data_6hee_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 6hee _Structure_validation_residue.Date_analyzed 2019-04-19 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 15.1 mt . . . . . 0 N--CA 1.465 0.303 0 CA-C-O 120.606 0.241 . . . . 90.2 111.262 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -101.91 144.1 30.97 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 122.886 0.474 . . . . 95.76 111.666 -166.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 1.7 t -99.23 145.31 27.39 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.596 0.712 . . . . 97.8 110.701 175.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -139.9 101.16 4.11 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 108.728 -0.841 . . . . 100.86 108.728 -168.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 1.6 pt -142.96 147.27 20.8 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 CA-C-O 121.756 0.788 . . . . 86.94 110.09 -178.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -70.62 144.05 51.27 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.094 -0.957 . . . . 97.0 111.136 -176.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -58.65 -42.63 88.84 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-N 115.644 -0.707 . . . . 87.25 111.665 -177.24 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 42.8 p-10 -65.61 -0.74 2.2 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 113.393 0.886 . . . . 75.24 113.393 -175.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 1.3 p -127.41 11.56 3.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 CA-C-N 119.056 0.844 . . . . 68.46 111.338 -176.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 1.5 ptt85 -107.86 140.5 40.87 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 121.035 -1.041 . . . . 81.98 112.242 -173.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 44.1 t -128.08 127.81 68.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 N-CA-C 106.828 -1.545 . . . . 54.96 106.828 175.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 9.4 t -100.82 126.8 54.44 Favored 'Isoleucine or valine' 0 C--O 1.241 0.607 0 N-CA-C 109.338 -0.615 . . . . 52.16 109.338 175.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 95.9 t -114.52 109.67 29.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 107.515 -1.291 . . . . 51.92 107.515 -178.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -88.56 130.1 35.33 Favored 'General case' 0 C--O 1.231 0.1 0 C-N-CA 122.517 0.327 . . . . 55.31 110.328 -176.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 63.9 mt -91.27 134.09 30.91 Favored 'Isoleucine or valine' 0 C--O 1.24 0.569 0 N-CA-C 109.748 -0.464 . . . . 50.65 109.748 -171.962 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 59.9 mtp85 -48.99 135.79 15.3 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.151 0.5 . . . . 93.92 110.325 173.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 11.4 mmtt -60.49 -22.74 63.86 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 113.21 0.819 . . . . 64.5 113.21 -177.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 46.7 p30 -96.7 10.89 37.36 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 119.04 0.836 . . . . 76.05 112.969 -179.111 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 41.4 t -114.05 127.87 71.26 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 N-CA-C 108.028 -1.101 . . . . 62.06 108.028 -179.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -108.15 65.27 0.63 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.485 -0.561 . . . . 83.95 109.485 -178.325 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -60.74 -28.44 68.69 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 112.72 0.637 . . . . 56.77 112.72 -171.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 58.2 t30 -99.85 4.79 45.35 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 113.33 0.863 . . . . 55.45 113.33 -174.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 60.3 m -99.19 122.15 41.99 Favored 'General case' 0 C--O 1.24 0.603 0 N-CA-C 108.946 -0.761 . . . . 59.36 108.946 -179.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -75.99 -27.88 57.6 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 120.218 -0.593 . . . . 67.99 111.803 177.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.1 p -124.84 148.02 48.45 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-O 121.537 0.684 . . . . 60.86 111.435 177.28 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 38.6 pt -139.97 168.03 18.21 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 N-CA-C 108.527 -0.916 . . . . 60.33 108.527 176.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -97.1 121.85 39.44 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.71 -0.677 . . . . 56.31 109.411 -179.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 27.4 mmtt -130.33 124.06 31.42 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 109.753 -0.462 . . . . 78.94 109.753 174.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 67.5 mm-40 55.31 29.39 12.87 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 123.47 0.708 . . . . 71.9 112.118 179.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 90.15 -0.74 79.06 Favored Glycine 0 N--CA 1.446 -0.678 0 CA-C-O 119.025 -0.875 . . . . 51.72 114.962 175.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -111.73 158.37 19.41 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 118.593 1.196 . . . . 66.77 110.745 174.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 89.2 m -87.27 110.23 20.06 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 107.527 -1.286 . . . . 64.56 107.527 171.827 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 7.2 m -118.68 158.95 19.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 108.189 -1.041 . . . . 59.97 108.189 179.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 12.0 p -68.33 146.59 53.13 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 118.571 -1.252 . . . . 70.58 108.891 176.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 22.4 t30 -88.35 112.64 23.1 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 108.745 -0.835 . . . . 66.42 108.745 -178.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 79.5 m-20 -72.09 -21.62 61.47 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 116.269 -0.423 . . . . 80.17 112.133 -173.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -95.16 15.29 19.51 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 113.037 0.754 . . . . 73.11 113.037 175.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -58.24 131.78 51.62 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.367 -0.533 . . . . 62.52 110.446 178.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 56.95 32.47 21.63 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 112.591 0.589 . . . . 58.41 112.591 177.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 1.6 tptm -73.33 -41.67 63.22 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 118.526 -1.27 . . . . 78.62 110.43 174.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 97.4 t -70.35 -46.83 69.58 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 N-CA-C 109.736 -0.468 . . . . 57.06 109.736 176.503 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 86.7 t80 -49.87 -49.9 47.73 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 120.932 -0.307 . . . . 56.54 110.849 176.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -67.34 -40.84 85.9 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.02 0.378 . . . . 57.17 112.02 -173.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 49.6 m -61.29 -32.56 72.4 Favored 'General case' 0 C--O 1.239 0.533 0 C-N-CA 119.307 -0.957 . . . . 59.73 112.1 174.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 87.0 mt -78.07 -48.63 15.63 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 119.354 -0.938 . . . . 55.94 110.782 -179.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 9.8 tptm -58.43 -31.97 68.24 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 112.324 0.491 . . . . 62.54 112.324 178.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 9.7 m-20 -84.42 0.22 50.32 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 113.864 1.061 . . . . 87.52 113.864 -176.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' MET . . . . . . . . . . . . . 71.5 mtp -72.29 130.98 42.07 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 119.395 0.998 . . . . 66.8 109.433 168.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 91.5 p -57.82 -33.47 68.65 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 112.182 0.438 . . . . 70.89 112.182 178.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 16.9 p -79.51 -1.04 35.78 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 114.036 1.125 . . . . 66.05 114.036 -175.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 24.5 t -99.86 136.15 32.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-N 119.179 0.9 . . . . 59.74 109.798 -173.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 10.0 ttmm -93.57 -51.82 4.77 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 120.398 -0.521 . . . . 85.77 112.302 179.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 75.7 p -147.43 160.98 41.96 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.58 0.705 . . . . 58.55 109.356 177.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 48.5 t -138.63 109.79 5.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 N-CA-C 106.991 -1.485 . . . . 52.22 106.991 -176.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 9.8 m -115.78 126.25 53.79 Favored 'General case' 0 C--O 1.242 0.671 0 CA-C-O 120.968 0.413 . . . . 50.6 111.118 -173.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -70.55 131.66 44.32 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.17 -0.468 . . . . 52.19 111.089 178.095 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 29.8 t -122.37 112.58 18.27 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 109.315 -0.624 . . . . 52.07 109.315 172.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 60.4 p -80.33 156.43 26.76 Favored 'General case' 0 C--O 1.243 0.738 0 CA-C-O 122.279 1.037 . . . . 56.28 111.285 -175.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 18.7 pttm -64.06 -32.09 73.51 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-N 114.691 -1.141 . . . . 67.08 111.228 176.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 43.6 mp0 -59.06 -47.57 84.74 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 120.246 -0.582 . . . . 61.37 111.648 174.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -74.22 -29.21 61.61 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 118.436 -1.305 . . . . 71.4 111.089 -177.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 65.6 mt-30 -64.18 -42.67 96.58 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 120.714 -0.394 . . . . 58.37 111.548 174.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 31.7 t80 -58.95 -50.32 74.51 Favored 'General case' 0 C--O 1.24 0.597 0 C-N-CA 119.694 -0.802 . . . . 63.74 110.961 175.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -53.45 -45.31 69.45 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 120.986 0.422 . . . . 98.69 110.692 179.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 10.3 tptm -64.27 -34.58 78.44 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 119.243 -0.983 . . . . 80.16 110.842 178.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 44.2 tp -64.56 -40.42 95.53 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 119.927 -0.709 . . . . 59.27 111.517 -179.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 27.4 p -72.27 -33.22 67.29 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 119.994 -0.682 . . . . 68.14 111.025 178.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -65.11 -24.47 67.44 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 120.763 -0.375 . . . . 84.07 111.79 174.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 79.5 mt -91.43 -42.93 14.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 C-N-CA 120.06 -0.656 . . . . 69.53 111.556 179.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 14.6 mmt -94.23 -10.62 32.4 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 124.377 1.071 . . . . 68.57 112.677 -173.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 84.13 146.38 7.4 Favored Glycine 0 N--CA 1.441 -0.977 0 C-N-CA 119.655 -1.26 . . . . 76.31 114.593 -172.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' ASP . . . . . 0.643 ' N ' ' O ' ' A' ' 301' ' ' HOH . 1.3 t0 49.17 163.17 0.0 OUTLIER 'General case' 0 C--O 1.236 0.352 0 C-N-CA 128.637 2.775 . . . . 86.98 114.78 171.797 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -71.81 146.52 47.97 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.417 -0.811 . . . . 