data_6neo_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 6neo _Structure_validation_residue.Date_analyzed 2019-02-15 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' B' B ' 14' ' ' TYR . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.123 0 CA-C-O 120.862 0.363 . . . . 253.97 111.041 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -72.06 -20.33 61.69 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 112.566 0.58 . . . . 283.5 112.566 -178.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.53 -33.77 69.47 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.203 -0.599 . . . . 277.04 111.655 178.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . . . -72.14 -26.05 61.95 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 120.434 -0.507 . . . . 269.76 111.522 177.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' ASP . . . . . 0.474 ' OD1' ' OG ' ' B' ' 28' ' ' SER . 76.3 m-20 -69.0 -47.11 66.32 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.537 -0.465 . . . . 283.5 110.874 175.291 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . . . -65.31 -30.03 70.84 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.37 -0.532 . . . . 279.28 111.321 175.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . . . -73.58 -29.01 62.14 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.449 -0.5 . . . . 271.92 111.468 175.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' MET . . . . . . . . . . . . . . . -89.62 -11.79 41.57 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 112.733 0.642 . . . . 263.87 112.733 174.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . . . -78.64 -16.21 57.61 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 112.756 0.65 . . . . 263.11 112.756 179.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' THR . . . . . 0.406 ' OG1' ' O ' ' B' ' 231' ' ' PHE . 7.3 t -80.37 3.84 19.89 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 112.778 0.658 . . . . 258.25 112.778 178.351 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -127.34 12.41 7.02 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 112.292 0.479 . . . . 298.25 112.292 178.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 74.07 18.74 79.77 Favored Glycine 0 N--CA 1.447 -0.578 0 N-CA-C 115.123 0.809 . . . . 303.43 115.123 179.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . . . -109.99 114.58 47.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 N-CA-C 107.633 -1.247 . . . . 277.97 107.633 -178.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 54.6 t0 -87.52 104.38 16.42 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 107.821 -1.178 . . . . 286.05 107.821 176.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' SER . . . . . 0.474 ' OG ' ' OD1' ' B' ' 18' ' ' ASP . 58.2 p -83.64 -31.5 26.17 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 112.547 0.573 . . . . 288.39 112.547 -173.419 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' GLN . . . . . . . . . . . . . 69.9 mm-40 57.41 38.82 28.44 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 121.337 0.589 . . . . 267.56 111.086 -176.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . . . -72.62 -37.78 57.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 CA-C-N 116.087 -0.506 . . . . 276.13 110.605 -179.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.03 -28.51 69.54 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.186 -0.605 . . . . 281.92 111.357 177.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -84.35 -30.55 25.38 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 120.767 -0.373 . . . . 282.7 111.821 174.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . . . -77.78 -33.06 52.78 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 112.081 0.4 . . . . 279.32 112.081 178.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.19 -38.25 85.04 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.213 -0.595 . . . . 278.62 111.034 176.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.46 -7.64 58.57 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 112.681 0.623 . . . . 316.03 112.681 175.413 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 48.1 t -78.02 0.75 23.27 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 112.925 0.713 . . . . 330.43 112.925 178.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . . . 59.1 37.11 24.29 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.41 0.624 . . . . 348.3 111.319 177.786 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' ALA . . . . . . . . . . . . . . . -83.44 150.56 25.96 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.578 0.751 . . . . 334.39 110.343 177.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 -67.12 166.68 13.45 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 122.019 0.914 . . . . 346.71 110.713 -179.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.41 -30.7 71.12 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 115.24 -0.891 . . . . 308.24 111.766 -179.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.85 -35.12 91.53 Favored Glycine 0 C--N 1.335 0.51 0 C-N-CA 120.058 -1.068 . . . . 305.04 112.654 178.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 89.5 m -79.5 -37.32 36.98 Favored 'General case' 0 C--O 1.237 0.399 0 O-C-N 122.28 -0.541 . . . . 318.07 111.434 177.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . . . -66.51 -37.92 86.09 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.44 -0.504 . . . . 284.23 111.283 179.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 45.2 m-20 -67.97 -36.6 80.33 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.281 -0.568 . . . . 286.14 111.298 178.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -71.26 -36.51 71.77 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.387 -0.525 . . . . 289.69 111.435 -179.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.69 -41.5 75.34 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.279 -0.568 . . . . 277.62 111.239 179.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' LEU . . . . . . . . . . . . . . . -70.51 -26.53 63.63 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.303 -0.559 . . . . 246.19 111.635 178.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' THR . . . . . . . . . . . . . 32.0 m -78.33 -40.97 35.0 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.682 -0.407 . . . . 271.23 111.544 179.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . . . -71.27 -17.48 62.48 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 112.533 0.568 . . . . 264.46 112.533 -178.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 66.1 m -89.59 -36.53 15.26 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 112.324 0.49 . . . . 276.12 112.324 -179.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . . . -69.08 -31.16 69.69 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.061 -0.656 . . . . 235.81 111.41 175.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . . . -67.46 -44.25 79.09 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.473 -0.491 . . . . 252.97 111.054 175.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . . . -69.87 -20.34 63.4 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.685 -0.406 . . . . 272.64 112.02 174.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -82.69 -40.81 20.15 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 117.905 0.32 . . . . 253.1 111.353 175.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . . . -64.01 -29.44 70.6 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.383 -0.527 . . . . 239.26 111.523 178.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' GLY . . . . . . . . . . . . . . . -74.96 -20.32 79.5 Favored Glycine 0 C--N 1.336 0.56 0 C-N-CA 120.88 -0.676 . . . . 268.28 114.205 175.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . . . -99.58 -8.39 24.57 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 117.696 0.748 . . . . 244.29 113.001 176.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' TRP . . . . . . . . . . . . . 11.0 m0 -85.14 -15.7 42.93 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 112.9 0.704 . . . . 288.29 112.9 -179.177 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 73.94 16.03 79.54 Favored Glycine 0 N--CA 1.446 -0.673 0 CA-C-O 119.101 -0.833 . . . . 246.19 115.126 -176.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . . . -69.28 -22.71 63.8 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 118.582 1.191 . . . . 230.08 111.968 -179.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 71.61 19.58 77.96 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.576 -0.821 . . . . 254.15 114.645 -178.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . . . -88.17 28.03 1.13 Allowed 'General case' 0 C--O 1.239 0.528 0 CA-C-N 117.969 0.884 . . . . 261.47 112.635 178.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' HIS . . . . . . . . . . . . . . . -64.49 -27.04 68.71 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.502 -0.479 . . . . 250.56 111.609 178.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 51.6 p-80 -69.87 -15.91 63.16 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 112.18 0.437 . . . . 246.85 112.18 175.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . . . -95.55 149.77 21.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.275 0.559 . . . . 241.04 110.229 177.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' ARG . . . . . . . . . . . . . . . -89.94 98.38 11.74 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 108.291 -1.003 . . . . 284.24 108.291 -179.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' HIS . . . . . . . . . . . . . . . -80.43 134.67 36.03 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.349 -0.387 . . . . 299.83 110.289 -178.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' GLU . . . . . . . . . . . . . . . -148.82 163.11 38.35 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 109.044 -0.724 . . . . 293.05 109.044 179.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -148.04 142.25 26.13 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.417 -0.81 . . . . 299.33 109.166 -179.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . . . -152.21 144.84 24.22 Favored 'General case' 0 C--O 1.234 0.237 0 N-CA-C 109.272 -0.64 . . . . 317.24 109.272 -179.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . . . -83.39 133.61 34.93 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 115.611 -0.722 . . . . 327.7 109.896 178.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' THR . . . . . 0.416 ' N ' ' O ' ' B' ' 76' ' ' ASP . 31.0 p -87.95 155.93 19.59 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.686 0.755 . . . . 346.93 110.791 -177.877 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -71.85 -11.39 60.78 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.311 -0.859 . . . . 345.02 112.565 176.048 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' ASP . . . . . . . . . . . . . 33.2 t0 -77.13 2.48 15.11 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 112.603 0.594 . . . . 346.04 112.603 175.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 86.33 15.09 64.97 Favored Glycine 0 N--CA 1.447 -0.614 0 CA-C-O 119.184 -0.786 . . . . 359.38 114.853 -175.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' ASP . . . . . 0.451 ' OD2' ' OG ' ' B' ' 90' ' ' SER . 25.7 t0 -125.25 173.43 8.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 118.247 1.024 . . . . 349.21 109.482 -176.999 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' ILE . . . . . 0.469 ' O ' ' N ' ' B' ' 89' ' ' VAL . . . -121.46 126.81 75.34 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 N-CA-C 108.128 -1.064 . . . . 336.18 108.128 177.192 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . . . -108.46 138.61 44.47 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 122.739 0.415 . . . . 317.59 110.144 -177.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . . . -84.58 147.93 5.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 108.695 -0.854 . . . . 297.99 108.695 176.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -128.78 140.05 51.9 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 109.424 -0.584 . . . . 295.67 109.424 -177.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . . . -146.02 103.78 3.77 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 107.784 -1.191 . . . . 276.73 107.784 -179.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . . . 59.63 28.04 17.38 Favored 'General case' 0 C--O 1.233 0.23 0 O-C-N 123.638 0.586 . . . . 256.19 112.143 176.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 110.16 -37.71 3.64 Favored Glycine 0 N--CA 1.45 -0.429 0 N-CA-C 115.151 0.82 . . . . 250.97 115.151 173.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . . . -93.76 133.31 28.11 Favored Pre-proline 0 C--O 1.238 0.479 0 CA-C-N 117.1 0.45 . . . . 302.66 110.267 -175.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo -70.21 135.08 28.51 Favored 'Trans proline' 0 C--N 1.331 -0.35 0 C-N-CA 120.4 0.734 . . . . 282.23 110.204 179.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . . . -95.94 -54.41 3.33 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.269 -0.423 . . . . 290.27 111.478 179.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -155.52 -178.87 7.59 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.426 -0.953 . . . . 297.23 108.426 -178.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . . . -120.38 168.5 11.23 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.536 -0.756 . . . . 313.66 109.712 179.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' VAL . . . . . 0.469 ' N ' ' O ' ' B' ' 77' ' ' ILE . . . -75.3 -45.85 39.88 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 CA-C-N 115.291 -0.868 . . . . 334.18 110.722 -176.031 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' SER . . . . . 0.451 ' OG ' ' OD2' ' B' ' 76' ' ' ASP . 97.4 p -70.49 -2.74 14.9 Favored 'General case' 0 C--O 1.237 0.432 0 N-CA-C 112.973 0.731 . . . . 324.75 112.973 -179.122 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . . . -85.63 12.09 9.47 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 112.851 0.686 . . . . 314.08 112.851 177.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.8 158.28 31.79 Favored Glycine 0 N--CA 1.446 -0.646 0 CA-C-O 122.364 0.98 . . . . 300.94 112.766 177.91 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . . . -78.91 -8.02 58.49 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 113.008 0.744 . . . . 292.04 113.008 179.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . -90.77 -22.66 32.81 Favored Glycine 0 N--CA 1.45 -0.432 0 CA-C-N 118.369 0.531 . . . . 290.8 112.885 178.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -72.17 -36.74 69.35 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.429 -0.509 . . . . 276.99 111.304 179.136 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . . . -70.21 -30.72 67.89 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.369 -0.532 . . . . 260.54 111.655 178.24 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' ALA . . . . . . . . . . . . . . . -70.87 -37.16 73.07 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.471 -0.492 . . . . 280.49 111.273 179.503 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . . . -75.79 -3.93 37.74 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 112.889 0.7 . . . . 242.88 112.889 176.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -98.64 -39.35 8.73 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 112.957 0.725 . . . . 246.13 112.957 178.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . . . -85.77 -11.99 52.14 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 112.95 0.722 . . . . 245.5 112.95 177.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.84 -46.12 65.41 Favored Pre-proline 0 C--O 1.246 0.894 0 CA-C-O 118.511 -0.756 . . . . 246.09 112.555 177.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -64.63 -24.71 62.42 Favored 'Trans proline' 0 C--O 1.237 0.443 0 CA-C-N 121.524 1.58 . . . . 254.75 113.531 177.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . . . -84.01 2.11 40.55 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 112.683 0.623 . . . . 260.58 112.683 175.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' GLN . . . . . . . . . . . . . . . -115.01 141.38 48.08 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 123.163 0.585 . . . . 256.85 110.021 -179.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' ALA . . . . . . . . . . . . . . . -125.73 107.76 10.86 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 108.334 -0.988 . . . . 261.69 108.334 179.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' LEU . . . . . . . . . . . . . . . -105.56 141.23 37.39 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 122.744 0.418 . . . . 238.49 110.07 -179.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 33.1 p-10 -84.61 -162.85 0.73 Allowed 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.044 -0.526 . . . . 281.64 110.434 177.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . . . -73.04 -15.99 61.5 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 112.472 0.545 . . . . 272.48 112.472 -179.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' ARG . . . . . . . . . . . . . . . -95.1 -16.46 22.63 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 113.191 0.812 . . . . 266.36 113.191 -179.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 103.69 1.41 46.34 Favored Glycine 0 N--CA 1.447 -0.62 0 CA-C-O 119.079 -0.845 . . . . 266.38 115.086 -178.029 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . . . -88.81 159.29 17.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 118.37 1.085 . . . . 281.69 110.674 -179.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 47.6 t -83.53 120.32 25.79 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.266 -0.879 . . . . 262.26 109.831 -178.503 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -71.93 -13.07 61.54 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 112.656 0.613 . . . . 246.41 112.656 176.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' TRP . . . . . . . . . . . . . 81.8 m95 -68.66 146.81 52.67 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.574 0.702 . . . . 251.75 110.743 179.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' ALA . . . . . . . . . . . . . . . -88.19 132.81 34.21 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.498 -0.774 . . . . 268.2 109.021 172.173 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -66.32 -32.58 74.07 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.197 -0.601 . . . . 268.65 111.92 -177.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' LEU . . . . . . . . . . . . . . . -76.68 -23.72 53.21 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 112.783 0.66 . . . . 245.18 112.783 -179.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' GLY . . . . . . . . . . . . . . . 103.82 -142.41 15.49 Favored Glycine 0 N--CA 1.448 -0.518 0 CA-C-N 118.174 0.443 . . . . 284.75 112.726 -177.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' GLU . . . . . . . . . . . . . . . -72.66 130.37 40.39 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.958 0.409 . . . . 302.88 110.354 179.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 157.82 -154.75 25.81 Favored Glycine 0 N--CA 1.45 -0.383 0 N-CA-C 110.123 -1.191 . . . . 269.18 110.123 -179.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -102.04 147.06 27.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.953 -0.623 . . . . 239.14 110.295 176.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' ARG . . . . . . . . . . . . . . . -132.46 120.36 21.84 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.441 -0.948 . . . . 245.18 108.441 176.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -68.87 138.36 90.32 Favored Pre-proline 0 C--O 1.236 0.369 0 C-N-CA 120.297 -0.561 . . . . 239.98 109.894 177.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.26 164.43 35.65 Favored 'Trans proline' 0 C--N 1.33 -0.399 0 CA-C-O 122.117 0.799 . . . . 261.56 111.796 -177.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -69.8 -6.2 54.77 Favored Glycine 0 N--CA 1.45 -0.396 0 CA-C-N 114.829 -1.078 . . . . 247.15 114.414 175.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -81.78 -2.86 52.26 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 117.923 0.861 . . . . 287.62 112.874 179.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . . . -73.72 135.12 78.15 Favored Pre-proline 0 C--O 1.236 0.344 0 CA-C-N 118.372 0.533 . . . . 292.51 110.519 -177.247 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -68.43 167.88 21.18 Favored 'Trans proline' 0 C--N 1.331 -0.356 0 CA-C-O 122.287 0.87 . . . . 281.73 110.994 177.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . . . -72.17 -15.75 61.97 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 114.924 -1.034 . . . . 255.94 112.271 177.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -70.06 -48.36 58.17 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.625 -0.43 . . . . 244.48 111.119 178.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . . . -71.17 -10.94 60.6 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 112.712 0.634 . . . . 240.44 112.712 178.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' LEU . . . . . . . . . . . . . . . -83.57 -36.87 23.64 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 118.28 0.491 . . . . 222.25 111.571 179.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . . . -62.53 -33.02 74.07 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.237 -0.585 . . . . 218.31 111.417 177.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 134' ' ' VAL . . . . . . . . . . . . . . . -68.37 -41.53 83.58 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 C-N-CA 120.487 -0.485 . . . . 232.76 110.357 176.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 135' ' ' LEU . . . . . . . . . . . . . . . -72.58 -5.95 40.77 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 112.599 0.592 . . . . 210.6 112.599 177.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . . . -103.93 -29.48 2.88 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 N-CA-C 109.399 -0.593 . . . . 203.69 109.399 178.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 137' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -99.98 -24.3 14.67 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 113.789 1.033 . . . . 248.32 113.789 -176.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 138' ' ' HIS . . . . . . . . . . . . . 89.2 m-70 -125.39 -6.76 7.0 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 114.508 1.299 . . . . 246.73 114.508 -171.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 139' ' ' ALA . . . . . 0.532 ' O ' ' NH1' ' B' ' 246' ' ' ARG . . . -99.05 167.75 10.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.927 0.87 . . . . 234.94 111.183 -175.034 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . . . -100.02 -80.7 0.47 Allowed 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.2 -0.909 . . . . 242.21 110.284 177.532 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 74.8 m-20 -109.35 126.56 53.53 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 109.51 -0.552 . . . . 242.78 109.51 178.381 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 142' ' ' PHE . . . . . . . . . . . . . . . -152.35 145.52 24.63 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 109.027 -0.731 . . . . 252.08 109.027 179.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . . . -137.32 140.02 41.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.738 -0.665 . . . . 259.62 109.337 179.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 71.9 p -109.69 158.22 18.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.603 0.716 . . . . 231.38 110.279 178.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 145' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -87.06 -163.9 0.99 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.116 -0.947 . . . . 256.72 108.859 175.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 146' ' ' TRP . . . . . . . . . . . . . 98.9 m95 -92.94 138.88 31.09 Favored 'General case' 0 C--O 1.234 0.247 0 O-C-N 121.647 -0.658 . . . . 258.81 111.094 -177.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 35.6 p -136.02 154.51 51.04 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.775 -0.648 . . . . 257.73 109.73 177.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -68.32 121.94 17.33 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.821 -0.627 . . . . 265.56 110.148 -177.076 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 149' ' ' GLY . . . . . . . . . . . . . . . -93.93 -158.61 33.79 Favored Glycine 0 N--CA 1.445 -0.703 0 CA-C-O 121.885 0.714 . . . . 274.37 112.774 -179.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 150' ' ' ARG . . . . . . . . . . . . . . . -70.24 135.71 49.26 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.168 0.509 . . . . 278.69 110.608 -179.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 70.97 -129.09 17.85 Favored Glycine 0 C--O 1.236 0.241 0 C-N-CA 120.024 -1.084 . . . . 264.98 110.571 -178.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 152' ' ' GLU . . . . . . . . . . . . . . . -105.92 23.99 13.08 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 112.305 0.484 . . . . 277.34 112.305 177.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 153' ' ' THR . . . . . . . . . . . . . 48.8 p -99.47 174.46 6.26 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 122.075 0.94 . . . . 272.41 110.782 -177.389 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 154' ' ' PHE . . . . . . . . . . . . . . . -128.38 169.25 14.49 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.027 -0.988 . . . . 253.23 108.937 176.447 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . . . -153.7 149.17 27.23 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.785 -0.643 . . . . 246.65 109.65 -178.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 156' ' ' ARG . . . . . . . . . . . . . . . -150.93 148.3 28.25 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 108.328 -0.99 . . . . 244.48 108.328 176.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 157' ' ' VAL . . . . . . . . . . . . . . . -133.81 149.97 31.2 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 109.422 -0.585 . . . . 217.54 109.422 -177.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 158' ' ' TRP . . . . . . . . . . . . . 27.9 p90 -159.14 158.35 32.66 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 108.387 -0.968 . . . . 264.62 108.387 175.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 49.2 ttp180 -137.81 125.8 22.76 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.414 -0.812 . . . . 229.99 109.515 -178.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . . . -125.17 118.51 26.23 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 108.673 -0.862 . . . . 240.41 108.673 -179.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . 69.02 -133.01 26.42 Favored Glycine 0 C--O 1.236 0.247 0 C-N-CA 119.591 -1.29 . . . . 241.46 110.202 -176.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . . . -99.34 23.47 9.23 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 112.523 0.564 . . . . 264.95 112.523 -179.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 163' ' ' THR . . . . . . . . . . . . . 47.8 p -128.26 130.7 48.3 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 109.344 -0.613 . . . . 241.99 109.344 -178.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 164' ' ' LEU . . . . . . . . . . . . . . . -106.48 135.92 47.14 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.476 -0.564 . . . . 227.25 109.476 176.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . . . -121.98 138.74 54.31 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 116.221 -0.445 . . . . 227.4 110.175 -176.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 166' ' ' VAL . . . . . . . . . . . . . . . -128.93 125.48 63.02 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 N-CA-C 107.954 -1.128 . . . . 244.81 107.954 176.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 167' ' ' GLU . . . . . . . . . . . . . . . -124.56 87.49 2.73 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 109.276 -0.638 . . . . 255.71 109.276 -175.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . . . -77.88 129.81 37.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 N-CA-C 108.37 -0.974 . . . . 253.71 108.37 171.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 169' ' ' ALA . . . . . . . . . . . . . . . -133.39 142.27 48.28 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.158 0.504 . . . . 284.14 111.09 -171.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 170' ' ' ARG . . . . . . . . . . . . . . . -125.87 100.19 31.12 Favored Pre-proline 0 C--O 1.24 0.602 0 N-CA-C 107.009 -1.478 . . . . 295.13 107.009 170.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 171' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -63.17 131.76 33.68 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 120.103 0.535 . . . . 293.33 112.065 -170.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 172' ' ' ALA . . . . . . . . . . . . . . . -159.63 116.34 2.58 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 108.193 -1.04 . . . . 289.57 108.193 178.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 78.3 p -72.56 164.74 25.95 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.993 0.901 . . . . 281.68 110.579 -179.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -67.57 -33.28 74.72 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 115.399 -0.819 . . . . 282.99 111.662 179.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 175' ' ' GLU . . . . . . . . . . . . . . . -70.78 -42.39 70.44 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.45 -0.5 . . . . 277.82 111.223 178.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -65.26 -27.16 68.45 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.269 -0.573 . . . . 260.1 111.484 176.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 177' ' ' ALA . . . . . . . . . . . . . . . -72.67 -34.85 67.49 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.567 -0.453 . . . . 277.84 111.581 177.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 178' ' ' LEU . . . . . . . . . . . . . . . -71.5 -29.23 64.57 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.198 -0.601 . . . . 288.07 111.566 177.381 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 179' ' ' SER . . . . . . . . . . . . . 48.1 t -78.34 -28.58 47.3 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 112.163 0.431 . . . . 315.6 112.163 179.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . . . -72.04 -42.78 65.89 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 120.147 -0.621 . . . . 287.61 111.152 177.542 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -69.04 -21.82 64.08 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 112.192 0.441 . . . . 287.89 112.192 178.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 182' ' ' ALA . . . . . . . . . . . . . . . -76.94 -32.0 57.02 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 118.047 0.385 . . . . 314.63 111.975 177.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . . . -77.26 -22.53 51.99 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 112.444 0.535 . . . . 295.96 112.444 176.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . . . -74.94 -41.92 58.68 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.544 -0.462 . . . . 320.05 111.232 178.407 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 185' ' ' VAL . . . . . . . . . . . . . . . -74.1 -27.23 21.79 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 C-N-CA 120.136 -0.626 . . . . 314.25 110.539 177.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . . . -75.79 -33.95 27.08 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 O-C-N 121.933 -0.479 . . . . 315.67 111.046 178.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -75.9 -24.46 55.62 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.055 -0.658 . . . . 301.99 111.857 178.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 188' ' ' SER . . . . . . . . . . . . . 86.2 p -81.51 8.06 10.47 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.937 0.718 . . . . 305.56 112.937 179.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . . . -81.83 112.59 19.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 N-CA-C 108.28 -1.007 . . . . 312.24 108.28 -179.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 190' ' ' LYS . . . . . . . . . . . . . 46.5 mmtm -71.41 -27.47 63.33 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.317 -0.553 . . . . 322.92 111.548 177.02 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 191' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -67.34 108.42 2.76 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.809 -0.811 . . . . 346.25 108.809 176.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 192' ' ' ARG . . . . . . . . . . . . . . . -70.67 -26.54 63.49 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.505 -0.478 . . . . 330.1 111.919 -176.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 193' ' ' ALA . . . . . . . . . . . . . . . -72.43 -44.17 62.79 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.298 -0.561 . . . . 337.81 111.324 179.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 194' ' ' PHE . . . . . . . . . . . . . . . -73.07 -30.84 63.99 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.355 -0.538 . . . . 345.25 111.557 177.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 195' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -67.24 -34.71 78.03 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.561 -0.455 . . . . 330.15 111.084 176.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 196' ' ' ARG . . . . . . . . . . . . . 5.8 ttm-85 -72.43 -33.66 67.26 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.378 -0.529 . . . . 325.79 111.462 176.275 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 197' ' ' GLU . . . . . . . . . . . . . . . -68.48 -39.69 81.27 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.55 -0.46 . . . . 322.9 111.3 -179.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 198' ' ' LEU . . . . . . . . . . . . . . . -70.86 -30.13 66.44 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.202 -0.599 . . . . 334.54 111.459 176.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 199' ' ' MET . . . . . . . . . . . . . . . -73.16 -26.67 61.28 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.416 -0.514 . . . . 334.12 111.532 177.388 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 200' ' ' ARG . . . . . . . . . . . . . . . -75.25 -34.24 61.37 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 111.911 0.337 . . . . 338.6 111.911 177.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' ARG . . . . . . . . . . . . . . . -82.14 -14.54 55.54 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 112.586 0.588 . . . . 334.31 112.586 176.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 97.8 p -78.05 -14.73 59.39 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 112.803 0.668 . . . . 322.82 112.803 179.112 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 82.3 mt-10 -71.38 -18.96 62.33 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 112.375 0.509 . . . . 320.62 112.375 -179.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 204' ' ' LYS . . . . . . . . . . . . . 61.7 tttm -121.48 -56.8 1.87 Allowed 'General case' 0 C--O 1.235 0.303 0 CA-C-N 118.163 0.438 . . . . 317.09 111.877 -178.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . . . -76.22 -19.32 58.48 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 112.901 0.704 . . . . 317.84 112.901 -178.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 206' ' ' GLY . . . . . . . . . . . . . . . 101.09 178.41 29.02 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-O 122.555 1.086 . . . . 321.59 112.128 -178.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 207' ' ' MET . . . . . . . . . . . . . . . -71.59 -30.71 66.14 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 114.452 -0.874 . . . . 310.67 111.811 -179.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . . . -78.79 -45.84 20.09 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.761 -0.376 . . . . 321.47 111.482 -178.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 209' ' ' GLY . . . . . . . . . . . . . . . -71.49 -14.26 74.64 Favored Glycine 0 C--N 1.335 0.488 0 C-N-CA 120.856 -0.688 . . . . 332.91 114.252 -178.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -83.81 -40.69 18.41 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 117.821 0.811 . . . . 337.6 111.715 -179.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . . . -69.83 -20.04 63.45 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 112.304 0.483 . . . . 315.62 112.304 178.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . . . -99.81 -5.09 29.14 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 113.066 0.765 . . . . 364.4 113.066 -179.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 213' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.288 0 CA-C-N 118.353 0.524 . . . . 351.56 113.244 -179.653 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 . . . . . 0 CA--C 1.522 -0.111 0 CA-C-O 120.867 0.365 . . . . 209.34 110.84 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 223' ' ' LEU . . . . . . . . . . . . . . . -96.95 32.77 2.04 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.93 -0.577 . . . . 256.68 112.275 -179.