89.51 109.724 171.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' TRP . . . . . 0.403 ' CD1' ' N ' ' A' ' 123' ' ' TRP . 8.6 m0 -81.3 82.38 7.18 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 106.419 -1.697 . . . . 69.62 106.419 170.364 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 12.7 mmtt -50.71 -44.28 58.1 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 114.758 -1.11 . . . . 89.44 112.261 -165.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 1.3 pt -71.43 -17.97 19.95 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 C-N-CA 118.739 -1.184 . . . . 71.81 111.78 -168.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -87.15 -12.65 46.34 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 113.246 0.832 . . . . 69.62 113.246 175.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -76.93 145.19 38.34 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 117.771 -1.572 . . . . 96.72 110.547 -167.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 86.79 -19.5 29.05 Favored Glycine 0 N--CA 1.445 -0.732 0 CA-C-N 115.206 -0.906 . . . . 64.55 114.529 -167.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 51.9 m-20 -93.34 170.11 9.86 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 118.447 1.123 . . . . 74.07 109.951 178.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -67.49 142.08 56.71 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.47 -0.786 . . . . 56.08 110.308 -175.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 45.4 t-20 -74.42 115.98 48.59 Favored Pre-proline 0 C--N 1.328 -0.356 0 N-CA-C 109.248 -0.649 . . . . 58.78 109.248 -178.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -84.56 -7.66 9.65 Favored 'Trans proline' 0 C--O 1.239 0.555 0 N-CA-C 114.25 0.827 . . . . 54.58 114.25 -178.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 49.4 mt -63.9 168.91 4.63 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 118.536 -1.266 . . . . 54.24 114.207 173.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -109.32 145.69 35.58 Favored 'General case' 0 C--O 1.178 -2.692 0 C-N-CA 116.279 -2.169 . . . . 52.0 111.697 -178.043 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -65.28 145.25 56.46 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 105.825 -1.917 . . . . 52.28 105.825 166.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -146.63 164.84 31.36 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 118.997 -1.081 . . . . 48.76 110.494 -178.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 60.6 m-85 -110.47 125.75 53.62 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 114.811 -1.086 . . . . 49.3 108.513 164.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' ILE . . . . . . . . . . . . . 7.5 mm -86.69 112.12 22.48 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 N-CA-C 105.344 -2.095 . . . . 50.77 105.344 171.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' VAL . . . . . . . . . . . . . 60.8 t -99.7 133.84 41.15 Favored 'Isoleucine or valine' 0 C--O 1.242 0.664 0 N-CA-C 109.288 -0.634 . . . . 53.33 109.288 -176.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -105.82 113.7 27.42 Favored 'General case' 0 C--O 1.239 0.525 0 N-CA-C 107.992 -1.114 . . . . 79.12 107.992 175.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' ALA . . . . . . . . . . . . . . . -70.43 153.36 43.05 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.768 -0.651 . . . . 60.21 110.741 174.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -63.74 -32.26 73.7 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 119.433 -0.907 . . . . 66.67 112.031 174.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -155.62 155.18 29.32 Favored Pre-proline 0 C--N 1.327 -0.403 0 N-CA-C 108.142 -1.058 . . . . 63.24 108.142 -174.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -58.74 -29.84 90.8 Favored 'Trans proline' 0 C--O 1.237 0.457 0 N-CA-C 114.714 1.005 . . . . 65.42 114.714 -178.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -74.37 -10.84 59.97 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 119.597 1.09 . . . . 67.93 113.451 -178.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 -85.49 -14.25 46.58 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 123.461 0.705 . . . . 68.62 112.742 177.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 17.9 t -59.01 -50.02 81.2 Favored 'Isoleucine or valine' 0 C--O 1.24 0.597 0 CA-C-O 121.037 0.446 . . . . 67.0 111.184 -170.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 13.5 pttm -59.91 -39.66 86.17 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 121.652 -0.655 . . . . 81.33 111.05 -175.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 5.5 m -69.18 -39.69 78.56 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 120.667 -0.413 . . . . 77.68 111.436 179.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' ILE . . . . . . . . . . . . . 95.3 mt -63.38 -41.02 91.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 C-N-CA 120.409 -0.516 . . . . 60.95 110.521 179.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -61.05 -56.08 25.22 Favored 'General case' 0 C--O 1.237 0.398 0 O-C-N 121.945 -0.472 . . . . 63.43 110.929 -178.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 79.4 mt-10 -54.85 -45.55 74.56 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 120.813 0.34 . . . . 85.01 111.254 179.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -64.47 -38.03 89.58 Favored 'General case' 0 C--O 1.24 0.571 0 C-N-CA 119.75 -0.78 . . . . 70.2 110.628 -179.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -67.41 -32.19 72.92 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 119.702 -0.799 . . . . 57.45 111.809 -179.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' LYS . . . . . . . . . . . . . 30.8 mttt -61.44 -31.49 71.44 Favored 'General case' 0 C--N 1.345 0.392 0 CA-C-N 118.388 0.54 . . . . 78.2 111.441 -177.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -78.43 -12.5 60.01 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 113.548 0.944 . . . . 71.45 113.548 -176.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' ILE . . . . . . . . . . . . . 46.3 mt -70.17 133.38 31.95 Favored 'Isoleucine or valine' 0 C--O 1.241 0.615 0 C-N-CA 119.81 -0.756 . . . . 60.1 109.677 -175.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -66.87 124.34 22.68 Favored 'General case' 0 C--O 1.242 0.71 0 CA-C-O 121.184 0.516 . . . . 87.11 109.779 176.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . 109.41 -13.24 33.29 Favored Glycine 0 N--CA 1.445 -0.765 0 CA-C-O 118.856 -0.969 . . . . 55.95 113.282 -176.01 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 48.8 t -87.9 126.88 41.38 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 N-CA-C 108.063 -1.088 . . . . 53.06 108.063 179.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 12.5 t -86.65 -50.05 7.07 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 119.904 -0.718 . . . . 58.08 111.593 178.003 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 -151.11 162.47 40.8 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 121.489 0.661 . . . . 76.05 109.351 178.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' VAL . . . . . . . . . . . . . 2.5 m -134.3 146.08 31.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 108.627 -0.879 . . . . 65.63 108.627 171.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 41.6 tt0 -117.79 120.97 39.56 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 107.6 -1.259 . . . . 77.49 107.6 173.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 21.9 p30 . . . . . 0 C--O 1.222 -0.384 0 N-CA-C 109.645 -0.502 . . . . 83.68 109.645 178.302 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' ILE . . . . . . . . . . . . . 7.9 mt . . . . . 0 CA--C 1.545 0.77 0 N-CA-C 110.03 -0.359 . . . . 113.23 110.03 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 69.83 120.07 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.862 1.265 . . . . 121.28 112.964 176.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -58.81 -36.87 75.18 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-N 116.107 -0.497 . . . . 113.04 111.678 -179.138 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -59.15 -36.7 75.72 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 112.088 0.403 . . . . 120.2 112.088 -168.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 3.4 m -114.18 13.95 8.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 O-C-N 122.039 -0.413 . . . . 115.76 111.646 -169.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -111.88 139.74 47.12 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-O 121.349 0.595 . . . . 109.69 111.564 -170.218 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 20.0 t -132.29 135.2 58.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.342 0 N-CA-C 107.472 -1.307 . . . . 96.98 107.472 172.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' VAL . . . . . . . . . . . . . 19.5 t -108.1 138.57 34.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 N-CA-C 108.245 -1.02 . . . . 90.83 108.245 178.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' VAL . . . . . . . . . . . . . 93.5 t -133.58 105.06 7.03 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 N-CA-C 106.139 -1.8 . . . . 88.2 106.139 -173.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -90.84 138.46 31.57 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.173 -0.677 . . . . 84.49 109.173 -179.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 1.5 pp -106.96 149.06 10.73 Favored 'Isoleucine or valine' 0 C--O 1.241 0.654 0 N-CA-C 108.553 -0.906 . . . . 87.81 108.553 -172.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -61.93 148.43 43.68 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.74 -0.664 . . . . 92.71 110.661 -169.431 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.02 -32.71 69.97 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.124 -0.944 . . . . 97.41 111.584 -175.095 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' ASP . . . . . . . . . . . . . 44.1 p-10 -90.73 21.74 3.91 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 124.138 0.975 . . . . 99.28 112.779 -174.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 16.3 t -129.73 138.95 52.87 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 N-CA-C 108.456 -0.942 . . . . 99.21 108.456 -177.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 3.0 mm-40 -124.5 70.23 1.11 Allowed 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 109.029 -0.73 . . . . 113.36 109.029 -173.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' ASP . . . . . 0.501 ' OD1' ' OH ' ' B' ' 137' ' ' TYR . 11.5 t70 -70.51 -4.76 24.48 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 118.146 -1.422 . . . . 120.98 113.676 -173.636 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' ASN . . . . . 0.525 ' ND2' ' O ' ' B' ' 71' ' ' ASN . 0.2 OUTLIER -131.25 -0.93 4.04 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 116.175 1.917 . . . . 108.67 116.175 -178.356 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' SER . . . . . . . . . . . . . 4.7 m -101.46 106.03 17.1 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 120.044 1.293 . . . . 112.11 107.676 170.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -54.42 -56.53 17.71 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.429 0.633 . . . . 118.35 110.775 -176.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.1 t -65.31 127.59 32.38 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.651 -0.5 . . . . 119.93 109.651 171.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 4.2 mt -122.51 124.28 70.41 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 N-CA-C 106.179 -1.785 . . . . 121.63 106.179 173.221 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' GLU . . . . . . . . . . . . . 2.0 pt-20 -109.58 95.84 5.88 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.622 -0.881 . . . . 129.55 108.622 178.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 14.6 mmtt -88.45 -51.36 5.76 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 123.857 0.863 . . . . 129.22 109.994 163.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -74.91 168.15 20.49 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 108.812 -0.81 . . . . 128.72 108.812 155.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' GLY . . . . . . . . . . . . . . . -53.12 -17.36 5.28 Favored Glycine 0 N--CA 1.449 -0.488 0 N-CA-C 115.368 0.907 . . . . 129.13 115.368 179.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -122.35 175.67 6.29 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 118.119 0.959 . . . . 127.33 111.183 -169.314 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' THR . . . . . . . . . . . . . 1.9 m -41.58 149.55 0.12 Allowed 'General case' 0 C--O 1.234 0.278 0 C-N-CA 129.285 3.034 . . . . 