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 224' ' ' ALA . . . . . . . . . . . . . . . -71.29 -30.31 66.09 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.231 -0.587 . . . . 280.25 111.538 178.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 225' ' ' GLN . . . . . . . . . . . . . . . -87.58 -2.81 58.87 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 112.972 0.73 . . . . 317.25 112.972 178.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 226' ' ' LEU . . . . . . . . . . . . . . . -80.51 135.07 53.59 Favored Pre-proline 0 C--O 1.234 0.255 0 CA-C-N 118.412 0.551 . . . . 280.71 110.312 179.655 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 227' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -69.7 -23.96 30.48 Favored 'Trans proline' 0 C--O 1.237 0.453 0 N-CA-C 113.438 0.515 . . . . 265.86 113.438 -179.514 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 228' ' ' GLU . . . . . . . . . . . . . . . -70.8 -12.9 61.83 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 112.873 0.694 . . . . 273.76 112.873 -179.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 229' ' ' ALA . . . . . . . . . . . . . . . -90.38 6.8 41.69 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 112.832 0.678 . . . . 284.69 112.832 179.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 230' ' ' HIS . . . . . . . . . . . . . . . -128.76 -42.57 1.42 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.938 0.718 . . . . 254.36 112.938 -179.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 231' ' ' PHE . . . . . 0.406 ' O ' ' OG1' ' B' ' 23' ' ' THR . . . -120.06 129.31 54.16 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.47 -0.567 . . . . 271.58 109.47 -179.028 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 232' ' ' THR . . . . . . . . . . . . . . . -130.27 165.29 22.74 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.507 0.67 . . . . 255.67 109.527 179.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 233' ' ' VAL . . . . . . . . . . . . . . . -83.9 122.83 38.29 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 N-CA-C 108.65 -0.87 . . . . 238.94 108.65 179.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 234' ' ' GLN . . . . . . . . . . . . . . . -133.18 -3.57 3.1 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 114.44 1.274 . . . . 243.73 114.44 178.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 235' ' ' ALA . . . . . . . . . . . . . . . -156.91 169.26 25.19 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 119.375 0.988 . . . . 249.17 108.847 179.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 236' ' ' PHE . . . . . . . . . . . . . . . -136.49 137.59 40.5 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.431 -0.804 . . . . 240.69 109.292 176.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 237' ' ' VAL . . . . . . . . . . . . . . . -112.42 112.24 39.61 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 N-CA-C 108.059 -1.089 . . . . 230.09 108.059 -175.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 238' ' ' GLN . . . . . . . . . . . . . . . -111.38 129.26 56.07 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 108.739 -0.838 . . . . 250.73 108.739 174.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 239' ' ' THR . . . . . . . . . . . . . 74.3 p -116.89 159.86 21.77 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 121.542 0.687 . . . . 277.57 110.802 -173.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . . . -154.45 138.85 16.73 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.152 -0.931 . . . . 240.85 108.812 177.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 241' ' ' SER . . . . . . . . . . . . . 88.8 p -135.11 162.21 33.13 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.633 0.73 . . . . 260.44 110.07 -176.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 242' ' ' GLY . . . . . . . . . . . . . . . 84.52 -140.14 18.66 Favored Glycine 0 N--CA 1.449 -0.455 0 CA-C-N 115.221 -0.899 . . . . 249.07 112.635 -179.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 243' ' ' ALA . . . . . . . . . . . . . . . -80.05 -20.87 44.23 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.68 0.622 . . . . 275.68 112.68 177.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 244' ' ' ALA . . . . . . . . . . . . . . . -68.34 -26.8 65.79 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.437 -0.505 . . . . 260.8 111.532 177.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -73.15 5.94 3.12 Favored 'General case' 0 C--O 1.238 0.491 0 N-CA-C 112.968 0.729 . . . . 251.27 112.968 177.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 246' ' ' ARG . . . . . 0.532 ' NH1' ' O ' ' B' ' 139' ' ' ALA . 33.9 ttm-85 -126.28 -17.86 5.09 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 113.767 1.025 . . . . 245.12 113.767 177.786 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -76.07 125.62 29.48 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 119.144 0.884 . . . . 267.3 109.449 178.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 248' ' ' ALA . . . . . . . . . . . . . . . -70.79 -23.67 62.43 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 112.53 0.567 . . . . 269.87 112.53 -179.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 249' ' ' GLU . . . . . . . . . . . . . . . -71.76 -39.15 70.18 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 120.08 -0.648 . . . . 281.87 111.197 179.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 250' ' ' GLU . . . . . . . . . . . . . 17.6 tt0 -77.8 -24.48 48.78 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 112.259 0.466 . . . . 259.29 112.259 178.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 251' ' ' TYR . . . . . . . . . . . . . . . -66.46 -32.07 73.21 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 120.098 -0.641 . . . . 237.57 111.2 174.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 252' ' ' ARG . . . . . . . . . . . . . . . -72.94 -15.27 61.57 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 112.025 0.38 . . . . 242.62 112.025 174.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 253' ' ' ALA . . . . . . . . . . . . . . . -90.64 -19.38 23.72 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 113.026 0.75 . . . . 258.2 113.026 177.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -85.86 -29.5 23.66 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 118.273 0.488 . . . . 252.28 112.023 178.236 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 255' ' ' LEU . . . . . . . . . . . . . . . -66.24 -35.59 80.83 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.614 -0.435 . . . . 252.52 111.27 177.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . . . -77.18 -33.33 56.44 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.279 -0.569 . . . . 272.33 111.563 173.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 257' ' ' THR . . . . . . . . . . . . . . . -68.26 -22.58 64.75 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 112.013 0.375 . . . . 269.04 112.013 175.074 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 258' ' ' ALA . . . . . . . . . . . . . . . -90.59 -31.48 16.67 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 112.433 0.531 . . . . 277.14 112.433 174.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 259' ' ' ALA . . . . . . . . . . . . . . . -74.35 -28.93 61.36 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.341 -0.544 . . . . 286.69 111.464 176.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -78.99 -35.09 43.47 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.714 -0.394 . . . . 305.05 111.353 174.56 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 261' ' ' ALA . . . . . . . . . . . . . . . -71.09 -15.43 62.52 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.493 -0.483 . . . . 292.02 111.717 176.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 262' ' ' LEU . . . . . . . . . . . . . . . -84.32 -41.6 16.64 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 125.031 1.332 . . . . 304.82 112.165 174.259 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 263' ' ' GLU . . . . . . . . . . . . . . . -67.14 -35.53 79.92 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.317 -0.553 . . . . 301.12 111.258 177.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . . . -73.54 -41.67 62.69 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 111.72 0.266 . . . . 295.69 111.72 177.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 265' ' ' TYR . . . . . . . . . . . . . . . -69.12 -44.19 72.88 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.21 -0.596 . . . . 302.61 111.151 178.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 266' ' ' GLN . . . . . . . . . . . . . . . -69.96 -24.74 63.38 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 120.572 -0.451 . . . . 286.53 112.126 176.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 267' ' ' GLY . . . . . . . . . . . . . . . -80.48 -18.12 71.85 Favored Glycine 0 C--N 1.336 0.545 0 C-N-CA 120.804 -0.712 . . . . 279.98 114.353 175.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 268' ' ' VAL . . . . . . . . . . . . . . . -92.2 -24.46 5.39 Favored 'Isoleucine or valine' 0 C--O 1.239 0.551 0 CA-C-N 117.677 0.739 . . . . 289.1 112.768 177.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 269' ' ' THR . . . . . . . . . . . . . 41.2 p -76.08 -34.76 59.56 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 118.387 0.539 . . . . 304.49 111.519 177.092 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 270' ' ' THR . . . . . . . . . . . . . 9.5 t -69.82 -16.41 63.27 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 112.183 0.438 . . . . 288.28 112.183 174.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 271' ' ' ARG . . . . . . . . . . . . . . . -89.66 -37.4 14.65 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 118.366 0.53 . . . . 289.7 111.825 175.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 272' ' ' GLN . . . . . . . . . . . . . . . -70.16 -25.69 63.57 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.24 -0.584 . . . . 281.49 111.55 176.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . . . -77.8 -27.2 50.08 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 111.915 0.339 . . . . 252.24 111.915 176.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 274' ' ' SER . . . . . . . . . . . . . 75.3 m -74.42 -24.67 59.13 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.24 -0.584 . . . . 261.61 111.531 177.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . . . -77.86 -11.31 59.88 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 112.933 0.716 . . . . 243.93 112.933 178.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 276' ' ' VAL . . . . . . . . . . . . . . . -100.31 -45.69 11.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 118.347 0.521 . . . . 254.34 111.51 179.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 277' ' ' LEU . . . . . . . . . . . . . . . -73.1 -7.58 51.96 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 112.786 0.662 . . . . 253.69 112.786 179.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 278' ' ' ARG . . . . . . . . . . . . . 42.2 ttp85 -66.45 -33.46 75.75 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 118.235 0.47 . . . . 281.12 111.666 178.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 279' ' ' HIS . . . . . . . . . . . . . 5.6 m-70 . . . . . 0 C--N 1.33 -0.281 0 CA-C-O 120.791 0.329 . . . . 264.16 111.354 179.792 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 14' ' ' TYR . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.123 0 CA-C-O 120.862 0.363 . . . . 253.97 111.041 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -72.06 -20.33 61.69 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 112.566 0.58 . . . . 283.5 112.566 -178.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.53 -33.77 69.47 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.203 -0.599 . . . . 277.04 111.655 178.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . . . -72.14 -26.05 61.95 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 120.434 -0.507 . . . . 269.76 111.522 177.578 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' ASP . . . . . 0.446 ' OD1' ' OG ' ' B' ' 28' ' ' SER . 76.3 m-20 -69.0 -47.11 66.32 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.537 -0.465 . . . . 283.5 110.874 175.291 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . . . -65.31 -30.03 70.84 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.37 -0.532 . . . . 279.28 111.321 175.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . . . -73.58 -29.01 62.14 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.449 -0.5 . . . . 271.92 111.468 175.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' MET . . . . . . . . . . . . . . . -89.62 -11.79 41.57 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 112.733 0.642 . . . . 263.87 112.733 174.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . . . -78.64 -16.21 57.61 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 112.756 0.65 . . . . 263.11 112.756 179.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' THR . . . . . 0.704 HG23 ' HE1' ' B' ' 58' ' ' TRP . 7.3 t -80.37 3.84 19.89 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 112.778 0.658 . . . . 258.25 112.778 178.351 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -127.34 12.41 7.02 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 112.292 0.479 . . . . 298.25 112.292 178.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 74.07 18.74 79.77 Favored Glycine 0 N--CA 1.447 -0.578 0 N-CA-C 115.123 0.809 . . . . 303.43 115.123 179.762 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . . . -109.99 114.58 47.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 N-CA-C 107.633 -1.247 . . . . 277.97 107.633 -178.364 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 54.6 t0 -87.52 104.38 16.42 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 107.821 -1.178 . . . . 286.05 107.821 176.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' SER . . . . . 0.446 ' OG ' ' OD1' ' B' ' 18' ' ' ASP . 58.2 p -83.64 -31.5 26.17 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 112.547 0.573 . . . . 288.39 112.547 -173.419 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 29' ' ' GLN . . . . . . . . . . . . . 69.9 mm-40 57.41 38.82 28.44 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 121.337 0.589 . . . . 267.56 111.086 -176.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . . . -72.62 -37.78 57.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 CA-C-N 116.087 -0.506 . . . . 276.13 110.605 -179.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.03 -28.51 69.54 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.186 -0.605 . . . . 281.92 111.357 177.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -84.35 -30.55 25.38 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 120.767 -0.373 . . . . 282.7 111.821 174.606 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . . . -77.78 -33.06 52.78 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 112.081 0.4 . . . . 279.32 112.081 178.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.19 -38.25 85.04 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.213 -0.595 . . . . 278.62 111.034 176.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.46 -7.64 58.57 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 112.681 0.623 . . . . 316.03 112.681 175.413 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 48.1 t -78.02 0.75 23.27 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 112.925 0.713 . . . . 330.43 112.925 178.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . . . 59.1 37.11 24.29 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.41 0.624 . . . . 348.3 111.319 177.786 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' ALA . . . . . . . . . . . . . . . -83.44 150.56 25.96 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.578 0.751 . . . . 334.39 110.343 177.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 -67.12 166.68 13.45 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 122.019 0.914 . . . . 346.71 110.713 -179.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.41 -30.7 71.12 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 115.24 -0.891 . . . . 308.24 111.766 -179.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.85 -35.12 91.53 Favored Glycine 0 C--N 1.335 0.51 0 C-N-CA 120.058 -1.068 . . . . 305.04 112.654 178.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 89.5 m -79.5 -37.32 36.98 Favored 'General case' 0 C--O 1.237 0.399 0 O-C-N 122.28 -0.541 . . . . 318.07 111.434 177.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . . . -66.51 -37.92 86.09 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.44 -0.504 . . . . 284.23 111.283 179.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 45.2 m-20 -67.97 -36.6 80.33 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.281 -0.568 . . . . 286.14 111.298 178.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -71.26 -36.51 71.77 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.387 -0.525 . . . . 289.69 111.435 -179.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.69 -41.5 75.34 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.279 -0.568 . . . . 277.62 111.239 179.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' LEU . . . . . . . . . . . . . . . -70.51 -26.53 63.63 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.303 -0.559 . . . . 246.19 111.635 178.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' THR . . . . . 0.479 HG23 ' HA ' ' B' ' 68' ' ' GLU . 32.0 m -78.33 -40.97 35.0 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.682 -0.407 . . . . 271.23 111.544 179.946 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . . . -71.27 -17.48 62.48 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 112.533 0.568 . . . . 264.46 112.533 -178.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 66.1 m -89.59 -36.53 15.26 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 112.324 0.49 . . . . 276.12 112.324 -179.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . . . -69.08 -31.16 69.69 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.061 -0.656 . . . . 235.81 111.41 175.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . . . -67.46 -44.25 79.09 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.473 -0.491 . . . . 252.97 111.054 175.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . . . -69.87 -20.34 63.4 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.685 -0.406 . . . . 272.64 112.02 174.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -82.69 -40.81 20.15 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 117.905 0.32 . . . . 253.1 111.353 175.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . . . -64.01 -29.44 70.6 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.383 -0.527 . . . . 239.26 111.523 178.036 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' GLY . . . . . . . . . . . . . . . -74.96 -20.32 79.5 Favored Glycine 0 C--N 1.336 0.56 0 C-N-CA 120.88 -0.676 . . . . 268.28 114.205 175.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . . . -99.58 -8.39 24.57 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 117.696 0.748 . . . . 244.29 113.001 176.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' TRP . . . . . 0.704 ' HE1' HG23 ' B' ' 23' ' ' THR . 11.0 m0 -85.14 -15.7 42.93 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 112.9 0.704 . . . . 288.29 112.9 -179.177 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 73.94 16.03 79.54 Favored Glycine 0 N--CA 1.446 -0.673 0 CA-C-O 119.101 -0.833 . . . . 246.19 115.126 -176.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . . . -69.28 -22.71 63.8 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 118.582 1.191 . . . . 230.08 111.968 -179.309 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 71.61 19.58 77.96 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.576 -0.821 . . . . 254.15 114.645 -178.121 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . . . -88.17 28.03 1.13 Allowed 'General case' 0 C--O 1.239 0.528 0 CA-C-N 117.969 0.884 . . . . 261.47 112.635 178.686 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' HIS . . . . . . . . . . . . . . . -64.49 -27.04 68.71 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.502 -0.479 . . . . 250.56 111.609 178.926 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 51.6 p-80 -69.87 -15.91 63.16 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 112.18 0.437 . . . . 246.85 112.18 175.366 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . . . -95.55 149.77 21.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.275 0.559 . . . . 241.04 110.229 177.695 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' ARG . . . . . . . . . . . . . . . -89.94 98.38 11.74 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 108.291 -1.003 . . . . 284.24 108.291 -179.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' HIS . . . . . . . . . . . . . . . -80.43 134.67 36.03 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.349 -0.387 . . . . 299.83 110.289 -178.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' GLU . . . . . 0.479 ' HA ' HG23 ' B' ' 48' ' ' THR . . . -148.82 163.11 38.35 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 109.044 -0.724 . . . . 293.05 109.044 179.393 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -148.04 142.25 26.13 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.417 -0.81 . . . . 299.33 109.166 -179.612 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . . . -152.21 144.84 24.22 Favored 'General case' 0 C--O 1.234 0.237 0 N-CA-C 109.272 -0.64 . . . . 317.24 109.272 -179.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . . . -83.39 133.61 34.93 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 115.611 -0.722 . . . . 327.7 109.896 178.483 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' THR . . . . . . . . . . . . . 31.0 p -87.95 155.93 19.59 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.686 0.755 . . . . 346.93 110.791 -177.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -71.85 -11.39 60.78 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.311 -0.859 . . . . 345.02 112.565 176.048 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' ASP . . . . . . . . . . . . . 33.2 t0 -77.13 2.48 15.11 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 112.603 0.594 . . . . 346.04 112.603 175.594 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 86.33 15.09 64.97 Favored Glycine 0 N--CA 1.447 -0.614 0 CA-C-O 119.184 -0.786 . . . . 359.38 114.853 -175.26 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -125.25 173.43 8.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 118.247 1.024 . . . . 349.21 109.482 -176.999 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' ILE . . . . . 0.433 ' O ' ' N ' ' B' ' 89' ' ' VAL . . . -121.46 126.81 75.34 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 N-CA-C 108.128 -1.064 . . . . 336.18 108.128 177.192 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . . . -108.46 138.61 44.47 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 122.739 0.415 . . . . 317.59 110.144 -177.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . . . -84.58 147.93 5.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 108.695 -0.854 . . . . 297.99 108.695 176.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -128.78 140.05 51.9 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 109.424 -0.584 . . . . 295.67 109.424 -177.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . . . -146.02 103.78 3.77 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 107.784 -1.191 . . . . 276.73 107.784 -179.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . . . 59.63 28.04 17.38 Favored 'General case' 0 C--O 1.233 0.23 0 O-C-N 123.638 0.586 . . . . 256.19 112.143 176.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 110.16 -37.71 3.64 Favored Glycine 0 N--CA 1.45 -0.429 0 N-CA-C 115.151 0.82 . . . . 250.97 115.151 173.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . . . -93.76 133.31 28.11 Favored Pre-proline 0 C--O 1.238 0.479 0 CA-C-N 117.1 0.45 . . . . 302.66 110.267 -175.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo -70.21 135.08 28.51 Favored 'Trans proline' 0 C--N 1.331 -0.35 0 C-N-CA 120.4 0.734 . . . . 282.23 110.204 179.118 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . . . -95.94 -54.41 3.33 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.269 -0.423 . . . . 290.27 111.478 179.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -155.52 -178.87 7.59 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.426 -0.953 . . . . 297.23 108.426 -178.026 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . . . -120.38 168.5 11.23 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.536 -0.756 . . . . 313.66 109.712 179.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' VAL . . . . . 0.433 ' N ' ' O ' ' B' ' 77' ' ' ILE . . . -75.3 -45.85 39.88 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 CA-C-N 115.291 -0.868 . . . . 334.18 110.722 -176.031 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 97.4 p -70.49 -2.74 14.9 Favored 'General case' 0 C--O 1.237 0.432 0 N-CA-C 112.973 0.731 . . . . 324.75 112.973 -179.122 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . . . -85.63 12.09 9.47 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 112.851 0.686 . . . . 314.08 112.851 177.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.8 158.28 31.79 Favored Glycine 0 N--CA 1.446 -0.646 0 CA-C-O 122.364 0.98 . . . . 300.94 112.766 177.91 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . . . -78.91 -8.02 58.49 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 113.008 0.744 . . . . 292.04 113.008 179.352 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . -90.77 -22.66 32.81 Favored Glycine 0 N--CA 1.45 -0.432 0 CA-C-N 118.369 0.531 . . . . 290.8 112.885 178.312 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -72.17 -36.74 69.35 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.429 -0.509 . . . . 276.99 111.304 179.136 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . . . -70.21 -30.72 67.89 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.369 -0.532 . . . . 260.54 111.655 178.24 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' ALA . . . . . . . . . . . . . . . -70.87 -37.16 73.07 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.471 -0.492 . . . . 280.49 111.273 179.503 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . . . -75.79 -3.93 37.74 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 112.889 0.7 . . . . 242.88 112.889 176.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -98.64 -39.35 8.73 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 112.957 0.725 . . . . 246.13 112.957 178.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . . . -85.77 -11.99 52.14 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 112.95 0.722 . . . . 245.5 112.95 177.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.84 -46.12 65.41 Favored Pre-proline 0 C--O 1.246 0.894 0 CA-C-O 118.511 -0.756 . . . . 246.09 112.555 177.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -64.63 -24.71 62.42 Favored 'Trans proline' 0 C--O 1.237 0.443 0 CA-C-N 121.524 1.58 . . . . 254.75 113.531 177.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . . . -84.01 2.11 40.55 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 112.683 0.623 . . . . 260.58 112.683 175.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 104' ' ' GLN . . . . . . . . . . . . . . . -115.01 141.38 48.08 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 123.163 0.585 . . . . 256.85 110.021 -179.53 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' ALA . . . . . . . . . . . . . . . -125.73 107.76 10.86 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 108.334 -0.988 . . . . 261.69 108.334 179.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' LEU . . . . . . . . . . . . . . . -105.56 141.23 37.39 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 122.744 0.418 . . . . 238.49 110.07 -179.036 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 33.1 p-10 -84.61 -162.85 0.73 Allowed 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.044 -0.526 . . . . 281.64 110.434 177.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . . . -73.04 -15.99 61.5 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 112.472 0.545 . . . . 272.48 112.472 -179.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 109' ' ' ARG . . . . . . . . . . . . . . . -95.1 -16.46 22.63 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 113.191 0.812 . . . . 266.36 113.191 -179.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 103.69 1.41 46.34 Favored Glycine 0 N--CA 1.447 -0.62 0 CA-C-O 119.079 -0.845 . . . . 266.38 115.086 -178.029 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . . . -88.81 159.29 17.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 118.37 1.085 . . . . 281.69 110.674 -179.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 47.6 t -83.53 120.32 25.79 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.266 -0.879 . . . . 262.26 109.831 -178.503 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 113' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -71.93 -13.07 61.54 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 112.656 0.613 . . . . 246.41 112.656 176.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' TRP . . . . . . . . . . . . . 81.8 m95 -68.66 146.81 52.67 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.574 0.702 . . . . 251.75 110.743 179.086 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 115' ' ' ALA . . . . . . . . . . . . . . . -88.19 132.81 34.21 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.498 -0.774 . . . . 268.2 109.021 172.173 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -66.32 -32.58 74.07 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.197 -0.601 . . . . 268.65 111.92 -177.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 117' ' ' LEU . . . . . . . . . . . . . . . -76.68 -23.72 53.21 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 112.783 0.66 . . . . 245.18 112.783 -179.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 118' ' ' GLY . . . . . . . . . . . . . . . 103.82 -142.41 15.49 Favored Glycine 0 N--CA 1.448 -0.518 0 CA-C-N 118.174 0.443 . . . . 284.75 112.726 -177.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 119' ' ' GLU . . . . . . . . . . . . . . . -72.66 130.37 40.39 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.958 0.409 . . . . 302.88 110.354 179.674 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 157.82 -154.75 25.81 Favored Glycine 0 N--CA 1.45 -0.383 0 N-CA-C 110.123 -1.191 . . . . 269.18 110.123 -179.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 121' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -102.04 147.06 27.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.953 -0.623 . . . . 239.14 110.295 176.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 122' ' ' ARG . . . . . . . . . . . . . . . -132.46 120.36 21.84 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.441 -0.948 . . . . 245.18 108.441 176.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -68.87 138.36 90.32 Favored Pre-proline 0 C--O 1.236 0.369 0 C-N-CA 120.297 -0.561 . . . . 239.98 109.894 177.451 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 124' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.26 164.43 35.65 Favored 'Trans proline' 0 C--N 1.33 -0.399 0 CA-C-O 122.117 0.799 . . . . 261.56 111.796 -177.34 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -69.8 -6.2 54.77 Favored Glycine 0 N--CA 1.45 -0.396 0 CA-C-N 114.829 -1.078 . . . . 247.15 114.414 175.185 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -81.78 -2.86 52.26 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 117.923 0.861 . . . . 287.62 112.874 179.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . . . -73.72 135.12 78.15 Favored Pre-proline 0 C--O 1.236 0.344 0 CA-C-N 118.372 0.533 . . . . 292.51 110.519 -177.247 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -68.43 167.88 21.18 Favored 'Trans proline' 0 C--N 1.331 -0.356 0 CA-C-O 122.287 0.87 . . . . 281.73 110.994 177.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . . . -72.17 -15.75 61.97 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 114.924 -1.034 . . . . 255.94 112.271 177.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -70.06 -48.36 58.17 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.625 -0.43 . . . . 244.48 111.119 178.682 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . . . -71.17 -10.94 60.6 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 112.712 0.634 . . . . 240.44 112.712 178.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 132' ' ' LEU . . . . . . . . . . . . . . . -83.57 -36.87 23.64 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 118.28 0.491 . . . . 222.25 111.571 179.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . . . -62.53 -33.02 74.07 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.237 -0.585 . . . . 218.31 111.417 177.682 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 134' ' ' VAL . . . . . . . . . . . . . . . -68.37 -41.53 83.58 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 C-N-CA 120.487 -0.485 . . . . 232.76 110.357 176.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 135' ' ' LEU . . . . . . . . . . . . . . . -72.58 -5.95 40.77 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 112.599 0.592 . . . . 210.6 112.599 177.067 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . . . -103.93 -29.48 2.88 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 N-CA-C 109.399 -0.593 . . . . 203.69 109.399 178.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 137' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -99.98 -24.3 14.67 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 113.789 1.033 . . . . 248.32 113.789 -176.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 138' ' ' HIS . . . . . . . . . . . . . 89.2 m-70 -125.39 -6.76 7.0 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 114.508 1.299 . . . . 246.73 114.508 -171.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -99.05 167.75 10.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.927 0.87 . . . . 234.94 111.183 -175.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . . . -100.02 -80.7 0.47 Allowed 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.2 -0.909 . . . . 242.21 110.284 177.532 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 74.8 m-20 -109.35 126.56 53.53 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 109.51 -0.552 . . . . 242.78 109.51 178.381 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 142' ' ' PHE . . . . . . . . . . . . . . . -152.35 145.52 24.63 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 109.027 -0.731 . . . . 252.08 109.027 179.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . . . -137.32 140.02 41.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.738 -0.665 . . . . 259.62 109.337 179.137 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 71.9 p -109.69 158.22 18.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.603 0.716 . . . . 231.38 110.279 178.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 145' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -87.06 -163.9 0.99 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.116 -0.947 . . . . 256.72 108.859 175.581 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 146' ' ' TRP . . . . . . . . . . . . . 98.9 m95 -92.94 138.88 31.09 Favored 'General case' 0 C--O 1.234 0.247 0 O-C-N 121.647 -0.658 . . . . 258.81 111.094 -177.825 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 35.6 p -136.02 154.51 51.04 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.775 -0.648 . . . . 257.73 109.73 177.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -68.32 121.94 17.33 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.821 -0.627 . . . . 265.56 110.148 -177.076 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 149' ' ' GLY . . . . . . . . . . . . . . . -93.93 -158.61 33.79 Favored Glycine 0 N--CA 1.445 -0.703 0 CA-C-O 121.885 0.714 . . . . 274.37 112.774 -179.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 150' ' ' ARG . . . . . . . . . . . . . . . -70.24 135.71 49.26 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.168 0.509 . . . . 278.69 110.608 -179.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 70.97 -129.09 17.85 Favored Glycine 0 C--O 1.236 0.241 0 C-N-CA 120.024 -1.084 . . . . 264.98 110.571 -178.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 152' ' ' GLU . . . . . . . . . . . . . . . -105.92 23.99 13.08 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 112.305 0.484 . . . . 277.34 112.305 177.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 153' ' ' THR . . . . . . . . . . . . . 48.8 p -99.47 174.46 6.26 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 122.075 0.94 . . . . 272.41 110.782 -177.389 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 154' ' ' PHE . . . . . . . . . . . . . . . -128.38 169.25 14.49 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.027 -0.988 . . . . 253.23 108.937 176.447 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . . . -153.7 149.17 27.23 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.785 -0.643 . . . . 246.65 109.65 -178.016 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 156' ' ' ARG . . . . . . . . . . . . . . . -150.93 148.3 28.25 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 108.328 -0.99 . . . . 