122.68 115.077 -176.273 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' VAL . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.277 0 CA-C-O 120.975 0.417 . . . . 119.32 110.515 165.48 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.433 0 CA-C-O 120.446 0.165 . . . . 115.14 111.291 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' TYR . . . . . 0.471 ' O ' ' N ' ' B' ' 89' ' ' LYS . 3.2 t80 -164.54 -145.3 0.08 Allowed 'General case' 0 C--O 1.239 0.506 0 N-CA-C 114.534 1.309 . . . . 117.17 114.534 175.935 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' HIS . . . . . 0.409 ' N ' ' CD2' ' B' ' 87' ' ' TYR . 1.9 m170 -48.27 -11.05 0.03 OUTLIER 'General case' 0 C--O 1.235 0.309 0 C-N-CA 126.694 1.997 . . . . 118.09 114.313 -162.036 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' LYS . . . . . 0.471 ' N ' ' O ' ' B' ' 87' ' ' TYR . 1.2 ttpt -57.65 -11.78 2.38 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 119.453 -0.899 . . . . 119.78 112.072 175.642 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' VAL . . . . . . . . . . . . . 66.3 t -72.31 -59.82 3.03 Favored 'Isoleucine or valine' 0 C--O 1.24 0.553 0 C-N-CA 119.904 -0.718 . . . . 117.06 109.764 163.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER -35.77 -83.96 0.01 OUTLIER 'General case' 0 C--N 1.346 0.418 0 C-N-CA 125.323 1.449 . . . . 122.29 112.928 178.3 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' ASP . . . . . 0.528 ' OD1' ' N ' ' B' ' 92' ' ' ASP . 4.2 p-10 -79.9 -5.9 56.42 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 119.141 -0.457 . . . . 120.3 111.245 -166.365 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' SER . . . . . . . . . . . . . 96.8 p -62.24 -33.46 74.63 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 118.542 -1.263 . . . . 116.93 111.219 168.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' LEU . . . . . . . . . . . . . 2.0 mp -76.79 -25.5 53.4 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 114.018 1.118 . . . . 119.8 114.018 170.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' LYS . . . . . . . . . . . . . 11.1 tptt -60.82 -50.54 73.04 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 120.499 -0.48 . . . . 120.22 110.688 178.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 . . . . . 0 N--CA 1.464 0.242 0 CA-C-O 120.908 0.385 . . . . 119.55 111.037 177.515 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' VAL . . . . . . . . . . . . . 18.3 t . . . . . 0 C--O 1.237 0.436 0 N-CA-C 112.513 0.561 . . . . 103.03 112.513 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' THR . . . . . . . . . . . . . 1.3 t -160.83 154.36 22.08 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 123.373 0.669 . . . . 100.36 109.837 -176.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -97.15 135.32 39.27 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 124.421 1.088 . . . . 89.0 110.668 -175.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 16.5 t -123.31 115.36 21.55 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 108.383 -0.969 . . . . 85.07 108.383 178.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.7 155.41 37.74 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 122.132 0.968 . . . . 79.14 111.107 -174.579 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 5.1 ptpt -63.77 -31.06 72.11 Favored 'General case' 0 C--O 1.239 0.523 0 CA-C-N 115.059 -0.973 . . . . 80.02 111.991 171.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' GLU . . . . . . . . . . . . . 27.4 mp0 -75.01 -35.62 61.97 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.335 -0.546 . . . . 75.82 111.419 -177.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -67.15 -45.93 75.6 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 120.748 -0.381 . . . . 103.27 110.744 172.11 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -51.15 -40.9 59.61 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 120.593 -0.443 . . . . 76.55 110.97 178.021 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' TYR . . . . . . . . . . . . . 91.5 t80 -69.31 -39.94 77.94 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 120.742 -0.383 . . . . 69.76 111.828 -179.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -64.49 -39.01 93.0 Favored 'General case' 0 C--O 1.243 0.718 0 C-N-CA 119.074 -1.05 . . . . 88.72 111.123 175.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' LYS . . . . . 0.412 ' NZ ' ' OE2' ' B' ' 117' ' ' GLU . 6.7 mmtt -64.34 -37.14 86.46 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 109.87 -0.419 . . . . 76.82 109.87 179.271 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 59.8 tp -64.15 -47.48 79.72 Favored 'General case' 0 C--O 1.243 0.736 0 CA-C-O 120.85 0.357 . . . . 61.08 111.166 -179.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' THR . . . . . . . . . . . . . 16.0 p -65.78 -33.06 74.98 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 118.753 -1.179 . . . . 65.25 111.192 177.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' GLU . . . . . 0.412 ' OE2' ' NZ ' ' B' ' 114' ' ' LYS . 6.1 tt0 -62.76 -37.36 86.32 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 119.568 -0.853 . . . . 71.94 110.184 178.966 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' ILE . . . . . . . . . . . . . 77.1 mt -79.88 -43.77 22.82 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.223 0 C-N-CA 122.885 0.474 . . . . 59.22 111.306 -175.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' MET . . . . . . . . . . . . . 50.0 mmm -92.25 -10.76 37.36 Favored 'General case' 0 C--O 1.241 0.621 0 N-CA-C 114.019 1.118 . . . . 79.33 114.019 -172.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 105.8 -169.39 15.95 Favored Glycine 0 N--CA 1.443 -0.841 0 N-CA-C 110.35 -1.1 . . . . 71.62 110.35 -173.166 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 23.7 p-10 -51.98 175.36 0.02 OUTLIER 'General case' 0 C--O 1.236 0.391 0 N-CA-C 115.014 1.487 . . . . 84.52 115.014 -164.389 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -49.08 159.59 0.26 Allowed 'General case' 0 C--O 1.238 0.495 0 CA-C-N 115.334 -0.848 . . . . 93.47 112.913 -177.91 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' TRP . . . . . 0.536 ' CD1' ' N ' ' B' ' 123' ' ' TRP . 5.1 m0 -102.8 85.01 2.48 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 104.33 -2.47 . . . . 82.21 104.33 171.739 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 7.6 tttm -59.24 -27.04 65.4 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 114.892 -1.049 . . . . 91.98 112.339 -165.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' ILE . . . . . . . . . . . . . 1.5 mp -72.58 -13.8 16.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 112.752 0.649 . . . . 69.62 112.752 -174.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -108.69 -6.85 15.77 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 113.77 1.026 . . . . 80.78 113.77 -177.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -62.92 -33.94 76.39 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 119.038 0.835 . . . . 84.34 112.037 -171.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . -77.96 5.2 54.87 Favored Glycine 0 N--CA 1.443 -0.864 0 N-CA-C 117.851 1.9 . . . . 86.75 117.851 -179.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -130.84 173.51 10.89 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 124.989 1.052 . . . . 87.01 110.527 -176.592 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.97 157.3 25.36 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 114.796 1.406 . . . . 81.63 114.796 -176.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' ASN . . . . . . . . . . . . . 42.8 t-20 -73.29 118.35 67.97 Favored Pre-proline 0 C--O 1.243 0.732 0 CA-C-N 115.037 -0.983 . . . . 81.77 109.868 178.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -82.23 -9.18 11.66 Favored 'Trans proline' 0 CA--C 1.51 -0.678 0 N-CA-C 114.069 0.757 . . . . 76.95 114.069 -176.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 10.0 mt -78.35 173.06 12.72 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 119.504 -0.878 . . . . 74.73 109.472 179.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 134' ' ' TYR . . . . . . . . . . . . . 42.8 m-85 -114.41 135.99 53.49 Favored 'General case' 0 C--O 1.239 0.523 0 CA-C-N 115.674 -0.693 . . . . 76.95 109.789 -173.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -55.49 146.17 20.88 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.163 -1.051 . . . . 83.75 108.163 163.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 136' ' ' ALA . . . . . . . . . . . . . . . -148.01 171.65 15.48 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 119.502 -0.879 . . . . 83.0 109.125 -176.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 137' ' ' TYR . . . . . 0.501 ' OH ' ' OD1' ' B' ' 70' ' ' ASP . 50.0 m-85 -125.14 120.02 30.19 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 106.932 -1.507 . . . . 106.05 106.932 170.971 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 138' ' ' ILE . . . . . . . . . . . . . 6.1 mm -83.15 131.92 32.61 Favored 'Isoleucine or valine' 0 C--O 1.239 0.516 0 N-CA-C 107.869 -1.16 . . . . 99.22 107.869 172.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 139' ' ' VAL . . . . . . . . . . . . . 32.6 t . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.42 -0.355 . . . . 99.0 110.367 -170.948 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.361 0 CA-C-O 119.814 -0.136 . . . . 126.59 111.214 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 144' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -55.4 -49.72 15.25 Favored 'Trans proline' 0 N--CA 1.481 0.779 0 N-CA-C 115.109 1.157 . . . . 121.75 115.109 -170.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 145' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -73.82 -17.08 61.12 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 118.916 0.78 . . . . 124.0 111.716 -178.008 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 146' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -94.73 66.38 3.15 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 122.363 1.077 . . . . 123.35 109.072 179.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 147' ' ' VAL . . . . . . . . . . . . . 3.9 m -127.47 -67.88 0.69 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.447 0 CA-C-N 115.279 -0.873 . . . . 118.99 111.523 -176.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 148' ' ' LYS . . . . . . . . . . . . . 5.3 mmtt -45.01 -27.57 0.57 Allowed 'General case' 0 C--O 1.234 0.252 0 C-N-CA 124.765 1.226 . . . . 118.92 111.338 -177.267 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 48.9 p -64.78 -65.01 0.73 Allowed 'General case' 0 C--O 1.239 0.533 0 CA-C-N 116.07 -0.514 . . . . 120.02 111.671 -175.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 150' ' ' ILE . . . . . . . . . . . . . 10.9 tp -71.31 -19.82 20.99 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.129 0 O-C-N 121.93 -0.481 . . . . 115.3 110.757 -174.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 151' ' ' ALA . . . . . . . . . . . . . . . -58.3 -58.88 6.55 Favored 'General case' 0 C--O 1.238 0.459 0 O-C-N 121.545 -0.722 . . . . 108.2 110.107 170.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 152' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -50.08 -47.57 53.57 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.046 0.45 . . . . 113.46 110.563 169.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 153' ' ' ASP . . . . . . . . . . . . . 1.3 t0 -57.32 -39.72 76.42 Favored 'General case' 0 C--N 1.327 -0.402 0 O-C-N 121.789 -0.569 . . . . 110.07 112.298 179.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -71.85 -27.65 63.03 Favored 'General case' 0 C--O 1.24 0.569 0 C-N-CA 120.409 -0.516 . . . . 104.95 111.771 -171.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 155' ' ' LYS . . . . . . . . . . . . . 4.6 ttpt -71.88 -14.84 62.06 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 119.738 -0.785 . . . . 107.91 111.544 177.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 156' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.83 -44.54 89.5 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 120.598 0.237 . . . . 107.08 111.314 179.772 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 157' ' ' ILE . . . . . . . . . . . . . 5.0 mp -56.92 138.41 17.72 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 CA-C-O 121.279 0.561 . . . . 99.21 110.856 -167.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 158' ' ' GLU . . . . . . . . . . . . . 26.2 pt-20 -64.59 148.22 51.28 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 121.464 0.649 . . . . 112.43 109.842 173.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 159' ' ' GLY . . . . . . . . . . . . . . . 88.38 -30.97 5.0 Favored Glycine 0 CA--C 1.528 0.899 0 N-CA-C 116.744 1.458 . . . . 99.85 116.744 -177.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 57.1 t -66.57 136.86 25.95 Favored 'Isoleucine or valine' 0 C--O 1.24 0.584 0 CA-C-N 117.866 0.833 . . . . 94.27 110.119 -177.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 2.8 t -85.83 -60.68 1.95 Allowed 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.179 -0.464 . . . . 87.08 110.946 177.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 73.7 mm-40 -146.47 166.63 25.86 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.328 0.585 . . . . 79.62 109.686 -179.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 163' ' ' VAL . . . . . . . . . . . . . 4.3 m -138.08 151.57 25.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 N-CA-C 109.163 -0.68 . . . . 88.71 109.163 172.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -133.75 138.01 45.52 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.122 -0.49 . . . . 87.7 110.457 -177.328 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 165' ' ' ASP . . . . . . . . . . . . . 1.9 p30 . . . . . 0 C--O 1.237 0.398 0 CA-C-O 121.645 0.736 . . . . 96.17 112.51 -177.63 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' UMQ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' TRS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . 0.643 ' O ' ' N ' ' A' ' 121' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 15.1 mt . . . . . 0 N--CA 1.465 0.303 0 CA-C-O 120.606 0.241 . . . . 90.2 111.262 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -101.91 144.1 30.97 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 122.886 0.474 . . . . 95.76 111.666 -166.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 1.7 t -99.23 145.31 27.39 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.596 0.712 . . . . 97.8 110.701 175.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -139.9 101.16 4.11 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 108.728 -0.841 . . . . 100.86 108.728 -168.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ILE . . . . . 0.549 HD11 ' HB2' ' A' ' 59' ' ' ARG . 1.6 pt -142.96 147.27 20.8 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 CA-C-O 121.756 0.788 . . . . 86.94 110.09 -178.296 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -70.62 144.05 51.27 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.094 -0.957 . . . . 97.0 111.136 -176.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -58.65 -42.63 88.84 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-N 115.644 -0.707 . . . . 87.25 111.665 -177.24 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 42.8 p-10 -65.61 -0.74 2.2 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 113.393 0.886 . . . . 75.24 113.393 -175.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' VAL . . . . . 0.413 HG22 ' HB3' ' A' ' 141' ' ' ALA . 1.3 p -127.41 11.56 3.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 CA-C-N 119.056 0.844 . . . . 68.46 111.338 -176.485 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ARG . . . . . 0.549 ' HB2' HD11 ' A' ' 54' ' ' ILE . 1.5 ptt85 -107.86 140.5 40.87 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 121.035 -1.041 . . . . 81.98 112.242 -173.232 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 44.1 t -128.08 127.81 68.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 N-CA-C 106.828 -1.545 . . . . 54.96 106.828 175.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' VAL . . . . . 0.41 HG23 ' NH1' ' A' ' 59' ' ' ARG . 9.4 t -100.82 126.8 54.44 Favored 'Isoleucine or valine' 0 C--O 1.241 0.607 0 N-CA-C 109.338 -0.615 . . . . 52.16 109.338 175.787 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 95.9 t -114.52 109.67 29.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 107.515 -1.291 . . . . 51.92 107.515 -178.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -88.56 130.1 35.33 Favored 'General case' 0 C--O 1.231 0.1 0 C-N-CA 122.517 0.327 . . . . 55.31 110.328 -176.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 63.9 mt -91.27 134.09 30.91 Favored 'Isoleucine or valine' 0 C--O 1.24 0.569 0 N-CA-C 109.748 -0.464 . . . . 50.65 109.748 -171.962 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 59.9 mtp85 -48.99 135.79 15.3 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.151 0.5 . . . . 93.92 110.325 173.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 11.4 mmtt -60.49 -22.74 63.86 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 113.21 0.819 . . . . 64.5 113.21 -177.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 46.7 p30 -96.7 10.89 37.36 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 119.04 0.836 . . . . 76.05 112.969 -179.111 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 41.4 t -114.05 127.87 71.26 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 N-CA-C 108.028 -1.101 . . . . 62.06 108.028 -179.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -108.15 65.27 0.63 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.485 -0.561 . . . . 83.95 109.485 -178.325 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -60.74 -28.44 68.69 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 112.72 0.637 . . . . 56.77 112.72 -171.483 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 58.2 t30 -99.85 4.79 45.35 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 113.33 0.863 . . . . 55.45 113.33 -174.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 60.3 m -99.19 122.15 41.99 Favored 'General case' 0 C--O 1.24 0.603 0 N-CA-C 108.946 -0.761 . . . . 59.36 108.946 -179.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -75.99 -27.88 57.6 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 120.218 -0.593 . . . . 67.99 111.803 177.121 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.1 p -124.84 148.02 48.45 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-O 121.537 0.684 . . . . 60.86 111.435 177.28 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ILE . . . . . 0.409 HG23 ' HB2' ' A' ' 84' ' ' ASN . 38.6 pt -139.97 168.03 18.21 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 N-CA-C 108.527 -0.916 . . . . 60.33 108.527 176.438 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -97.1 121.85 39.44 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.71 -0.677 . . . . 56.31 109.411 -179.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 27.4 mmtt -130.33 124.06 31.42 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 109.753 -0.462 . . . . 78.94 109.753 174.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 67.5 mm-40 55.31 29.39 12.87 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 123.47 0.708 . . . . 71.9 112.118 179.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 90.15 -0.74 79.06 Favored Glycine 0 N--CA 1.446 -0.678 0 CA-C-O 119.025 -0.875 . . . . 51.72 114.962 175.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -111.73 158.37 19.41 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 118.593 1.196 . . . . 66.77 110.745 174.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 89.2 m -87.27 110.23 20.06 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 107.527 -1.286 . . . . 64.56 107.527 171.827 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 7.2 m -118.68 158.95 19.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 108.189 -1.041 . . . . 59.97 108.189 179.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 12.0 p -68.33 146.59 53.13 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 118.571 -1.252 . . . . 70.58 108.891 176.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ASN . . . . . 0.409 ' HB2' HG23 ' A' ' 75' ' ' ILE . 22.4 t30 -88.35 112.64 23.1 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 108.745 -0.835 . . . . 66.42 108.745 -178.728 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 79.5 m-20 -72.09 -21.62 61.47 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 116.269 -0.423 . . . . 80.17 112.133 -173.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -95.16 15.29 19.51 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 113.037 0.754 . . . . 73.11 113.037 175.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -58.24 131.78 51.62 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.367 -0.533 . . . . 62.52 110.446 178.044 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 56.95 32.47 21.63 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 112.591 0.589 . . . . 58.41 112.591 177.052 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 1.6 tptm -73.33 -41.67 63.22 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 118.526 -1.27 . . . . 78.62 110.43 174.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 97.4 t -70.35 -46.83 69.58 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 N-CA-C 109.736 -0.468 . . . . 57.06 109.736 176.503 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 86.7 t80 -49.87 -49.9 47.73 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 120.932 -0.307 . . . . 56.54 110.849 176.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -67.34 -40.84 85.9 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.02 0.378 . . . . 57.17 112.02 -173.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 49.6 m -61.29 -32.56 72.4 Favored 'General case' 0 C--O 1.239 0.533 0 C-N-CA 119.307 -0.957 . . . . 59.73 112.1 174.245 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 87.0 mt -78.07 -48.63 15.63 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 119.354 -0.938 . . . . 55.94 110.782 -179.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 9.8 tptm -58.43 -31.97 68.24 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 112.324 0.491 . . . . 62.54 112.324 178.036 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 9.7 m-20 -84.42 0.22 50.32 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 113.864 1.061 . . . . 87.52 113.864 -176.543 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' MET . . . . . 0.622 ' HE1' ' HA ' ' A' ' 150' ' ' ILE . 71.5 mtp -72.29 130.98 42.07 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 119.395 0.998 . . . . 66.8 109.433 168.925 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 91.5 p -57.82 -33.47 68.65 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 112.182 0.438 . . . . 70.89 112.182 178.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 16.9 p -79.51 -1.04 35.78 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 114.036 1.125 . . . . 66.05 114.036 -175.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 24.5 t -99.86 136.15 32.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-N 119.179 0.9 . . . . 59.74 109.798 -173.606 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 10.0 ttmm -93.57 -51.82 4.77 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 120.398 -0.521 . . . . 85.77 112.302 179.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 75.7 p -147.43 160.98 41.96 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.58 0.705 . . . . 58.55 109.356 177.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 48.5 t -138.63 109.79 5.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 N-CA-C 106.991 -1.485 . . . . 52.22 106.991 -176.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 9.8 m -115.78 126.25 53.79 Favored 'General case' 0 C--O 1.242 0.671 0 CA-C-O 120.968 0.413 . . . . 50.6 111.118 -173.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -70.55 131.66 44.32 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.17 -0.468 . . . . 52.19 111.089 178.095 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 29.8 t -122.37 112.58 18.27 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 109.315 -0.624 . . . . 52.07 109.315 172.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 60.4 p -80.33 156.43 26.76 Favored 'General case' 0 C--O 1.243 0.738 0 CA-C-O 122.279 1.037 . . . . 56.28 111.285 -175.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 18.7 pttm -64.06 -32.09 73.51 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-N 114.691 -1.141 . . . . 67.08 111.228 176.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 43.6 mp0 -59.06 -47.57 84.74 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 120.246 -0.582 . . . . 61.37 111.648 174.499 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -74.22 -29.21 61.61 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 118.436 -1.305 . . . . 71.4 111.089 -177.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 65.6 mt-30 -64.18 -42.67 96.58 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 120.714 -0.394 . . . . 58.37 111.548 174.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 31.7 t80 -58.95 -50.32 74.51 Favored 'General case' 0 C--O 1.24 0.597 0 C-N-CA 119.694 -0.802 . . . . 63.74 110.961 175.