244.48 108.328 176.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 157' ' ' VAL . . . . . . . . . . . . . . . -133.81 149.97 31.2 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 109.422 -0.585 . . . . 217.54 109.422 -177.461 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 158' ' ' TRP . . . . . . . . . . . . . 27.9 p90 -159.14 158.35 32.66 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 108.387 -0.968 . . . . 264.62 108.387 175.347 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 49.2 ttp180 -137.81 125.8 22.76 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.414 -0.812 . . . . 229.99 109.515 -178.782 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . . . -125.17 118.51 26.23 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 108.673 -0.862 . . . . 240.41 108.673 -179.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . 69.02 -133.01 26.42 Favored Glycine 0 C--O 1.236 0.247 0 C-N-CA 119.591 -1.29 . . . . 241.46 110.202 -176.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . . . -99.34 23.47 9.23 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 112.523 0.564 . . . . 264.95 112.523 -179.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 163' ' ' THR . . . . . . . . . . . . . 47.8 p -128.26 130.7 48.3 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 109.344 -0.613 . . . . 241.99 109.344 -178.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 164' ' ' LEU . . . . . . . . . . . . . . . -106.48 135.92 47.14 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.476 -0.564 . . . . 227.25 109.476 176.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . . . -121.98 138.74 54.31 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 116.221 -0.445 . . . . 227.4 110.175 -176.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 166' ' ' VAL . . . . . . . . . . . . . . . -128.93 125.48 63.02 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 N-CA-C 107.954 -1.128 . . . . 244.81 107.954 176.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 167' ' ' GLU . . . . . . . . . . . . . . . -124.56 87.49 2.73 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 109.276 -0.638 . . . . 255.71 109.276 -175.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . . . -77.88 129.81 37.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 N-CA-C 108.37 -0.974 . . . . 253.71 108.37 171.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 169' ' ' ALA . . . . . . . . . . . . . . . -133.39 142.27 48.28 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.158 0.504 . . . . 284.14 111.09 -171.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 170' ' ' ARG . . . . . . . . . . . . . . . -125.87 100.19 31.12 Favored Pre-proline 0 C--O 1.24 0.602 0 N-CA-C 107.009 -1.478 . . . . 295.13 107.009 170.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 171' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -63.17 131.76 33.68 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 120.103 0.535 . . . . 293.33 112.065 -170.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 172' ' ' ALA . . . . . . . . . . . . . . . -159.63 116.34 2.58 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 108.193 -1.04 . . . . 289.57 108.193 178.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 78.3 p -72.56 164.74 25.95 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.993 0.901 . . . . 281.68 110.579 -179.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -67.57 -33.28 74.72 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 115.399 -0.819 . . . . 282.99 111.662 179.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 175' ' ' GLU . . . . . . . . . . . . . . . -70.78 -42.39 70.44 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.45 -0.5 . . . . 277.82 111.223 178.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -65.26 -27.16 68.45 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.269 -0.573 . . . . 260.1 111.484 176.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 177' ' ' ALA . . . . . . . . . . . . . . . -72.67 -34.85 67.49 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.567 -0.453 . . . . 277.84 111.581 177.286 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 178' ' ' LEU . . . . . . . . . . . . . . . -71.5 -29.23 64.57 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.198 -0.601 . . . . 288.07 111.566 177.381 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 179' ' ' SER . . . . . . . . . . . . . 48.1 t -78.34 -28.58 47.3 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 112.163 0.431 . . . . 315.6 112.163 179.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . . . -72.04 -42.78 65.89 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 120.147 -0.621 . . . . 287.61 111.152 177.542 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -69.04 -21.82 64.08 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 112.192 0.441 . . . . 287.89 112.192 178.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 182' ' ' ALA . . . . . . . . . . . . . . . -76.94 -32.0 57.02 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 118.047 0.385 . . . . 314.63 111.975 177.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . . . -77.26 -22.53 51.99 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 112.444 0.535 . . . . 295.96 112.444 176.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . . . -74.94 -41.92 58.68 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.544 -0.462 . . . . 320.05 111.232 178.407 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 185' ' ' VAL . . . . . . . . . . . . . . . -74.1 -27.23 21.79 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 C-N-CA 120.136 -0.626 . . . . 314.25 110.539 177.703 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . . . -75.79 -33.95 27.08 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 O-C-N 121.933 -0.479 . . . . 315.67 111.046 178.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -75.9 -24.46 55.62 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.055 -0.658 . . . . 301.99 111.857 178.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 188' ' ' SER . . . . . . . . . . . . . 86.2 p -81.51 8.06 10.47 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.937 0.718 . . . . 305.56 112.937 179.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . . . -81.83 112.59 19.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 N-CA-C 108.28 -1.007 . . . . 312.24 108.28 -179.204 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 190' ' ' LYS . . . . . . . . . . . . . 46.5 mmtm -71.41 -27.47 63.33 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.317 -0.553 . . . . 322.92 111.548 177.02 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 191' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -67.34 108.42 2.76 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.809 -0.811 . . . . 346.25 108.809 176.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 192' ' ' ARG . . . . . . . . . . . . . . . -70.67 -26.54 63.49 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.505 -0.478 . . . . 330.1 111.919 -176.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 193' ' ' ALA . . . . . . . . . . . . . . . -72.43 -44.17 62.79 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.298 -0.561 . . . . 337.81 111.324 179.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 194' ' ' PHE . . . . . . . . . . . . . . . -73.07 -30.84 63.99 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.355 -0.538 . . . . 345.25 111.557 177.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 195' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -67.24 -34.71 78.03 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.561 -0.455 . . . . 330.15 111.084 176.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 196' ' ' ARG . . . . . . . . . . . . . 5.8 ttm-85 -72.43 -33.66 67.26 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.378 -0.529 . . . . 325.79 111.462 176.275 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 197' ' ' GLU . . . . . . . . . . . . . . . -68.48 -39.69 81.27 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.55 -0.46 . . . . 322.9 111.3 -179.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 198' ' ' LEU . . . . . . . . . . . . . . . -70.86 -30.13 66.44 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.202 -0.599 . . . . 334.54 111.459 176.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 199' ' ' MET . . . . . . . . . . . . . . . -73.16 -26.67 61.28 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.416 -0.514 . . . . 334.12 111.532 177.388 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 200' ' ' ARG . . . . . . . . . . . . . . . -75.25 -34.24 61.37 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 111.911 0.337 . . . . 338.6 111.911 177.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 201' ' ' ARG . . . . . . . . . . . . . . . -82.14 -14.54 55.54 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 112.586 0.588 . . . . 334.31 112.586 176.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 97.8 p -78.05 -14.73 59.39 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 112.803 0.668 . . . . 322.82 112.803 179.112 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 82.3 mt-10 -71.38 -18.96 62.33 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 112.375 0.509 . . . . 320.62 112.375 -179.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 204' ' ' LYS . . . . . . . . . . . . . 61.7 tttm -121.48 -56.8 1.87 Allowed 'General case' 0 C--O 1.235 0.303 0 CA-C-N 118.163 0.438 . . . . 317.09 111.877 -178.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . . . -76.22 -19.32 58.48 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 112.901 0.704 . . . . 317.84 112.901 -178.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 206' ' ' GLY . . . . . . . . . . . . . . . 101.09 178.41 29.02 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-O 122.555 1.086 . . . . 321.59 112.128 -178.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 207' ' ' MET . . . . . . . . . . . . . . . -71.59 -30.71 66.14 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 114.452 -0.874 . . . . 310.67 111.811 -179.118 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . . . -78.79 -45.84 20.09 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.761 -0.376 . . . . 321.47 111.482 -178.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 209' ' ' GLY . . . . . . . . . . . . . . . -71.49 -14.26 74.64 Favored Glycine 0 C--N 1.335 0.488 0 C-N-CA 120.856 -0.688 . . . . 332.91 114.252 -178.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -83.81 -40.69 18.41 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 117.821 0.811 . . . . 337.6 111.715 -179.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . . . -69.83 -20.04 63.45 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 112.304 0.483 . . . . 315.62 112.304 178.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . . . -99.81 -5.09 29.14 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 113.066 0.765 . . . . 364.4 113.066 -179.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 213' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.288 0 CA-C-N 118.353 0.524 . . . . 351.56 113.244 -179.653 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 222' ' ' ASN . . . . . 0.575 ' N ' HD21 ' B' ' 222' ' ' ASN . 0.7 OUTLIER . . . . . 0 CA--C 1.522 -0.111 0 CA-C-O 120.867 0.365 . . . . 209.34 110.84 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 223' ' ' LEU . . . . . . . . . . . . . . . -96.95 32.77 2.04 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.93 -0.577 . . . . 256.68 112.275 -179.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 224' ' ' ALA . . . . . . . . . . . . . . . -71.29 -30.31 66.09 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.231 -0.587 . . . . 280.25 111.538 178.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 225' ' ' GLN . . . . . . . . . . . . . . . -87.58 -2.81 58.87 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 112.972 0.73 . . . . 317.25 112.972 178.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 226' ' ' LEU . . . . . . . . . . . . . . . -80.51 135.07 53.59 Favored Pre-proline 0 C--O 1.234 0.255 0 CA-C-N 118.412 0.551 . . . . 280.71 110.312 179.655 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 227' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -69.7 -23.96 30.48 Favored 'Trans proline' 0 C--O 1.237 0.453 0 N-CA-C 113.438 0.515 . . . . 265.86 113.438 -179.514 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 228' ' ' GLU . . . . . . . . . . . . . . . -70.8 -12.9 61.83 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 112.873 0.694 . . . . 273.76 112.873 -179.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 229' ' ' ALA . . . . . . . . . . . . . . . -90.38 6.8 41.69 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 112.832 0.678 . . . . 284.69 112.832 179.454 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 230' ' ' HIS . . . . . . . . . . . . . . . -128.76 -42.57 1.42 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.938 0.718 . . . . 254.36 112.938 -179.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 231' ' ' PHE . . . . . . . . . . . . . . . -120.06 129.31 54.16 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.47 -0.567 . . . . 271.58 109.47 -179.028 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 232' ' ' THR . . . . . . . . . . . . . . . -130.27 165.29 22.74 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.507 0.67 . . . . 255.67 109.527 179.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 233' ' ' VAL . . . . . . . . . . . . . . . -83.9 122.83 38.29 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 N-CA-C 108.65 -0.87 . . . . 238.94 108.65 179.489 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 234' ' ' GLN . . . . . . . . . . . . . . . -133.18 -3.57 3.1 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 114.44 1.274 . . . . 243.73 114.44 178.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 235' ' ' ALA . . . . . . . . . . . . . . . -156.91 169.26 25.19 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 119.375 0.988 . . . . 249.17 108.847 179.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 236' ' ' PHE . . . . . . . . . . . . . . . -136.49 137.59 40.5 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.431 -0.804 . . . . 240.69 109.292 176.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 237' ' ' VAL . . . . . . . . . . . . . . . -112.42 112.24 39.61 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 N-CA-C 108.059 -1.089 . . . . 230.09 108.059 -175.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 238' ' ' GLN . . . . . . . . . . . . . . . -111.38 129.26 56.07 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 108.739 -0.838 . . . . 250.73 108.739 174.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 239' ' ' THR . . . . . . . . . . . . . 74.3 p -116.89 159.86 21.77 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 121.542 0.687 . . . . 277.57 110.802 -173.204 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . . . -154.45 138.85 16.73 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.152 -0.931 . . . . 240.85 108.812 177.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 241' ' ' SER . . . . . . . . . . . . . 88.8 p -135.11 162.21 33.13 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.633 0.73 . . . . 260.44 110.07 -176.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 242' ' ' GLY . . . . . . . . . . . . . . . 84.52 -140.14 18.66 Favored Glycine 0 N--CA 1.449 -0.455 0 CA-C-N 115.221 -0.899 . . . . 249.07 112.635 -179.152 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 243' ' ' ALA . . . . . . . . . . . . . . . -80.05 -20.87 44.23 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.68 0.622 . . . . 275.68 112.68 177.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 244' ' ' ALA . . . . . . . . . . . . . . . -68.34 -26.8 65.79 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.437 -0.505 . . . . 260.8 111.532 177.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -73.15 5.94 3.12 Favored 'General case' 0 C--O 1.238 0.491 0 N-CA-C 112.968 0.729 . . . . 251.27 112.968 177.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 246' ' ' ARG . . . . . . . . . . . . . 33.9 ttm-85 -126.28 -17.86 5.09 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 113.767 1.025 . . . . 245.12 113.767 177.786 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -76.07 125.62 29.48 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 119.144 0.884 . . . . 267.3 109.449 178.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 248' ' ' ALA . . . . . . . . . . . . . . . -70.79 -23.67 62.43 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 112.53 0.567 . . . . 269.87 112.53 -179.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 249' ' ' GLU . . . . . . . . . . . . . . . -71.76 -39.15 70.18 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 120.08 -0.648 . . . . 281.87 111.197 179.358 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 250' ' ' GLU . . . . . . . . . . . . . 17.6 tt0 -77.8 -24.48 48.78 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 112.259 0.466 . . . . 259.29 112.259 178.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 251' ' ' TYR . . . . . . . . . . . . . . . -66.46 -32.07 73.21 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 120.098 -0.641 . . . . 237.57 111.2 174.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 252' ' ' ARG . . . . . . . . . . . . . . . -72.94 -15.27 61.57 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 112.025 0.38 . . . . 242.62 112.025 174.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 253' ' ' ALA . . . . . . . . . . . . . . . -90.64 -19.38 23.72 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 113.026 0.75 . . . . 258.2 113.026 177.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -85.86 -29.5 23.66 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 118.273 0.488 . . . . 252.28 112.023 178.236 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 255' ' ' LEU . . . . . . . . . . . . . . . -66.24 -35.59 80.83 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.614 -0.435 . . . . 252.52 111.27 177.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . . . -77.18 -33.33 56.44 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.279 -0.569 . . . . 272.33 111.563 173.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 257' ' ' THR . . . . . . . . . . . . . . . -68.26 -22.58 64.75 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 112.013 0.375 . . . . 269.04 112.013 175.074 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 258' ' ' ALA . . . . . . . . . . . . . . . -90.59 -31.48 16.67 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 112.433 0.531 . . . . 277.14 112.433 174.