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -53.45 -45.31 69.45 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 120.986 0.422 . . . . 98.69 110.692 179.007 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 10.3 tptm -64.27 -34.58 78.44 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 119.243 -0.983 . . . . 80.16 110.842 178.308 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 44.2 tp -64.56 -40.42 95.53 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 119.927 -0.709 . . . . 59.27 111.517 -179.086 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 27.4 p -72.27 -33.22 67.29 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 119.994 -0.682 . . . . 68.14 111.025 178.801 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -65.11 -24.47 67.44 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 120.763 -0.375 . . . . 84.07 111.79 174.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 79.5 mt -91.43 -42.93 14.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 C-N-CA 120.06 -0.656 . . . . 69.53 111.556 179.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 14.6 mmt -94.23 -10.62 32.4 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 124.377 1.071 . . . . 68.57 112.677 -173.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 84.13 146.38 7.4 Favored Glycine 0 N--CA 1.441 -0.977 0 C-N-CA 119.655 -1.26 . . . . 76.31 114.593 -172.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' ASP . . . . . 0.643 ' N ' ' O ' ' A' ' 301' ' ' HOH . 1.3 t0 49.17 163.17 0.0 OUTLIER 'General case' 0 C--O 1.236 0.352 0 C-N-CA 128.637 2.775 . . . . 86.98 114.78 171.797 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -71.81 146.52 47.97 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.417 -0.811 . . . . 89.51 109.724 171.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' TRP . . . . . 0.403 ' CD1' ' N ' ' A' ' 123' ' ' TRP . 8.6 m0 -81.3 82.38 7.18 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 106.419 -1.697 . . . . 69.62 106.419 170.364 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 124' ' ' LYS . . . . . 0.525 ' HG2' ' O ' ' A' ' 306' ' ' HOH . 12.7 mmtt -50.71 -44.28 58.1 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 114.758 -1.11 . . . . 89.44 112.261 -165.855 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 1.3 pt -71.43 -17.97 19.95 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 C-N-CA 118.739 -1.184 . . . . 71.81 111.78 -168.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -87.15 -12.65 46.34 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 113.246 0.832 . . . . 69.62 113.246 175.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -76.93 145.19 38.34 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 117.771 -1.572 . . . . 96.72 110.547 -167.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 86.79 -19.5 29.05 Favored Glycine 0 N--CA 1.445 -0.732 0 CA-C-N 115.206 -0.906 . . . . 64.55 114.529 -167.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 51.9 m-20 -93.34 170.11 9.86 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 118.447 1.123 . . . . 74.07 109.951 178.661 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -67.49 142.08 56.71 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.47 -0.786 . . . . 56.08 110.308 -175.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 45.4 t-20 -74.42 115.98 48.59 Favored Pre-proline 0 C--N 1.328 -0.356 0 N-CA-C 109.248 -0.649 . . . . 58.78 109.248 -178.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -84.56 -7.66 9.65 Favored 'Trans proline' 0 C--O 1.239 0.555 0 N-CA-C 114.25 0.827 . . . . 54.58 114.25 -178.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 49.4 mt -63.9 168.91 4.63 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 118.536 -1.266 . . . . 54.24 114.207 173.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -109.32 145.69 35.58 Favored 'General case' 0 C--O 1.178 -2.692 0 C-N-CA 116.279 -2.169 . . . . 52.0 111.697 -178.043 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -65.28 145.25 56.46 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 105.825 -1.917 . . . . 52.28 105.825 166.499 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -146.63 164.84 31.36 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 118.997 -1.081 . . . . 48.76 110.494 -178.178 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 60.6 m-85 -110.47 125.75 53.62 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 114.811 -1.086 . . . . 49.3 108.513 164.264 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' ILE . . . . . . . . . . . . . 7.5 mm -86.69 112.12 22.48 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 N-CA-C 105.344 -2.095 . . . . 50.77 105.344 171.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' VAL . . . . . . . . . . . . . 60.8 t -99.7 133.84 41.15 Favored 'Isoleucine or valine' 0 C--O 1.242 0.664 0 N-CA-C 109.288 -0.634 . . . . 53.33 109.288 -176.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -105.82 113.7 27.42 Favored 'General case' 0 C--O 1.239 0.525 0 N-CA-C 107.992 -1.114 . . . . 79.12 107.992 175.657 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' ALA . . . . . 0.413 ' HB3' HG22 ' A' ' 58' ' ' VAL . . . -70.43 153.36 43.05 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.768 -0.651 . . . . 60.21 110.741 174.931 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -63.74 -32.26 73.7 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 119.433 -0.907 . . . . 66.67 112.031 174.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -155.62 155.18 29.32 Favored Pre-proline 0 C--N 1.327 -0.403 0 N-CA-C 108.142 -1.058 . . . . 63.24 108.142 -174.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -58.74 -29.84 90.8 Favored 'Trans proline' 0 C--O 1.237 0.457 0 N-CA-C 114.714 1.005 . . . . 65.42 114.714 -178.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -74.37 -10.84 59.97 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 119.597 1.09 . . . . 67.93 113.451 -178.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 -85.49 -14.25 46.58 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 123.461 0.705 . . . . 68.62 112.742 177.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 17.9 t -59.01 -50.02 81.2 Favored 'Isoleucine or valine' 0 C--O 1.24 0.597 0 CA-C-O 121.037 0.446 . . . . 67.0 111.184 -170.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 13.5 pttm -59.91 -39.66 86.17 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 121.652 -0.655 . . . . 81.33 111.05 -175.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 5.5 m -69.18 -39.69 78.56 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 120.667 -0.413 . . . . 77.68 111.436 179.314 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' ILE . . . . . 0.622 ' HA ' ' HE1' ' A' ' 97' ' ' MET . 95.3 mt -63.38 -41.02 91.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 C-N-CA 120.409 -0.516 . . . . 60.95 110.521 179.58 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -61.05 -56.08 25.22 Favored 'General case' 0 C--O 1.237 0.398 0 O-C-N 121.945 -0.472 . . . . 63.43 110.929 -178.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 79.4 mt-10 -54.85 -45.55 74.56 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 120.813 0.34 . . . . 85.01 111.254 179.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -64.47 -38.03 89.58 Favored 'General case' 0 C--O 1.24 0.571 0 C-N-CA 119.75 -0.78 . . . . 70.2 110.628 -179.772 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -67.41 -32.19 72.92 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 119.702 -0.799 . . . . 57.45 111.809 -179.679 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 155' ' ' LYS . . . . . 0.444 ' HE3' HG22 ' A' ' 163' ' ' VAL . 30.8 mttt -61.44 -31.49 71.44 Favored 'General case' 0 C--N 1.345 0.392 0 CA-C-N 118.388 0.54 . . . . 78.2 111.441 -177.787 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -78.43 -12.5 60.01 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 113.548 0.944 . . . . 71.45 113.548 -176.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 157' ' ' ILE . . . . . . . . . . . . . 46.3 mt -70.17 133.38 31.95 Favored 'Isoleucine or valine' 0 C--O 1.241 0.615 0 C-N-CA 119.81 -0.756 . . . . 60.1 109.677 -175.809 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -66.87 124.34 22.68 Favored 'General case' 0 C--O 1.242 0.71 0 CA-C-O 121.184 0.516 . . . . 87.11 109.779 176.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . 109.41 -13.24 33.29 Favored Glycine 0 N--CA 1.445 -0.765 0 CA-C-O 118.856 -0.969 . . . . 55.95 113.282 -176.01 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 48.8 t -87.9 126.88 41.38 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 N-CA-C 108.063 -1.088 . . . . 53.06 108.063 179.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 12.5 t -86.65 -50.05 7.07 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 119.904 -0.718 . . . . 58.08 111.593 178.003 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 -151.11 162.47 40.8 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 121.489 0.661 . . . . 76.05 109.351 178.191 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 163' ' ' VAL . . . . . 0.444 HG22 ' HE3' ' A' ' 155' ' ' LYS . 2.5 m -134.3 146.08 31.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 108.627 -0.879 . . . . 65.63 108.627 171.167 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 41.6 tt0 -117.79 120.97 39.56 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 107.6 -1.259 . . . . 77.49 107.6 173.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 21.9 p30 . . . . . 0 C--O 1.222 -0.384 0 N-CA-C 109.645 -0.502 . . . . 83.68 109.645 178.302 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 54' ' ' ILE . . . . . . . . . . . . . 7.9 mt . . . . . 0 CA--C 1.545 0.77 0 N-CA-C 110.03 -0.359 . . . . 113.23 110.03 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 55' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 69.83 120.07 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.862 1.265 . . . . 121.28 112.964 176.378 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' ASN . . . . . 0.442 ' HA ' ' HG2' ' B' ' 59' ' ' ARG . 0.9 OUTLIER -58.81 -36.87 75.18 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-N 116.107 -0.497 . . . . 113.04 111.678 -179.138 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 57' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -59.15 -36.7 75.72 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 112.088 0.403 . . . . 120.2 112.088 -168.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 3.4 m -114.18 13.95 8.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 O-C-N 122.039 -0.413 . . . . 115.76 111.646 -169.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' ARG . . . . . 0.442 ' HG2' ' HA ' ' B' ' 56' ' ' ASN . 0.2 OUTLIER -111.88 139.74 47.12 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-O 121.349 0.595 . . . . 109.69 111.564 -170.218 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 20.0 t -132.29 135.2 58.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.342 0 N-CA-C 107.472 -1.307 . . . . 96.98 107.472 172.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' VAL . . . . . . . . . . . . . 19.5 t -108.1 138.57 34.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 N-CA-C 108.245 -1.02 . . . . 90.83 108.245 178.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' VAL . . . . . . . . . . . . . 93.5 t -133.58 105.06 7.03 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 N-CA-C 106.139 -1.8 . . . . 88.2 106.139 -173.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -90.84 138.46 31.57 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.173 -0.677 . . . . 84.49 109.173 -179.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' ILE . . . . . 0.428 HD12 ' O ' ' B' ' 65' ' ' ARG . 1.5 pp -106.96 149.06 10.73 Favored 'Isoleucine or valine' 0 C--O 1.241 0.654 0 N-CA-C 108.553 -0.906 . . . . 87.81 108.553 -172.989 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 65' ' ' ARG . . . . . 0.471 ' HB2' ' O ' ' B' ' 159' ' ' GLY . 0.6 OUTLIER -61.93 148.43 43.68 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.74 -0.664 . . . . 92.71 110.661 -169.431 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.02 -32.71 69.97 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.124 -0.944 . . . . 97.41 111.584 -175.095 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 67' ' ' ASP . . . . . . . . . . . . . 44.1 p-10 -90.73 21.74 3.91 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 124.138 0.975 . . . . 99.28 112.779 -174.718 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 16.3 t -129.73 138.95 52.87 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 N-CA-C 108.456 -0.942 . . . . 99.21 108.456 -177.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' GLU . . . . . 0.536 ' OE1' ' HB2' ' B' ' 72' ' ' SER . 