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 259' ' ' ALA . . . . . . . . . . . . . . . -74.35 -28.93 61.36 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.341 -0.544 . . . . 286.69 111.464 176.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -78.99 -35.09 43.47 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.714 -0.394 . . . . 305.05 111.353 174.56 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 261' ' ' ALA . . . . . . . . . . . . . . . -71.09 -15.43 62.52 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.493 -0.483 . . . . 292.02 111.717 176.444 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 262' ' ' LEU . . . . . . . . . . . . . . . -84.32 -41.6 16.64 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 125.031 1.332 . . . . 304.82 112.165 174.259 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 263' ' ' GLU . . . . . . . . . . . . . . . -67.14 -35.53 79.92 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.317 -0.553 . . . . 301.12 111.258 177.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . . . -73.54 -41.67 62.69 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 111.72 0.266 . . . . 295.69 111.72 177.662 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 265' ' ' TYR . . . . . . . . . . . . . . . -69.12 -44.19 72.88 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.21 -0.596 . . . . 302.61 111.151 178.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 266' ' ' GLN . . . . . . . . . . . . . . . -69.96 -24.74 63.38 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 120.572 -0.451 . . . . 286.53 112.126 176.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 267' ' ' GLY . . . . . . . . . . . . . . . -80.48 -18.12 71.85 Favored Glycine 0 C--N 1.336 0.545 0 C-N-CA 120.804 -0.712 . . . . 279.98 114.353 175.185 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 268' ' ' VAL . . . . . . . . . . . . . . . -92.2 -24.46 5.39 Favored 'Isoleucine or valine' 0 C--O 1.239 0.551 0 CA-C-N 117.677 0.739 . . . . 289.1 112.768 177.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 269' ' ' THR . . . . . . . . . . . . . 41.2 p -76.08 -34.76 59.56 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 118.387 0.539 . . . . 304.49 111.519 177.092 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 270' ' ' THR . . . . . . . . . . . . . 9.5 t -69.82 -16.41 63.27 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 112.183 0.438 . . . . 288.28 112.183 174.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 271' ' ' ARG . . . . . . . . . . . . . . . -89.66 -37.4 14.65 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 118.366 0.53 . . . . 289.7 111.825 175.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 272' ' ' GLN . . . . . . . . . . . . . . . -70.16 -25.69 63.57 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.24 -0.584 . . . . 281.49 111.55 176.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . . . -77.8 -27.2 50.08 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 111.915 0.339 . . . . 252.24 111.915 176.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 274' ' ' SER . . . . . . . . . . . . . 75.3 m -74.42 -24.67 59.13 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.24 -0.584 . . . . 261.61 111.531 177.046 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . . . -77.86 -11.31 59.88 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 112.933 0.716 . . . . 243.93 112.933 178.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 276' ' ' VAL . . . . . . . . . . . . . . . -100.31 -45.69 11.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 118.347 0.521 . . . . 254.34 111.51 179.756 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 277' ' ' LEU . . . . . . . . . . . . . . . -73.1 -7.58 51.96 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 112.786 0.662 . . . . 253.69 112.786 179.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 278' ' ' ARG . . . . . . . . . . . . . 42.2 ttp85 -66.45 -33.46 75.75 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 118.235 0.47 . . . . 281.12 111.666 178.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 279' ' ' HIS . . . . . . . . . . . . . 5.6 m-70 . . . . . 0 C--N 1.33 -0.281 0 CA-C-O 120.791 0.329 . . . . 264.16 111.354 179.792 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' TYR . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.457 -0.123 0 CA-C-O 120.862 0.363 . . . . 253.97 111.041 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . -72.06 -20.33 61.69 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 112.566 0.58 . . . . 283.5 112.566 -178.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' ALA . . . . . . . . . . . . . . . -71.53 -33.77 69.47 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.203 -0.599 . . . . 277.04 111.655 178.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' PHE . . . . . . . . . . . . . . . -72.14 -26.05 61.95 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 120.434 -0.507 . . . . 269.76 111.522 177.578 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' ASP . . . . . 0.446 ' OD1' ' OG ' ' B' ' 28' ' ' SER . 76.3 m-20 -69.0 -47.11 66.32 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.537 -0.465 . . . . 283.5 110.874 175.291 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . . . -65.31 -30.03 70.84 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.37 -0.532 . . . . 279.28 111.321 175.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . . . -73.58 -29.01 62.14 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.449 -0.5 . . . . 271.92 111.468 175.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' MET . . . . . . . . . . . . . . . -89.62 -11.79 41.57 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 112.733 0.642 . . . . 263.87 112.733 174.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' SER . . . . . . . . . . . . . . . -78.64 -16.21 57.61 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 112.756 0.65 . . . . 263.11 112.756 179.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' THR . . . . . 0.704 HG23 ' HE1' ' B' ' 58' ' ' TRP . 7.3 t -80.37 3.84 19.89 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 112.778 0.658 . . . . 258.25 112.778 178.351 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -127.34 12.41 7.02 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 112.292 0.479 . . . . 298.25 112.292 178.402 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 74.07 18.74 79.77 Favored Glycine 0 N--CA 1.447 -0.578 0 N-CA-C 115.123 0.809 . . . . 303.43 115.123 179.762 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' VAL . . . . . . . . . . . . . . . -109.99 114.58 47.39 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 N-CA-C 107.633 -1.247 . . . . 277.97 107.633 -178.364 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' ASP . . . . . . . . . . . . . 54.6 t0 -87.52 104.38 16.42 Favored 'General case' 0 C--O 1.233 0.235 0 N-CA-C 107.821 -1.178 . . . . 286.05 107.821 176.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' SER . . . . . 0.446 ' OG ' ' OD1' ' B' ' 18' ' ' ASP . 58.2 p -83.64 -31.5 26.17 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 112.547 0.573 . . . . 288.39 112.547 -173.419 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' GLN . . . . . . . . . . . . . 69.9 mm-40 57.41 38.82 28.44 Favored 'General case' 0 N--CA 1.465 0.304 0 CA-C-O 121.337 0.589 . . . . 267.56 111.086 -176.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . . . -72.62 -37.78 57.17 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 CA-C-N 116.087 -0.506 . . . . 276.13 110.605 -179.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.03 -28.51 69.54 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.186 -0.605 . . . . 281.92 111.357 177.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -84.35 -30.55 25.38 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 120.767 -0.373 . . . . 282.7 111.821 174.606 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . . . -77.78 -33.06 52.78 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 112.081 0.4 . . . . 279.32 112.081 178.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.19 -38.25 85.04 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.213 -0.595 . . . . 278.62 111.034 176.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.46 -7.64 58.57 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 112.681 0.623 . . . . 316.03 112.681 175.413 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 48.1 t -78.02 0.75 23.27 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 112.925 0.713 . . . . 330.43 112.925 178.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . . . 59.1 37.11 24.29 Favored 'General case' 0 N--CA 1.466 0.347 0 CA-C-O 121.41 0.624 . . . . 348.3 111.319 177.786 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' ALA . . . . . . . . . . . . . . . -83.44 150.56 25.96 Favored 'General case' 0 N--CA 1.454 -0.246 0 C-N-CA 123.578 0.751 . . . . 334.39 110.343 177.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 16.9 p-10 -67.12 166.68 13.45 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-O 122.019 0.914 . . . . 346.71 110.713 -179.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' ALA . . . . . . . . . . . . . . . -66.41 -30.7 71.12 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 115.24 -0.891 . . . . 308.24 111.766 -179.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' GLY . . . . . . . . . . . . . . . -64.85 -35.12 91.53 Favored Glycine 0 C--N 1.335 0.51 0 C-N-CA 120.058 -1.068 . . . . 305.04 112.654 178.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' THR . . . . . . . . . . . . . 89.5 m -79.5 -37.32 36.98 Favored 'General case' 0 C--O 1.237 0.399 0 O-C-N 122.28 -0.541 . . . . 318.07 111.434 177.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' LEU . . . . . . . . . . . . . . . -66.51 -37.92 86.09 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 120.44 -0.504 . . . . 284.23 111.283 179.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' ASP . . . . . . . . . . . . . 45.2 m-20 -67.97 -36.6 80.33 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 120.281 -0.568 . . . . 286.14 111.298 178.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' ALA . . . . . . . . . . . . . . . -71.26 -36.51 71.77 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.387 -0.525 . . . . 289.69 111.435 -179.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . -69.69 -41.5 75.34 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.279 -0.568 . . . . 277.62 111.239 179.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' LEU . . . . . . . . . . . . . . . -70.51 -26.53 63.63 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.303 -0.559 . . . . 246.19 111.635 178.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' THR . . . . . 0.479 HG23 ' HA ' ' B' ' 68' ' ' GLU . 32.0 m -78.33 -40.97 35.0 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.682 -0.407 . . . . 271.23 111.544 179.946 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . . . -71.27 -17.48 62.48 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 112.533 0.568 . . . . 264.46 112.533 -178.981 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 66.1 m -89.59 -36.53 15.26 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 112.324 0.49 . . . . 276.12 112.324 -179.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' LEU . . . . . . . . . . . . . . . -69.08 -31.16 69.69 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.061 -0.656 . . . . 235.81 111.41 175.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' GLN . . . . . . . . . . . . . . . -67.46 -44.25 79.09 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.473 -0.491 . . . . 252.97 111.054 175.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' GLU . . . . . . . . . . . . . . . -69.87 -20.34 63.4 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.685 -0.406 . . . . 272.64 112.02 174.353 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -82.69 -40.81 20.15 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 117.905 0.32 . . . . 253.1 111.353 175.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' GLN . . . . . . . . . . . . . . . -64.01 -29.44 70.6 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.383 -0.527 . . . . 239.26 111.523 178.036 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' GLY . . . . . . . . . . . . . . . -74.96 -20.32 79.5 Favored Glycine 0 C--N 1.336 0.56 0 C-N-CA 120.88 -0.676 . . . . 268.28 114.205 175.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' ARG . . . . . . . . . . . . . . . -99.58 -8.39 24.57 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 117.696 0.748 . . . . 244.29 113.001 176.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' TRP . . . . . 0.704 ' HE1' HG23 ' B' ' 23' ' ' THR . 11.0 m0 -85.14 -15.7 42.93 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 112.9 0.704 . . . . 288.29 112.9 -179.177 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 73.94 16.03 79.54 Favored Glycine 0 N--CA 1.446 -0.673 0 CA-C-O 119.101 -0.833 . . . . 246.19 115.126 -176.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' LEU . . . . . . . . . . . . . . . -69.28 -22.71 63.8 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 118.582 1.191 . . . . 230.08 111.968 -179.309 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' GLY . . . . . . . . . . . . . . . 71.61 19.58 77.96 Favored Glycine 0 N--CA 1.448 -0.529 0 C-N-CA 120.576 -0.821 . . . . 254.15 114.645 -178.121 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . . . -88.17 28.03 1.13 Allowed 'General case' 0 C--O 1.239 0.528 0 CA-C-N 117.969 0.884 . . . . 261.47 112.635 178.686 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' HIS . . . . . . . . . . . . . . . -64.49 -27.04 68.71 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.502 -0.479 . . . . 250.56 111.609 178.926 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' HIS . . . . . . . . . . . . . 51.6 p-80 -69.87 -15.91 63.16 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 112.18 0.437 . . . . 246.85 112.18 175.366 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . . . -95.55 149.77 21.06 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-O 121.275 0.559 . . . . 241.04 110.229 177.695 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' ARG . . . . . . . . . . . . . . . -89.94 98.38 11.74 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 108.291 -1.003 . . . . 284.24 108.291 -179.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' HIS . . . . . . . . . . . . . . . -80.43 134.67 36.03 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 116.349 -0.387 . . . . 299.83 110.289 -178.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' GLU . . . . . 0.479 ' HA ' HG23 ' B' ' 48' ' ' THR . . . -148.82 163.11 38.35 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 109.044 -0.724 . . . . 293.05 109.044 179.393 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -148.04 142.25 26.13 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-N 115.417 -0.81 . . . . 299.33 109.166 -179.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' ARG . . . . . . . . . . . . . . . -152.21 144.84 24.22 Favored 'General case' 0 C--O 1.234 0.237 0 N-CA-C 109.272 -0.64 . . . . 317.24 109.272 -179.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . . . -83.39 133.61 34.93 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 115.611 -0.722 . . . . 327.7 109.896 178.483 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' THR . . . . . . . . . . . . . 31.0 p -87.95 155.93 19.59 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 121.686 0.755 . . . . 346.93 110.791 -177.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -71.85 -11.39 60.78 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.311 -0.859 . . . . 345.02 112.565 176.048 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' ASP . . . . . . . . . . . . . 33.2 t0 -77.13 2.48 15.11 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 112.603 0.594 . . . . 346.04 112.603 175.594 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 86.33 15.09 64.97 Favored Glycine 0 N--CA 1.447 -0.614 0 CA-C-O 119.184 -0.786 . . . . 359.38 114.853 -175.26 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' ASP . . . . . . . . . . . . . 25.7 t0 -125.25 173.43 8.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 118.247 1.024 . . . . 349.21 109.482 -176.999 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' ILE . . . . . 0.433 ' O ' ' N ' ' B' ' 89' ' ' VAL . . . -121.46 126.81 75.34 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 N-CA-C 108.128 -1.064 . . . . 336.18 108.128 177.192 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . . . -108.46 138.61 44.47 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 122.739 0.415 . . . . 317.59 110.144 -177.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' ILE . . . . . . . . . . . . . . . -84.58 147.93 5.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.357 0 N-CA-C 108.695 -0.854 . . . . 297.99 108.695 176.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -128.78 140.05 51.9 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 109.424 -0.584 . . . . 295.67 109.424 -177.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . . . -146.02 103.78 3.77 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 107.784 -1.191 . . . . 276.73 107.784 -179.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' ASP . . . . . . . . . . . . . . . 59.63 28.04 17.38 Favored 'General case' 0 C--O 1.233 0.23 0 O-C-N 123.638 0.586 . . . . 256.19 112.143 176.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 110.16 -37.71 3.64 Favored Glycine 0 N--CA 1.45 -0.429 0 N-CA-C 115.151 0.82 . . . . 250.97 115.151 173.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' ARG . . . . . . . . . . . . . . . -93.76 133.31 28.11 Favored Pre-proline 0 C--O 1.238 0.479 0 CA-C-N 117.1 0.45 . . . . 302.66 110.267 -175.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' PRO . . . . . . . . . . . . . 39.3 Cg_exo -70.21 135.08 28.51 Favored 'Trans proline' 0 C--N 1.331 -0.35 0 C-N-CA 120.4 0.734 . . . . 282.23 110.204 179.118 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . . . -95.94 -54.41 3.33 Favored 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.269 -0.423 . . . . 290.27 111.478 179.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' ALA . . . . . . . . . . . . . . . -155.52 -178.87 7.59 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 108.426 -0.953 . . . . 297.23 108.426 -178.026 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . . . -120.38 168.5 11.23 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.536 -0.756 . . . . 313.66 109.712 179.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' VAL . . . . . 0.433 ' N ' ' O ' ' B' ' 77' ' ' ILE . . . -75.3 -45.85 39.88 Favored 'Isoleucine or valine' 0 C--O 1.237 0.419 0 CA-C-N 115.291 -0.868 . . . . 