3.0 mm-40 -124.5 70.23 1.11 Allowed 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 109.029 -0.73 . . . . 113.36 109.029 -173.549 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 70' ' ' ASP . . . . . 0.583 ' OD2' ' HB ' ' B' ' 90' ' ' VAL . 11.5 t70 -70.51 -4.76 24.48 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 118.146 -1.422 . . . . 120.98 113.676 -173.636 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 71' ' ' ASN . . . . . 0.471 ' O ' ' ND2' ' B' ' 71' ' ' ASN . 0.2 OUTLIER -131.25 -0.93 4.04 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 116.175 1.917 . . . . 108.67 116.175 -178.356 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 72' ' ' SER . . . . . 0.536 ' HB2' ' OE1' ' B' ' 69' ' ' GLU . 4.7 m -101.46 106.03 17.1 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 120.044 1.293 . . . . 112.11 107.676 170.569 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -54.42 -56.53 17.71 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.429 0.633 . . . . 118.35 110.775 -176.806 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.1 t -65.31 127.59 32.38 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.651 -0.5 . . . . 119.93 109.651 171.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 4.2 mt -122.51 124.28 70.41 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 N-CA-C 106.179 -1.785 . . . . 121.63 106.179 173.221 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' GLU . . . . . 0.447 ' O ' ' HG3' ' B' ' 76' ' ' GLU . 2.0 pt-20 -109.58 95.84 5.88 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.622 -0.881 . . . . 129.55 108.622 178.659 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 14.6 mmtt -88.45 -51.36 5.76 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 123.857 0.863 . . . . 129.22 109.994 163.169 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' GLU . . . . . 0.41 ' HG3' ' N ' ' B' ' 79' ' ' GLY . 3.5 tp10 -74.91 168.15 20.49 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 108.812 -0.81 . . . . 128.72 108.812 155.797 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 79' ' ' GLY . . . . . 0.41 ' N ' ' HG3' ' B' ' 78' ' ' GLU . . . -53.12 -17.36 5.28 Favored Glycine 0 N--CA 1.449 -0.488 0 N-CA-C 115.368 0.907 . . . . 129.13 115.368 179.19 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 80' ' ' GLN . . . . . 0.447 ' HG3' ' H ' ' B' ' 81' ' ' THR . 1.0 OUTLIER -122.35 175.67 6.29 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 118.119 0.959 . . . . 127.33 111.183 -169.314 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 81' ' ' THR . . . . . 0.447 ' H ' ' HG3' ' B' ' 80' ' ' GLN . 1.9 m -41.58 149.55 0.12 Allowed 'General case' 0 C--O 1.234 0.278 0 C-N-CA 129.285 3.034 . . . . 122.68 115.077 -176.273 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 82' ' ' VAL . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.277 0 CA-C-O 120.975 0.417 . . . . 119.32 110.515 165.48 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.433 0 CA-C-O 120.446 0.165 . . . . 115.14 111.291 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 87' ' ' TYR . . . . . 0.471 ' O ' ' N ' ' B' ' 89' ' ' LYS . 3.2 t80 -164.54 -145.3 0.08 Allowed 'General case' 0 C--O 1.239 0.506 0 N-CA-C 114.534 1.309 . . . . 117.17 114.534 175.935 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 88' ' ' HIS . . . . . 0.512 ' CD2' ' HD1' ' B' ' 91' ' ' TYR . 1.9 m170 -48.27 -11.05 0.03 OUTLIER 'General case' 0 C--O 1.235 0.309 0 C-N-CA 126.694 1.997 . . . . 118.09 114.313 -162.036 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 89' ' ' LYS . . . . . 0.471 ' N ' ' O ' ' B' ' 87' ' ' TYR . 1.2 ttpt -57.65 -11.78 2.38 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 119.453 -0.899 . . . . 119.78 112.072 175.642 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 90' ' ' VAL . . . . . 0.601 ' O ' HD12 ' B' ' 94' ' ' LEU . 66.3 t -72.31 -59.82 3.03 Favored 'Isoleucine or valine' 0 C--O 1.24 0.553 0 C-N-CA 119.904 -0.718 . . . . 117.06 109.764 163.18 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 91' ' ' TYR . . . . . 0.512 ' HD1' ' CD2' ' B' ' 88' ' ' HIS . 1.0 OUTLIER -35.77 -83.96 0.01 OUTLIER 'General case' 0 C--N 1.346 0.418 0 C-N-CA 125.323 1.449 . . . . 122.29 112.928 178.3 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -79.9 -5.9 56.42 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 119.141 -0.457 . . . . 120.3 111.245 -166.365 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' SER . . . . . . . . . . . . . 96.8 p -62.24 -33.46 74.63 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 118.542 -1.263 . . . . 116.93 111.219 168.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' LEU . . . . . 0.601 HD12 ' O ' ' B' ' 90' ' ' VAL . 2.0 mp -76.79 -25.5 53.4 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 114.018 1.118 . . . . 119.8 114.018 170.437 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 95' ' ' LYS . . . . . . . . . . . . . 11.1 tptt -60.82 -50.54 73.04 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 120.499 -0.48 . . . . 120.22 110.688 178.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 . . . . . 0 N--CA 1.464 0.242 0 CA-C-O 120.908 0.385 . . . . 119.55 111.037 177.515 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 103' ' ' VAL . . . . . 0.771 HG22 HG13 ' B' ' 139' ' ' VAL . 18.3 t . . . . . 0 C--O 1.237 0.436 0 N-CA-C 112.513 0.561 . . . . 103.03 112.513 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 104' ' ' THR . . . . . . . . . . . . . 1.3 t -160.83 154.36 22.08 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 123.373 0.669 . . . . 100.36 109.837 -176.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -97.15 135.32 39.27 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 124.421 1.088 . . . . 89.0 110.668 -175.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 16.5 t -123.31 115.36 21.55 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 108.383 -0.969 . . . . 85.07 108.383 178.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.7 155.41 37.74 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 122.132 0.968 . . . . 79.14 111.107 -174.579 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 5.1 ptpt -63.77 -31.06 72.11 Favored 'General case' 0 C--O 1.239 0.523 0 CA-C-N 115.059 -0.973 . . . . 80.02 111.991 171.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 109' ' ' GLU . . . . . . . . . . . . . 27.4 mp0 -75.01 -35.62 61.97 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.335 -0.546 . . . . 75.82 111.419 -177.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -67.15 -45.93 75.6 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 120.748 -0.381 . . . . 103.27 110.744 172.11 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 111' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -51.15 -40.9 59.61 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 120.593 -0.443 . . . . 76.55 110.97 178.021 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 112' ' ' TYR . . . . . 0.425 ' O ' HG23 ' B' ' 116' ' ' THR . 91.5 t80 -69.31 -39.94 77.94 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 120.742 -0.383 . . . . 69.76 111.828 -179.205 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 113' ' ' GLU . . . . . 0.543 ' HG3' ' N ' ' B' ' 114' ' ' LYS . 5.0 pt-20 -64.49 -39.01 93.0 Favored 'General case' 0 C--O 1.243 0.718 0 C-N-CA 119.074 -1.05 . . . . 88.72 111.123 175.393 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 114' ' ' LYS . . . . . 0.543 ' N ' ' HG3' ' B' ' 113' ' ' GLU . 6.7 mmtt -64.34 -37.14 86.46 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 109.87 -0.419 . . . . 76.82 109.87 179.271 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 59.8 tp -64.15 -47.48 79.72 Favored 'General case' 0 C--O 1.243 0.736 0 CA-C-O 120.85 0.357 . . . . 61.08 111.166 -179.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 116' ' ' THR . . . . . 0.425 HG23 ' O ' ' B' ' 112' ' ' TYR . 16.0 p -65.78 -33.06 74.98 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 118.753 -1.179 . . . . 65.25 111.192 177.098 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -62.76 -37.36 86.32 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 119.568 -0.853 . . . . 71.94 110.184 178.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 118' ' ' ILE . . . . . . . . . . . . . 77.1 mt -79.88 -43.77 22.82 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.223 0 C-N-CA 122.885 0.474 . . . . 59.22 111.306 -175.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 119' ' ' MET . . . . . . . . . . . . . 50.0 mmm -92.25 -10.76 37.36 Favored 'General case' 0 C--O 1.241 0.621 0 N-CA-C 114.019 1.118 . . . . 79.33 114.019 -172.522 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 105.8 -169.39 15.95 Favored Glycine 0 N--CA 1.443 -0.841 0 N-CA-C 110.35 -1.1 . . . . 71.62 110.35 -173.166 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 23.7 p-10 -51.98 175.36 0.02 OUTLIER 'General case' 0 C--O 1.236 0.391 0 N-CA-C 115.014 1.487 . . . . 84.52 115.014 -164.389 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 122' ' ' ASN . . . . . 0.449 ' HB3' ' OE2' ' B' ' 127' ' ' GLU . 0.9 OUTLIER -49.08 159.59 0.26 Allowed 'General case' 0 C--O 1.238 0.495 0 CA-C-N 115.334 -0.848 . . . . 93.47 112.913 -177.91 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 123' ' ' TRP . . . . . 0.536 ' CD1' ' N ' ' B' ' 123' ' ' TRP . 5.1 m0 -102.8 85.01 2.48 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 104.33 -2.47 . . . . 82.21 104.33 171.739 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 7.6 tttm -59.24 -27.04 65.4 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 114.892 -1.049 . . . . 91.98 112.339 -165.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 125' ' ' ILE . . . . . . . . . . . . . 1.5 mp -72.58 -13.8 16.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 112.752 0.649 . . . . 69.62 112.752 -174.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 126' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -108.69 -6.85 15.77 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 113.77 1.026 . . . . 80.78 113.77 -177.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 127' ' ' GLU . . . . . 0.449 ' OE2' ' HB3' ' B' ' 122' ' ' ASN . 7.5 mm-40 -62.92 -33.94 76.39 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 119.038 0.835 . . . . 84.34 112.037 -171.359 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . -77.96 5.2 54.87 Favored Glycine 0 N--CA 1.443 -0.864 0 N-CA-C 117.851 1.9 . . . . 86.75 117.851 -179.16 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -130.84 173.51 10.89 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 124.989 1.052 . . . . 87.01 110.527 -176.592 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.97 157.3 25.36 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 114.796 1.406 . . . . 81.63 114.796 -176.564 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 131' ' ' ASN . . . . . . . . . . . . . 42.8 t-20 -73.29 118.35 67.97 Favored Pre-proline 0 C--O 1.243 0.732 0 CA-C-N 115.037 -0.983 . . . . 81.77 109.868 178.843 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 132' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -82.23 -9.18 11.66 Favored 'Trans proline' 0 CA--C 1.51 -0.678 0 N-CA-C 114.069 0.757 . . . . 76.95 114.069 -176.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 10.0 mt -78.35 173.06 12.72 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 119.504 -0.878 . . . . 74.73 109.472 179.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 134' ' ' TYR . . . . . . . . . . . . . 42.8 m-85 -114.41 135.99 53.49 Favored 'General case' 0 C--O 1.239 0.523 0 CA-C-N 115.674 -0.693 . . . . 76.95 109.789 -173.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -55.49 146.17 20.88 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.163 -1.051 . . . . 83.75 108.163 163.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 136' ' ' ALA . . . . . . . . . . . . . . . -148.01 171.65 15.48 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 119.502 -0.879 . . . . 83.0 109.125 -176.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 137' ' ' TYR . . . . . 0.486 ' OH ' ' OD1' ' B' ' 70' ' ' ASP . 50.0 m-85 -125.14 120.02 30.19 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 106.932 -1.507 . . . . 106.05 106.932 170.971 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 138' ' ' ILE . . . . . . . . . . . . . 6.1 mm -83.15 131.92 32.61 Favored 'Isoleucine or valine' 0 C--O 1.239 0.516 0 N-CA-C 107.869 -1.16 . . . . 99.22 107.869 172.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 139' ' ' VAL . . . . . 0.771 HG13 HG22 ' B' ' 103' ' ' VAL . 32.6 t . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.42 -0.355 . . . . 99.0 110.367 -170.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.361 0 CA-C-O 119.814 -0.136 . . . . 