334.18 110.722 -176.031 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' SER . . . . . . . . . . . . . 97.4 p -70.49 -2.74 14.9 Favored 'General case' 0 C--O 1.237 0.432 0 N-CA-C 112.973 0.731 . . . . 324.75 112.973 -179.122 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' GLU . . . . . . . . . . . . . . . -85.63 12.09 9.47 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 112.851 0.686 . . . . 314.08 112.851 177.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' GLY . . . . . . . . . . . . . . . 86.8 158.28 31.79 Favored Glycine 0 N--CA 1.446 -0.646 0 CA-C-O 122.364 0.98 . . . . 300.94 112.766 177.91 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' PHE . . . . . . . . . . . . . . . -78.91 -8.02 58.49 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 113.008 0.744 . . . . 292.04 113.008 179.352 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' GLY . . . . . . . . . . . . . . . -90.77 -22.66 32.81 Favored Glycine 0 N--CA 1.45 -0.432 0 CA-C-N 118.369 0.531 . . . . 290.8 112.885 178.312 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -72.17 -36.74 69.35 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.429 -0.509 . . . . 276.99 111.304 179.136 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' LEU . . . . . . . . . . . . . . . -70.21 -30.72 67.89 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.369 -0.532 . . . . 260.54 111.655 178.24 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' ALA . . . . . . . . . . . . . . . -70.87 -37.16 73.07 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.471 -0.492 . . . . 280.49 111.273 179.503 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . . . -75.79 -3.93 37.74 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 112.889 0.7 . . . . 242.88 112.889 176.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' ALA . . . . . . . . . . . . . . . -98.64 -39.35 8.73 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 112.957 0.725 . . . . 246.13 112.957 178.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' TYR . . . . . . . . . . . . . . . -85.77 -11.99 52.14 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 112.95 0.722 . . . . 245.5 112.95 177.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.84 -46.12 65.41 Favored Pre-proline 0 C--O 1.246 0.894 0 CA-C-O 118.511 -0.756 . . . . 246.09 112.555 177.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -64.63 -24.71 62.42 Favored 'Trans proline' 0 C--O 1.237 0.443 0 CA-C-N 121.524 1.58 . . . . 254.75 113.531 177.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' MET . . . . . . . . . . . . . . . -84.01 2.11 40.55 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 112.683 0.623 . . . . 260.58 112.683 175.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' GLN . . . . . . . . . . . . . . . -115.01 141.38 48.08 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 123.163 0.585 . . . . 256.85 110.021 -179.53 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' ALA . . . . . . . . . . . . . . . -125.73 107.76 10.86 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 108.334 -0.988 . . . . 261.69 108.334 179.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' LEU . . . . . . . . . . . . . . . -105.56 141.23 37.39 Favored 'General case' 0 C--N 1.329 -0.3 0 C-N-CA 122.744 0.418 . . . . 238.49 110.07 -179.036 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' ASP . . . . . . . . . . . . . 33.1 p-10 -84.61 -162.85 0.73 Allowed 'General case' 0 C--O 1.236 0.377 0 CA-C-N 116.044 -0.526 . . . . 281.64 110.434 177.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' GLU . . . . . . . . . . . . . . . -73.04 -15.99 61.5 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 112.472 0.545 . . . . 272.48 112.472 -179.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' ARG . . . . . . . . . . . . . . . -95.1 -16.46 22.63 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 113.191 0.812 . . . . 266.36 113.191 -179.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' GLY . . . . . . . . . . . . . . . 103.69 1.41 46.34 Favored Glycine 0 N--CA 1.447 -0.62 0 CA-C-O 119.079 -0.845 . . . . 266.38 115.086 -178.029 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' LEU . . . . . . . . . . . . . . . -88.81 159.29 17.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 118.37 1.085 . . . . 281.69 110.674 -179.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' SER . . . . . . . . . . . . . 47.6 t -83.53 120.32 25.79 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.266 -0.879 . . . . 262.26 109.831 -178.503 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' GLN . . . . . . . . . . . . . 96.9 mt-30 -71.93 -13.07 61.54 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 112.656 0.613 . . . . 246.41 112.656 176.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' TRP . . . . . . . . . . . . . 81.8 m95 -68.66 146.81 52.67 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 121.574 0.702 . . . . 251.75 110.743 179.086 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' ALA . . . . . . . . . . . . . . . -88.19 132.81 34.21 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.498 -0.774 . . . . 268.2 109.021 172.173 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' ALA . . . . . . . . . . . . . . . -66.32 -32.58 74.07 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.197 -0.601 . . . . 268.65 111.92 -177.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' LEU . . . . . . . . . . . . . . . -76.68 -23.72 53.21 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 112.783 0.66 . . . . 245.18 112.783 -179.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' GLY . . . . . . . . . . . . . . . 103.82 -142.41 15.49 Favored Glycine 0 N--CA 1.448 -0.518 0 CA-C-N 118.174 0.443 . . . . 284.75 112.726 -177.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' GLU . . . . . . . . . . . . . . . -72.66 130.37 40.39 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-O 120.958 0.409 . . . . 302.88 110.354 179.674 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 157.82 -154.75 25.81 Favored Glycine 0 N--CA 1.45 -0.383 0 N-CA-C 110.123 -1.191 . . . . 269.18 110.123 -179.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' TYR . . . . . . . . . . . . . 69.5 t80 -102.04 147.06 27.03 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.953 -0.623 . . . . 239.14 110.295 176.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' ARG . . . . . . . . . . . . . . . -132.46 120.36 21.84 Favored 'General case' 0 C--O 1.235 0.332 0 N-CA-C 108.441 -0.948 . . . . 245.18 108.441 176.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -68.87 138.36 90.32 Favored Pre-proline 0 C--O 1.236 0.369 0 C-N-CA 120.297 -0.561 . . . . 239.98 109.894 177.451 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -72.26 164.43 35.65 Favored 'Trans proline' 0 C--N 1.33 -0.399 0 CA-C-O 122.117 0.799 . . . . 261.56 111.796 -177.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' GLY . . . . . . . . . . . . . . . -69.8 -6.2 54.77 Favored Glycine 0 N--CA 1.45 -0.396 0 CA-C-N 114.829 -1.078 . . . . 247.15 114.414 175.185 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' ASP . . . . . . . . . . . . . 37.7 t0 -81.78 -2.86 52.26 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 117.923 0.861 . . . . 287.62 112.874 179.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . . . -73.72 135.12 78.15 Favored Pre-proline 0 C--O 1.236 0.344 0 CA-C-N 118.372 0.533 . . . . 292.51 110.519 -177.247 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' PRO . . . . . . . . . . . . . 22.3 Cg_exo -68.43 167.88 21.18 Favored 'Trans proline' 0 C--N 1.331 -0.356 0 CA-C-O 122.287 0.87 . . . . 281.73 110.994 177.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . . . -72.17 -15.75 61.97 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 114.924 -1.034 . . . . 255.94 112.271 177.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -70.06 -48.36 58.17 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.625 -0.43 . . . . 244.48 111.119 178.682 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' GLN . . . . . . . . . . . . . . . -71.17 -10.94 60.6 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 112.712 0.634 . . . . 240.44 112.712 178.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' LEU . . . . . . . . . . . . . . . -83.57 -36.87 23.64 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-N 118.28 0.491 . . . . 222.25 111.571 179.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . . . -62.53 -33.02 74.07 Favored 'General case' 0 C--O 1.236 0.383 0 C-N-CA 120.237 -0.585 . . . . 218.31 111.417 177.682 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 134' ' ' VAL . . . . . . . . . . . . . . . -68.37 -41.53 83.58 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 C-N-CA 120.487 -0.485 . . . . 232.76 110.357 176.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 135' ' ' LEU . . . . . . . . . . . . . . . -72.58 -5.95 40.77 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 112.599 0.592 . . . . 210.6 112.599 177.067 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 136' ' ' ILE . . . . . . . . . . . . . . . -103.93 -29.48 2.88 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 N-CA-C 109.399 -0.593 . . . . 203.69 109.399 178.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 137' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -99.98 -24.3 14.67 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 113.789 1.033 . . . . 248.32 113.789 -176.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 138' ' ' HIS . . . . . . . . . . . . . 89.2 m-70 -125.39 -6.76 7.0 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 114.508 1.299 . . . . 246.73 114.508 -171.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -99.05 167.75 10.52 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 121.927 0.87 . . . . 234.94 111.183 -175.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 140' ' ' ARG . . . . . . . . . . . . . . . -100.02 -80.7 0.47 Allowed 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.2 -0.909 . . . . 242.21 110.284 177.532 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 141' ' ' ASP . . . . . . . . . . . . . 74.8 m-20 -109.35 126.56 53.53 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 109.51 -0.552 . . . . 242.78 109.51 178.381 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 142' ' ' PHE . . . . . . . . . . . . . . . -152.35 145.52 24.63 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 109.027 -0.731 . . . . 252.08 109.027 179.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 143' ' ' GLU . . . . . . . . . . . . . . . -137.32 140.02 41.23 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 115.738 -0.665 . . . . 259.62 109.337 179.137 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 144' ' ' THR . . . . . . . . . . . . . 71.9 p -109.69 158.22 18.31 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 121.603 0.716 . . . . 231.38 110.279 178.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 145' ' ' ASP . . . . . . . . . . . . . 7.3 t0 -87.06 -163.9 0.99 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 115.116 -0.947 . . . . 256.72 108.859 175.581 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 146' ' ' TRP . . . . . . . . . . . . . 98.9 m95 -92.94 138.88 31.09 Favored 'General case' 0 C--O 1.234 0.247 0 O-C-N 121.647 -0.658 . . . . 258.81 111.094 -177.825 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 35.6 p -136.02 154.51 51.04 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 115.775 -0.648 . . . . 257.73 109.73 177.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -68.32 121.94 17.33 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.821 -0.627 . . . . 265.56 110.148 -177.076 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 149' ' ' GLY . . . . . . . . . . . . . . . -93.93 -158.61 33.79 Favored Glycine 0 N--CA 1.445 -0.703 0 CA-C-O 121.885 0.714 . . . . 274.37 112.774 -179.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 150' ' ' ARG . . . . . . . . . . . . . . . -70.24 135.71 49.26 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.168 0.509 . . . . 278.69 110.608 -179.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 151' ' ' GLY . . . . . . . . . . . . . . . 70.97 -129.09 17.85 Favored Glycine 0 C--O 1.236 0.241 0 C-N-CA 120.024 -1.084 . . . . 264.98 110.571 -178.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 152' ' ' GLU . . . . . . . . . . . . . . . -105.92 23.99 13.08 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 112.305 0.484 . . . . 277.34 112.305 177.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 153' ' ' THR . . . . . . . . . . . . . 48.8 p -99.47 174.46 6.26 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 122.075 0.94 . . . . 272.41 110.782 -177.389 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 154' ' ' PHE . . . . . . . . . . . . . . . -128.38 169.25 14.49 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 115.027 -0.988 . . . . 253.23 108.937 176.447 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 155' ' ' GLN . . . . . . . . . . . . . . . -153.7 149.17 27.23 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 115.785 -0.643 . . . . 246.65 109.65 -178.016 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 156' ' ' ARG . . . . . . . . . . . . . . . -150.93 148.3 28.25 Favored 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 108.328 -0.99 . . . . 244.48 108.328 176.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 157' ' ' VAL . . . . . . . . . . . . . . . -133.81 149.97 31.2 Favored 'Isoleucine or valine' 0 C--O 1.235 0.314 0 N-CA-C 109.422 -0.585 . . . . 217.54 109.422 -177.461 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 158' ' ' TRP . . . . . . . . . . . . . 27.9 p90 -159.14 158.35 32.66 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 108.387 -0.968 . . . . 264.62 108.387 175.347 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 159' ' ' ARG . . . . . . . . . . . . . 49.2 ttp180 -137.81 125.8 22.76 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.414 -0.812 . . . . 229.99 109.515 -178.782 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 160' ' ' LYS . . . . . . . . . . . . . . . -125.17 118.51 26.23 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 108.673 -0.862 . . . . 240.41 108.673 -179.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 161' ' ' GLY . . . . . . . . . . . . . . . 69.02 -133.01 26.42 Favored Glycine 0 C--O 1.236 0.247 0 C-N-CA 119.591 -1.29 . . . . 241.46 110.202 -176.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 162' ' ' ASP . . . . . . . . . . . . . . . -99.34 23.47 9.23 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 112.523 0.564 . . . . 264.95 112.523 -179.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 163' ' ' THR . . . . . . . . . . . . . 47.8 p -128.26 130.7 48.3 Favored 'General case' 0 C--O 1.236 0.366 0 N-CA-C 109.344 -0.613 . . . . 241.99 109.344 -178.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 164' ' ' LEU . . . . . . . . . . . . . . . -106.48 135.92 47.14 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.476 -0.564 . . . . 227.25 109.476 176.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 165' ' ' PHE . . . . . . . . . . . . . . . -121.98 138.74 54.31 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 116.221 -0.445 . . . . 227.4 110.175 -176.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 166' ' ' VAL . . . . . . . . . . . . . . . -128.93 125.48 63.02 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 N-CA-C 107.954 -1.128 . . . . 244.81 107.954 176.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 167' ' ' GLU . . . . . . . . . . . . . . . -124.56 87.49 2.73 Favored 'General case' 0 C--O 1.233 0.205 0 N-CA-C 109.276 -0.638 . . . . 255.71 109.276 -175.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 168' ' ' VAL . . . . . . . . . . . . . . . -77.88 129.81 37.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 N-CA-C 108.37 -0.974 . . . . 253.71 108.37 171.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 169' ' ' ALA . . . . . . . . . . . . . . . -133.39 142.27 48.28 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-O 121.158 0.504 . . . . 284.14 111.09 -171.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 170' ' ' ARG . . . . . . . . . . . . . . . -125.87 100.19 31.12 Favored Pre-proline 0 C--O 1.24 0.602 0 N-CA-C 107.009 -1.478 . . . . 295.13 107.009 170.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 171' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -63.17 131.76 33.68 Favored 'Trans proline' 0 C--O 1.233 0.264 0 C-N-CA 120.103 0.535 . . . . 293.33 112.065 -170.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 172' ' ' ALA . . . . . . . . . . . . . . . -159.63 116.34 2.58 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 108.193 -1.04 . . . . 289.57 108.193 178.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 173' ' ' SER . . . . . . . . . . . . . 78.3 p -72.56 164.74 25.95 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-O 121.993 0.901 . . . . 281.68 110.579 -179.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 174' ' ' ALA . . . . . . . . . . . . . . . -67.57 -33.28 74.72 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-N 115.399 -0.819 . . . . 282.99 111.662 179.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 175' ' ' GLU . . . . . . . . . . . . . . . -70.78 -42.39 70.44 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.45 -0.5 . . . . 277.82 111.223 178.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 176' ' ' ALA . . . . . . . . . . . . . . . -65.26 -27.16 68.45 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.269 -0.573 . . . . 260.1 111.484 176.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 177' ' ' ALA . . . . . . . . . . . . . . . -72.67 -34.85 67.49 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.567 -0.453 . . . . 277.84 111.581 177.286 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 178' ' ' LEU . . . . . . . . . . . . . . . -71.5 -29.23 64.57 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.198 -0.601 . . . . 288.07 111.566 177.381 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 179' ' ' SER . . . . . . . . . . . . . 48.1 t -78.34 -28.58 47.3 Favored 'General case' 0 C--O 1.236 0.388 0 N-CA-C 112.163 0.431 . . . . 315.6 112.163 179.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 180' ' ' LYS . . . . . . . . . . . . . . . -72.04 -42.78 65.89 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 120.147 -0.621 . . . . 287.61 111.152 177.542 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 181' ' ' ALA . . . . . . . . . . . . . . . -69.04 -21.82 64.08 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 112.192 0.441 . . . . 287.89 112.192 178.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 182' ' ' ALA . . . . . . . . . . . . . . . -76.94 -32.0 57.02 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 118.047 0.385 . . . . 