126.59 111.214 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 144' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -55.4 -49.72 15.25 Favored 'Trans proline' 0 N--CA 1.481 0.779 0 N-CA-C 115.109 1.157 . . . . 121.75 115.109 -170.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 145' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -73.82 -17.08 61.12 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 118.916 0.78 . . . . 124.0 111.716 -178.008 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 146' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -94.73 66.38 3.15 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 122.363 1.077 . . . . 123.35 109.072 179.613 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 147' ' ' VAL . . . . . 0.627 HG23 ' H ' ' B' ' 148' ' ' LYS . 3.9 m -127.47 -67.88 0.69 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.447 0 CA-C-N 115.279 -0.873 . . . . 118.99 111.523 -176.992 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 148' ' ' LYS . . . . . 0.627 ' H ' HG23 ' B' ' 147' ' ' VAL . 5.3 mmtt -45.01 -27.57 0.57 Allowed 'General case' 0 C--O 1.234 0.252 0 C-N-CA 124.765 1.226 . . . . 118.92 111.338 -177.267 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 48.9 p -64.78 -65.01 0.73 Allowed 'General case' 0 C--O 1.239 0.533 0 CA-C-N 116.07 -0.514 . . . . 120.02 111.671 -175.825 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 150' ' ' ILE . . . . . 0.65 HD12 ' HB3' ' B' ' 153' ' ' ASP . 10.9 tp -71.31 -19.82 20.99 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.129 0 O-C-N 121.93 -0.481 . . . . 115.3 110.757 -174.964 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 151' ' ' ALA . . . . . . . . . . . . . . . -58.3 -58.88 6.55 Favored 'General case' 0 C--O 1.238 0.459 0 O-C-N 121.545 -0.722 . . . . 108.2 110.107 170.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 152' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -50.08 -47.57 53.57 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.046 0.45 . . . . 113.46 110.563 169.686 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 153' ' ' ASP . . . . . 0.65 ' HB3' HD12 ' B' ' 150' ' ' ILE . 1.3 t0 -57.32 -39.72 76.42 Favored 'General case' 0 C--N 1.327 -0.402 0 O-C-N 121.789 -0.569 . . . . 110.07 112.298 179.902 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -71.85 -27.65 63.03 Favored 'General case' 0 C--O 1.24 0.569 0 C-N-CA 120.409 -0.516 . . . . 104.95 111.771 -171.648 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 155' ' ' LYS . . . . . . . . . . . . . 4.6 ttpt -71.88 -14.84 62.06 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 119.738 -0.785 . . . . 107.91 111.544 177.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 156' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.83 -44.54 89.5 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 120.598 0.237 . . . . 107.08 111.314 179.772 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 157' ' ' ILE . . . . . 0.493 ' H ' HD12 ' B' ' 157' ' ' ILE . 5.0 mp -56.92 138.41 17.72 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 CA-C-O 121.279 0.561 . . . . 99.21 110.856 -167.99 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 158' ' ' GLU . . . . . 0.423 ' O ' HG22 ' B' ' 157' ' ' ILE . 26.2 pt-20 -64.59 148.22 51.28 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 121.464 0.649 . . . . 112.43 109.842 173.266 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 159' ' ' GLY . . . . . 0.471 ' O ' ' HB2' ' B' ' 65' ' ' ARG . . . 88.38 -30.97 5.0 Favored Glycine 0 CA--C 1.528 0.899 0 N-CA-C 116.744 1.458 . . . . 99.85 116.744 -177.06 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 57.1 t -66.57 136.86 25.95 Favored 'Isoleucine or valine' 0 C--O 1.24 0.584 0 CA-C-N 117.866 0.833 . . . . 94.27 110.119 -177.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 2.8 t -85.83 -60.68 1.95 Allowed 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.179 -0.464 . . . . 87.08 110.946 177.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 73.7 mm-40 -146.47 166.63 25.86 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.328 0.585 . . . . 79.62 109.686 -179.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 163' ' ' VAL . . . . . . . . . . . . . 4.3 m -138.08 151.57 25.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 N-CA-C 109.163 -0.68 . . . . 88.71 109.163 172.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -133.75 138.01 45.52 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.122 -0.49 . . . . 87.7 110.457 -177.328 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 165' ' ' ASP . . . . . . . . . . . . . 1.9 p30 . . . . . 0 C--O 1.237 0.398 0 CA-C-O 121.645 0.736 . . . . 96.17 112.51 -177.63 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' UMQ . . . . . 0.443 H4'1 ' H21' ' A' ' 201' ' ' UMQ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 202' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 201' ' ' TRS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . 0.643 ' O ' ' N ' ' A' ' 121' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 306' ' ' HOH . . . . . 0.525 ' O ' ' HG2' ' A' ' 124' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 15.1 mt . . . . . 0 N--CA 1.465 0.303 0 CA-C-O 120.606 0.241 . . . . 90.2 111.262 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -101.91 144.1 30.97 Favored 'General case' 0 C--O 1.239 0.508 0 C-N-CA 122.886 0.474 . . . . 95.76 111.666 -166.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 1.7 t -99.23 145.31 27.39 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.596 0.712 . . . . 97.8 110.701 175.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 5.3 p-10 -139.9 101.16 4.11 Favored 'General case' 0 N--CA 1.468 0.458 0 N-CA-C 108.728 -0.841 . . . . 100.86 108.728 -168.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ILE . . . . . 0.549 HD11 ' HB2' ' A' ' 59' ' ' ARG . 1.6 pt -142.96 147.27 20.8 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 CA-C-O 121.756 0.788 . . . . 86.94 110.09 -178.296 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -70.62 144.05 51.27 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.094 -0.957 . . . . 97.0 111.136 -176.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -58.65 -42.63 88.84 Favored 'General case' 0 C--O 1.241 0.639 0 CA-C-N 115.644 -0.707 . . . . 87.25 111.665 -177.24 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 42.8 p-10 -65.61 -0.74 2.2 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 113.393 0.886 . . . . 75.24 113.393 -175.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.413 HG22 ' HB3' ' A' ' 141' ' ' ALA . 1.3 p -127.41 11.56 3.4 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 CA-C-N 119.056 0.844 . . . . 68.46 111.338 -176.485 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ARG . . . . . 0.549 ' HB2' HD11 ' A' ' 54' ' ' ILE . 1.5 ptt85 -107.86 140.5 40.87 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 121.035 -1.041 . . . . 81.98 112.242 -173.232 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 44.1 t -128.08 127.81 68.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 N-CA-C 106.828 -1.545 . . . . 54.96 106.828 175.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.41 HG23 ' NH1' ' A' ' 59' ' ' ARG . 9.4 t -100.82 126.8 54.44 Favored 'Isoleucine or valine' 0 C--O 1.241 0.607 0 N-CA-C 109.338 -0.615 . . . . 52.16 109.338 175.787 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 95.9 t -114.52 109.67 29.3 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 107.515 -1.291 . . . . 51.92 107.515 -178.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 93.0 m-85 -88.56 130.1 35.33 Favored 'General case' 0 C--O 1.231 0.1 0 C-N-CA 122.517 0.327 . . . . 55.31 110.328 -176.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 63.9 mt -91.27 134.09 30.91 Favored 'Isoleucine or valine' 0 C--O 1.24 0.569 0 N-CA-C 109.748 -0.464 . . . . 50.65 109.748 -171.962 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 59.9 mtp85 -48.99 135.79 15.3 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-O 121.151 0.5 . . . . 93.92 110.325 173.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' LYS . . . . . . . . . . . . . 11.4 mmtt -60.49 -22.74 63.86 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 113.21 0.819 . . . . 64.5 113.21 -177.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 46.7 p30 -96.7 10.89 37.36 Favored 'General case' 0 C--O 1.236 0.374 0 CA-C-N 119.04 0.836 . . . . 76.05 112.969 -179.111 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 41.4 t -114.05 127.87 71.26 Favored 'Isoleucine or valine' 0 C--O 1.234 0.285 0 N-CA-C 108.028 -1.101 . . . . 62.06 108.028 -179.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -108.15 65.27 0.63 Allowed 'General case' 0 C--N 1.326 -0.436 0 N-CA-C 109.485 -0.561 . . . . 83.95 109.485 -178.325 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -60.74 -28.44 68.69 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 112.72 0.637 . . . . 56.77 112.72 -171.483 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 58.2 t30 -99.85 4.79 45.35 Favored 'General case' 0 C--N 1.329 -0.309 0 N-CA-C 113.33 0.863 . . . . 55.45 113.33 -174.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 60.3 m -99.19 122.15 41.99 Favored 'General case' 0 C--O 1.24 0.603 0 N-CA-C 108.946 -0.761 . . . . 59.36 108.946 -179.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -75.99 -27.88 57.6 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 120.218 -0.593 . . . . 67.99 111.803 177.121 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.1 p -124.84 148.02 48.45 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-O 121.537 0.684 . . . . 60.86 111.435 177.28 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.409 HG23 ' HB2' ' A' ' 84' ' ' ASN . 38.6 pt -139.97 168.03 18.21 Favored 'Isoleucine or valine' 0 C--O 1.235 0.294 0 N-CA-C 108.527 -0.916 . . . . 60.33 108.527 176.438 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -97.1 121.85 39.44 Favored 'General case' 0 N--CA 1.448 -0.536 0 CA-C-N 115.71 -0.677 . . . . 56.31 109.411 -179.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 27.4 mmtt -130.33 124.06 31.42 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 109.753 -0.462 . . . . 78.94 109.753 174.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 67.5 mm-40 55.31 29.39 12.87 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 123.47 0.708 . . . . 71.9 112.118 179.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 90.15 -0.74 79.06 Favored Glycine 0 N--CA 1.446 -0.678 0 CA-C-O 119.025 -0.875 . . . . 51.72 114.962 175.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' GLN . . . . . . . . . . . . . 30.9 mm-40 -111.73 158.37 19.41 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 118.593 1.196 . . . . 66.77 110.745 174.33 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' THR . . . . . . . . . . . . . 89.2 m -87.27 110.23 20.06 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 107.527 -1.286 . . . . 64.56 107.527 171.827 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 7.2 m -118.68 158.95 19.52 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.385 0 N-CA-C 108.189 -1.041 . . . . 59.97 108.189 179.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 12.0 p -68.33 146.59 53.13 Favored 'General case' 0 C--O 1.234 0.279 0 C-N-CA 118.571 -1.252 . . . . 70.58 108.891 176.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ASN . . . . . 0.409 ' HB2' HG23 ' A' ' 75' ' ' ILE . 22.4 t30 -88.35 112.64 23.1 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 108.745 -0.835 . . . . 66.42 108.745 -178.728 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 79.5 m-20 -72.09 -21.62 61.47 Favored 'General case' 0 CA--C 1.516 -0.339 0 CA-C-N 116.269 -0.423 . . . . 80.17 112.133 -173.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -95.16 15.29 19.51 Favored 'General case' 0 N--CA 1.453 -0.322 0 N-CA-C 113.037 0.754 . . . . 73.11 113.037 175.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -58.24 131.78 51.62 Favored 'General case' 0 C--N 1.33 -0.274 0 C-N-CA 120.367 -0.533 . . . . 62.52 110.446 178.044 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 56.95 32.47 21.63 Favored 'General case' 0 N--CA 1.474 0.728 0 N-CA-C 112.591 0.589 . . . . 58.41 112.591 177.052 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 1.6 tptm -73.33 -41.67 63.22 Favored 'General case' 0 C--N 1.328 -0.348 0 C-N-CA 118.526 -1.27 . . . . 78.62 110.43 174.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' VAL . . . . . . . . . . . . . 97.4 t -70.35 -46.83 69.58 Favored 'Isoleucine or valine' 0 C--O 1.234 0.276 0 N-CA-C 109.736 -0.468 . . . . 57.06 109.736 176.503 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' TYR . . . . . . . . . . . . . 