314.63 111.975 177.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 183' ' ' TRP . . . . . . . . . . . . . . . -77.26 -22.53 51.99 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 112.444 0.535 . . . . 295.96 112.444 176.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 184' ' ' LYS . . . . . . . . . . . . . . . -74.94 -41.92 58.68 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.544 -0.462 . . . . 320.05 111.232 178.407 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 185' ' ' VAL . . . . . . . . . . . . . . . -74.1 -27.23 21.79 Favored 'Isoleucine or valine' 0 C--O 1.238 0.456 0 C-N-CA 120.136 -0.626 . . . . 314.25 110.539 177.703 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 186' ' ' ILE . . . . . . . . . . . . . . . -75.79 -33.95 27.08 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 O-C-N 121.933 -0.479 . . . . 315.67 111.046 178.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 187' ' ' ALA . . . . . . . . . . . . . . . -75.9 -24.46 55.62 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.055 -0.658 . . . . 301.99 111.857 178.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 188' ' ' SER . . . . . . . . . . . . . 86.2 p -81.51 8.06 10.47 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.937 0.718 . . . . 305.56 112.937 179.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 189' ' ' ILE . . . . . . . . . . . . . . . -81.83 112.59 19.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 N-CA-C 108.28 -1.007 . . . . 312.24 108.28 -179.204 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 190' ' ' LYS . . . . . . . . . . . . . 46.5 mmtm -71.41 -27.47 63.33 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.317 -0.553 . . . . 322.92 111.548 177.02 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 191' ' ' ASP . . . . . . . . . . . . . 20.7 t0 -67.34 108.42 2.76 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 108.809 -0.811 . . . . 346.25 108.809 176.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 192' ' ' ARG . . . . . . . . . . . . . . . -70.67 -26.54 63.49 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.505 -0.478 . . . . 330.1 111.919 -176.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 193' ' ' ALA . . . . . . . . . . . . . . . -72.43 -44.17 62.79 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.298 -0.561 . . . . 337.81 111.324 179.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 194' ' ' PHE . . . . . . . . . . . . . . . -73.07 -30.84 63.99 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.355 -0.538 . . . . 345.25 111.557 177.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 195' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -67.24 -34.71 78.03 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.561 -0.455 . . . . 330.15 111.084 176.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 196' ' ' ARG . . . . . . . . . . . . . 5.8 ttm-85 -72.43 -33.66 67.26 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.378 -0.529 . . . . 325.79 111.462 176.275 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 197' ' ' GLU . . . . . . . . . . . . . . . -68.48 -39.69 81.27 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.55 -0.46 . . . . 322.9 111.3 -179.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 198' ' ' LEU . . . . . . . . . . . . . . . -70.86 -30.13 66.44 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.202 -0.599 . . . . 334.54 111.459 176.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 199' ' ' MET . . . . . . . . . . . . . . . -73.16 -26.67 61.28 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.416 -0.514 . . . . 334.12 111.532 177.388 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 200' ' ' ARG . . . . . . . . . . . . . . . -75.25 -34.24 61.37 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 111.911 0.337 . . . . 338.6 111.911 177.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' ARG . . . . . . . . . . . . . . . -82.14 -14.54 55.54 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 112.586 0.588 . . . . 334.31 112.586 176.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 202' ' ' SER . . . . . . . . . . . . . 97.8 p -78.05 -14.73 59.39 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 112.803 0.668 . . . . 322.82 112.803 179.112 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 203' ' ' GLU . . . . . . . . . . . . . 82.3 mt-10 -71.38 -18.96 62.33 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 112.375 0.509 . . . . 320.62 112.375 -179.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 204' ' ' LYS . . . . . . . . . . . . . 61.7 tttm -121.48 -56.8 1.87 Allowed 'General case' 0 C--O 1.235 0.303 0 CA-C-N 118.163 0.438 . . . . 317.09 111.877 -178.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 205' ' ' ASP . . . . . . . . . . . . . . . -76.22 -19.32 58.48 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 112.901 0.704 . . . . 317.84 112.901 -178.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 206' ' ' GLY . . . . . . . . . . . . . . . 101.09 178.41 29.02 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-O 122.555 1.086 . . . . 321.59 112.128 -178.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 207' ' ' MET . . . . . . . . . . . . . . . -71.59 -30.71 66.14 Favored 'General case' 0 C--O 1.236 0.38 0 CA-C-N 114.452 -0.874 . . . . 310.67 111.811 -179.118 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 208' ' ' LEU . . . . . . . . . . . . . . . -78.79 -45.84 20.09 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.761 -0.376 . . . . 321.47 111.482 -178.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 209' ' ' GLY . . . . . . . . . . . . . . . -71.49 -14.26 74.64 Favored Glycine 0 C--N 1.335 0.488 0 C-N-CA 120.856 -0.688 . . . . 332.91 114.252 -178.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 210' ' ' ALA . . . . . . . . . . . . . . . -83.81 -40.69 18.41 Favored 'General case' 0 C--O 1.236 0.393 0 CA-C-N 117.821 0.811 . . . . 337.6 111.715 -179.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 211' ' ' LEU . . . . . . . . . . . . . . . -69.83 -20.04 63.45 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 112.304 0.483 . . . . 315.62 112.304 178.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 212' ' ' LEU . . . . . . . . . . . . . . . -99.81 -5.09 29.14 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 113.066 0.765 . . . . 364.4 113.066 -179.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 213' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.288 0 CA-C-N 118.353 0.524 . . . . 351.56 113.244 -179.653 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 222' ' ' ASN . . . . . . . . . . . . . 4.0 m-20 . . . . . 0 CA--C 1.522 -0.111 0 CA-C-O 120.867 0.365 . . . . 209.34 110.84 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 223' ' ' LEU . . . . . . . . . . . . . . . -96.95 32.77 2.04 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 115.93 -0.577 . . . . 256.68 112.275 -179.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 224' ' ' ALA . . . . . . . . . . . . . . . -71.29 -30.31 66.09 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.231 -0.587 . . . . 280.25 111.538 178.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 225' ' ' GLN . . . . . . . . . . . . . . . -87.58 -2.81 58.87 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 112.972 0.73 . . . . 317.25 112.972 178.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 226' ' ' LEU . . . . . . . . . . . . . . . -80.51 135.07 53.59 Favored Pre-proline 0 C--O 1.234 0.255 0 CA-C-N 118.412 0.551 . . . . 280.71 110.312 179.655 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 227' ' ' PRO . . . . . . . . . . . . . 66.3 Cg_endo -69.7 -23.96 30.48 Favored 'Trans proline' 0 C--O 1.237 0.453 0 N-CA-C 113.438 0.515 . . . . 265.86 113.438 -179.514 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 228' ' ' GLU . . . . . . . . . . . . . . . -70.8 -12.9 61.83 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 112.873 0.694 . . . . 273.76 112.873 -179.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 229' ' ' ALA . . . . . . . . . . . . . . . -90.38 6.8 41.69 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 112.832 0.678 . . . . 284.69 112.832 179.454 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 230' ' ' HIS . . . . . . . . . . . . . . . -128.76 -42.57 1.42 Allowed 'General case' 0 C--N 1.322 -0.591 0 N-CA-C 112.938 0.718 . . . . 254.36 112.938 -179.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 231' ' ' PHE . . . . . . . . . . . . . . . -120.06 129.31 54.16 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.47 -0.567 . . . . 271.58 109.47 -179.028 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 232' ' ' THR . . . . . . . . . . . . . . . -130.27 165.29 22.74 Favored 'General case' 0 C--O 1.234 0.24 0 CA-C-O 121.507 0.67 . . . . 255.67 109.527 179.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 233' ' ' VAL . . . . . . . . . . . . . . . -83.9 122.83 38.29 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 N-CA-C 108.65 -0.87 . . . . 238.94 108.65 179.489 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 234' ' ' GLN . . . . . . . . . . . . . . . -133.18 -3.57 3.1 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 114.44 1.274 . . . . 243.73 114.44 178.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 235' ' ' ALA . . . . . . . . . . . . . . . -156.91 169.26 25.19 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 119.375 0.988 . . . . 249.17 108.847 179.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 236' ' ' PHE . . . . . . . . . . . . . . . -136.49 137.59 40.5 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 115.431 -0.804 . . . . 240.69 109.292 176.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 237' ' ' VAL . . . . . . . . . . . . . . . -112.42 112.24 39.61 Favored 'Isoleucine or valine' 0 C--O 1.237 0.441 0 N-CA-C 108.059 -1.089 . . . . 230.09 108.059 -175.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 238' ' ' GLN . . . . . . . . . . . . . . . -111.38 129.26 56.07 Favored 'General case' 0 C--O 1.235 0.323 0 N-CA-C 108.739 -0.838 . . . . 250.73 108.739 174.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 239' ' ' THR . . . . . . . . . . . . . 74.3 p -116.89 159.86 21.77 Favored 'General case' 0 C--O 1.234 0.253 0 CA-C-O 121.542 0.687 . . . . 277.57 110.802 -173.204 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 240' ' ' LEU . . . . . . . . . . . . . . . -154.45 138.85 16.73 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 115.152 -0.931 . . . . 240.85 108.812 177.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 241' ' ' SER . . . . . . . . . . . . . 88.8 p -135.11 162.21 33.13 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.633 0.73 . . . . 260.44 110.07 -176.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 242' ' ' GLY . . . . . . . . . . . . . . . 84.52 -140.14 18.66 Favored Glycine 0 N--CA 1.449 -0.455 0 CA-C-N 115.221 -0.899 . . . . 249.07 112.635 -179.152 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 243' ' ' ALA . . . . . . . . . . . . . . . -80.05 -20.87 44.23 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 112.68 0.622 . . . . 275.68 112.68 177.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 244' ' ' ALA . . . . . . . . . . . . . . . -68.34 -26.8 65.79 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.437 -0.505 . . . . 260.8 111.532 177.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 245' ' ' ALA . . . . . . . . . . . . . . . -73.15 5.94 3.12 Favored 'General case' 0 C--O 1.238 0.491 0 N-CA-C 112.968 0.729 . . . . 251.27 112.968 177.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 246' ' ' ARG . . . . . . . . . . . . . 33.9 ttm-85 -126.28 -17.86 5.09 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 113.767 1.025 . . . . 245.12 113.767 177.786 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 247' ' ' ASN . . . . . . . . . . . . . 46.2 t30 -76.07 125.62 29.48 Favored 'General case' 0 C--O 1.237 0.416 0 CA-C-N 119.144 0.884 . . . . 267.3 109.449 178.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 248' ' ' ALA . . . . . . . . . . . . . . . -70.79 -23.67 62.43 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 112.53 0.567 . . . . 269.87 112.53 -179.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 249' ' ' GLU . . . . . . . . . . . . . . . -71.76 -39.15 70.18 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 120.08 -0.648 . . . . 281.87 111.197 179.358 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 250' ' ' GLU . . . . . . . . . . . . . 17.6 tt0 -77.8 -24.48 48.78 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 112.259 0.466 . . . . 259.29 112.259 178.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 251' ' ' TYR . . . . . . . . . . . . . . . -66.46 -32.07 73.21 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 120.098 -0.641 . . . . 237.57 111.2 174.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 252' ' ' ARG . . . . . . . . . . . . . . . -72.94 -15.27 61.57 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 112.025 0.38 . . . . 242.62 112.025 174.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 253' ' ' ALA . . . . . . . . . . . . . . . -90.64 -19.38 23.72 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 113.026 0.75 . . . . 258.2 113.026 177.476 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 254' ' ' ALA . . . . . . . . . . . . . . . -85.86 -29.5 23.66 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 118.273 0.488 . . . . 252.28 112.023 178.236 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 255' ' ' LEU . . . . . . . . . . . . . . . -66.24 -35.59 80.83 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.614 -0.435 . . . . 252.52 111.27 177.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 256' ' ' LYS . . . . . . . . . . . . . . . -77.18 -33.33 56.44 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 120.279 -0.569 . . . . 272.33 111.563 173.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 257' ' ' THR . . . . . . . . . . . . . . . -68.26 -22.58 64.75 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 112.013 0.375 . . . . 269.04 112.013 175.074 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 258' ' ' ALA . . . . . . . . . . . . . . . -90.59 -31.48 16.67 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 112.433 0.531 . . . . 277.14 112.433 174.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 259' ' ' ALA . . . . . . . . . . . . . . . -74.35 -28.93 61.36 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.341 -0.544 . . . . 286.69 111.464 176.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 260' ' ' ALA . . . . . . . . . . . . . . . -78.99 -35.09 43.47 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.714 -0.394 . . . . 305.05 111.353 174.56 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 261' ' ' ALA . . . . . . . . . . . . . . . -71.09 -15.43 62.52 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.493 -0.483 . . . . 292.02 111.717 176.444 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 262' ' ' LEU . . . . . . . . . . . . . . . -84.32 -41.6 16.64 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 125.031 1.332 . . . . 304.82 112.165 174.259 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 263' ' ' GLU . . . . . . . . . . . . . . . -67.14 -35.53 79.92 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.317 -0.553 . . . . 301.12 111.258 177.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 264' ' ' GLU . . . . . . . . . . . . . . . -73.54 -41.67 62.69 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 111.72 0.266 . . . . 295.69 111.72 177.662 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 265' ' ' TYR . . . . . . . . . . . . . . . -69.12 -44.19 72.88 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.21 -0.596 . . . . 302.61 111.151 178.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 266' ' ' GLN . . . . . . . . . . . . . . . -69.96 -24.74 63.38 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 120.572 -0.451 . . . . 286.53 112.126 176.509 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 267' ' ' GLY . . . . . . . . . . . . . . . -80.48 -18.12 71.85 Favored Glycine 0 C--N 1.336 0.545 0 C-N-CA 120.804 -0.712 . . . . 279.98 114.353 175.185 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 268' ' ' VAL . . . . . . . . . . . . . . . -92.2 -24.46 5.39 Favored 'Isoleucine or valine' 0 C--O 1.239 0.551 0 CA-C-N 117.677 0.739 . . . . 289.1 112.768 177.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 269' ' ' THR . . . . . . . . . . . . . 41.2 p -76.08 -34.76 59.56 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-N 118.387 0.539 . . . . 304.49 111.519 177.092 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 270' ' ' THR . . . . . . . . . . . . . 9.5 t -69.82 -16.41 63.27 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 112.183 0.438 . . . . 288.28 112.183 174.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 271' ' ' ARG . . . . . . . . . . . . . . . -89.66 -37.4 14.65 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 118.366 0.53 . . . . 289.7 111.825 175.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 272' ' ' GLN . . . . . . . . . . . . . . . -70.16 -25.69 63.57 Favored 'General case' 0 C--O 1.236 0.364 0 C-N-CA 120.24 -0.584 . . . . 281.49 111.55 176.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 273' ' ' LEU . . . . . . . . . . . . . . . -77.8 -27.2 50.08 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 111.915 0.339 . . . . 252.24 111.915 176.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 274' ' ' SER . . . . . . . . . . . . . 75.3 m -74.42 -24.67 59.13 Favored 'General case' 0 C--O 1.236 0.392 0 C-N-CA 120.24 -0.584 . . . . 261.61 111.531 177.046 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 275' ' ' GLU . . . . . . . . . . . . . . . -77.86 -11.31 59.88 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 112.933 0.716 . . . . 243.93 112.933 178.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 276' ' ' VAL . . . . . . . . . . . . . . . -100.31 -45.69 11.73 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 118.347 0.521 . . . . 254.34 111.51 179.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 277' ' ' LEU . . . . . . . . . . . . . . . -73.1 -7.58 51.96 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 112.786 0.662 . . . . 253.69 112.786 179.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 278' ' ' ARG . . . . . . . . . . . . . 42.2 ttp85 -66.45 -33.46 75.75 Favored 'General case' 0 C--O 1.237 0.397 0 CA-C-N 118.235 0.47 . . . . 281.12 111.666 178.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 279' ' ' HIS . . . . . . . . . . . . . 5.6 m-70 . . . . . 0 C--N 1.33 -0.281 0 CA-C-O 120.791 0.329 . . . . 264.16 111.354 179.792 . . . . . . . . 0 0 . 1 stop_ save_