86.7 t80 -49.87 -49.9 47.73 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 120.932 -0.307 . . . . 56.54 110.849 176.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 86.1 m-20 -67.34 -40.84 85.9 Favored 'General case' 0 N--CA 1.465 0.281 0 N-CA-C 112.02 0.378 . . . . 57.17 112.02 -173.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' SER . . . . . . . . . . . . . 49.6 m -61.29 -32.56 72.4 Favored 'General case' 0 C--O 1.239 0.533 0 C-N-CA 119.307 -0.957 . . . . 59.73 112.1 174.245 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' LEU . . . . . . . . . . . . . 87.0 mt -78.07 -48.63 15.63 Favored 'General case' 0 C--O 1.233 0.226 0 C-N-CA 119.354 -0.938 . . . . 55.94 110.782 -179.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 9.8 tptm -58.43 -31.97 68.24 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 112.324 0.491 . . . . 62.54 112.324 178.036 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 9.7 m-20 -84.42 0.22 50.32 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 113.864 1.061 . . . . 87.52 113.864 -176.543 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' MET . . . . . 0.622 ' HE1' ' HA ' ' A' ' 150' ' ' ILE . 71.5 mtp -72.29 130.98 42.07 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 119.395 0.998 . . . . 66.8 109.433 168.925 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 91.5 p -57.82 -33.47 68.65 Favored 'General case' 0 N--CA 1.468 0.436 0 N-CA-C 112.182 0.438 . . . . 70.89 112.182 178.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' THR . . . . . . . . . . . . . 16.9 p -79.51 -1.04 35.78 Favored 'General case' 0 C--N 1.328 -0.362 0 N-CA-C 114.036 1.125 . . . . 66.05 114.036 -175.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' VAL . . . . . . . . . . . . . 24.5 t -99.86 136.15 32.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.35 0 CA-C-N 119.179 0.9 . . . . 59.74 109.798 -173.606 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 10.0 ttmm -93.57 -51.82 4.77 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 120.398 -0.521 . . . . 85.77 112.302 179.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 75.7 p -147.43 160.98 41.96 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-O 121.58 0.705 . . . . 58.55 109.356 177.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' VAL . . . . . . . . . . . . . 48.5 t -138.63 109.79 5.25 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.208 0 N-CA-C 106.991 -1.485 . . . . 52.22 106.991 -176.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' THR . . . . . . . . . . . . . 9.8 m -115.78 126.25 53.79 Favored 'General case' 0 C--O 1.242 0.671 0 CA-C-O 120.968 0.413 . . . . 50.6 111.118 -173.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' PHE . . . . . . . . . . . . . 71.5 t80 -70.55 131.66 44.32 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 116.17 -0.468 . . . . 52.19 111.089 178.095 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' SER . . . . . . . . . . . . . 29.8 t -122.37 112.58 18.27 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 109.315 -0.624 . . . . 52.07 109.315 172.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 60.4 p -80.33 156.43 26.76 Favored 'General case' 0 C--O 1.243 0.738 0 CA-C-O 122.279 1.037 . . . . 56.28 111.285 -175.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 18.7 pttm -64.06 -32.09 73.51 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-N 114.691 -1.141 . . . . 67.08 111.228 176.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 43.6 mp0 -59.06 -47.57 84.74 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 120.246 -0.582 . . . . 61.37 111.648 174.499 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -74.22 -29.21 61.61 Favored 'General case' 0 N--CA 1.465 0.289 0 C-N-CA 118.436 -1.305 . . . . 71.4 111.089 -177.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' GLN . . . . . . . . . . . . . 65.6 mt-30 -64.18 -42.67 96.58 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 120.714 -0.394 . . . . 58.37 111.548 174.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' TYR . . . . . . . . . . . . . 31.7 t80 -58.95 -50.32 74.51 Favored 'General case' 0 C--O 1.24 0.597 0 C-N-CA 119.694 -0.802 . . . . 63.74 110.961 175.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -53.45 -45.31 69.45 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 120.986 0.422 . . . . 98.69 110.692 179.007 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 10.3 tptm -64.27 -34.58 78.44 Favored 'General case' 0 C--O 1.235 0.323 0 C-N-CA 119.243 -0.983 . . . . 80.16 110.842 178.308 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 44.2 tp -64.56 -40.42 95.53 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 119.927 -0.709 . . . . 59.27 111.517 -179.086 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' THR . . . . . . . . . . . . . 27.4 p -72.27 -33.22 67.29 Favored 'General case' 0 C--O 1.235 0.311 0 C-N-CA 119.994 -0.682 . . . . 68.14 111.025 178.801 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 2.3 tt0 -65.11 -24.47 67.44 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 120.763 -0.375 . . . . 84.07 111.79 174.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' ILE . . . . . . . . . . . . . 79.5 mt -91.43 -42.93 14.0 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.237 0 C-N-CA 120.06 -0.656 . . . . 69.53 111.556 179.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' MET . . . . . . . . . . . . . 14.6 mmt -94.23 -10.62 32.4 Favored 'General case' 0 C--N 1.324 -0.543 0 C-N-CA 124.377 1.071 . . . . 68.57 112.677 -173.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 84.13 146.38 7.4 Favored Glycine 0 N--CA 1.441 -0.977 0 C-N-CA 119.655 -1.26 . . . . 76.31 114.593 -172.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' ASP . . . . . 0.643 ' N ' ' O ' ' A' ' 301' ' ' HOH . 1.3 t0 49.17 163.17 0.0 OUTLIER 'General case' 0 C--O 1.236 0.352 0 C-N-CA 128.637 2.775 . . . . 86.98 114.78 171.797 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 35.3 m-80 -71.81 146.52 47.97 Favored 'General case' 0 N--CA 1.445 -0.694 0 CA-C-N 115.417 -0.811 . . . . 89.51 109.724 171.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' TRP . . . . . 0.403 ' CD1' ' N ' ' A' ' 123' ' ' TRP . 8.6 m0 -81.3 82.38 7.18 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 106.419 -1.697 . . . . 69.62 106.419 170.364 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' LYS . . . . . 0.525 ' HG2' ' O ' ' A' ' 306' ' ' HOH . 12.7 mmtt -50.71 -44.28 58.1 Favored 'General case' 0 CA--C 1.514 -0.438 0 CA-C-N 114.758 -1.11 . . . . 89.44 112.261 -165.855 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 1.3 pt -71.43 -17.97 19.95 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.274 0 C-N-CA 118.739 -1.184 . . . . 71.81 111.78 -168.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -87.15 -12.65 46.34 Favored 'General case' 0 C--N 1.324 -0.539 0 N-CA-C 113.246 0.832 . . . . 69.62 113.246 175.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' GLU . . . . . . . . . . . . . 7.1 mt-10 -76.93 145.19 38.34 Favored 'General case' 0 C--N 1.322 -0.596 0 C-N-CA 117.771 -1.572 . . . . 96.72 110.547 -167.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' GLY . . . . . . . . . . . . . . . 86.79 -19.5 29.05 Favored Glycine 0 N--CA 1.445 -0.732 0 CA-C-N 115.206 -0.906 . . . . 64.55 114.529 -167.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' ASP . . . . . . . . . . . . . 51.9 m-20 -93.34 170.11 9.86 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 118.447 1.123 . . . . 74.07 109.951 178.661 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -67.49 142.08 56.71 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.47 -0.786 . . . . 56.08 110.308 -175.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 45.4 t-20 -74.42 115.98 48.59 Favored Pre-proline 0 C--N 1.328 -0.356 0 N-CA-C 109.248 -0.649 . . . . 58.78 109.248 -178.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' PRO . . . . . . . . . . . . . 66.5 Cg_endo -84.56 -7.66 9.65 Favored 'Trans proline' 0 C--O 1.239 0.555 0 N-CA-C 114.25 0.827 . . . . 54.58 114.25 -178.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 49.4 mt -63.9 168.91 4.63 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 118.536 -1.266 . . . . 54.24 114.207 173.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 45.4 m-85 -109.32 145.69 35.58 Favored 'General case' 0 C--O 1.178 -2.692 0 C-N-CA 116.279 -2.169 . . . . 52.0 111.697 -178.043 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' ASP . . . . . . . . . . . . . 84.6 m-20 -65.28 145.25 56.46 Favored 'General case' 0 C--N 1.313 -1.0 0 N-CA-C 105.825 -1.917 . . . . 52.28 105.825 166.499 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' ALA . . . . . . . . . . . . . . . -146.63 164.84 31.36 Favored 'General case' 0 CA--C 1.515 -0.386 0 C-N-CA 118.997 -1.081 . . . . 48.76 110.494 -178.178 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' TYR . . . . . . . . . . . . . 60.6 m-85 -110.47 125.75 53.62 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 114.811 -1.086 . . . . 49.3 108.513 164.264 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' ILE . . . . . . . . . . . . . 7.5 mm -86.69 112.12 22.48 Favored 'Isoleucine or valine' 0 C--O 1.233 0.221 0 N-CA-C 105.344 -2.095 . . . . 50.77 105.344 171.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' VAL . . . . . . . . . . . . . 60.8 t -99.7 133.84 41.15 Favored 'Isoleucine or valine' 0 C--O 1.242 0.664 0 N-CA-C 109.288 -0.634 . . . . 53.33 109.288 -176.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -105.82 113.7 27.42 Favored 'General case' 0 C--O 1.239 0.525 0 N-CA-C 107.992 -1.114 . . . . 79.12 107.992 175.657 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' ALA . . . . . 0.413 ' HB3' HG22 ' A' ' 58' ' ' VAL . . . -70.43 153.36 43.05 Favored 'General case' 0 CA--C 1.534 0.34 0 CA-C-N 115.768 -0.651 . . . . 60.21 110.741 174.931 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -63.74 -32.26 73.7 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 119.433 -0.907 . . . . 66.67 112.031 174.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -155.62 155.18 29.32 Favored Pre-proline 0 C--N 1.327 -0.403 0 N-CA-C 108.142 -1.058 . . . . 63.24 108.142 -174.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_exo -58.74 -29.84 90.8 Favored 'Trans proline' 0 C--O 1.237 0.457 0 N-CA-C 114.714 1.005 . . . . 65.42 114.714 -178.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' ASN . . . . . . . . . . . . . 94.7 m-20 -74.37 -10.84 59.97 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-N 119.597 1.09 . . . . 67.93 113.451 -178.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 -85.49 -14.25 46.58 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 123.461 0.705 . . . . 68.62 112.742 177.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 17.9 t -59.01 -50.02 81.2 Favored 'Isoleucine or valine' 0 C--O 1.24 0.597 0 CA-C-O 121.037 0.446 . . . . 67.0 111.184 -170.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' LYS . . . . . . . . . . . . . 13.5 pttm -59.91 -39.66 86.17 Favored 'General case' 0 C--O 1.24 0.601 0 O-C-N 121.652 -0.655 . . . . 81.33 111.05 -175.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' THR . . . . . . . . . . . . . 5.5 m -69.18 -39.69 78.56 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 120.667 -0.413 . . . . 77.68 111.436 179.314 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' ILE . . . . . 0.622 ' HA ' ' HE1' ' A' ' 97' ' ' MET . 95.3 mt -63.38 -41.02 91.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.247 0 C-N-CA 120.409 -0.516 . . . . 60.95 110.521 179.58 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' ALA . . . . . . . . . . . . . . . -61.05 -56.08 25.22 Favored 'General case' 0 C--O 1.237 0.398 0 O-C-N 121.945 -0.472 . . . . 63.43 110.929 -178.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 79.4 mt-10 -54.85 -45.55 74.56 Favored 'General case' 0 CA--C 1.515 -0.385 0 CA-C-O 120.813 0.34 . . . . 85.01 111.254 179.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' ASP . . . . . . . . . . . . . 28.7 m-20 -64.47 -38.03 89.58 Favored 'General case' 0 C--O 1.24 0.571 0 C-N-CA 119.75 -0.78 . . . . 70.2 110.628 -179.772 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' ALA . . . . . . . . . . . . . . . -67.41 -32.19 72.92 Favored 'General case' 0 N--CA 1.454 -0.262 0 C-N-CA 119.702 -0.799 . . . . 57.45 111.809 -179.679 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' LYS . . . . . 0.444 ' HE3' HG22 ' A' ' 163' ' ' VAL . 30.8 mttt -61.44 -31.49 71.44 Favored 'General case' 0 C--N 1.345 0.392 0 CA-C-N 118.388 0.54 . . . . 78.2 111.441 -177.787 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' LYS . . . . . . . . . . . . . 94.0 mttt -78.43 -12.5 60.01 Favored 'General case' 0 C--O 1.237 0.404 0 N-CA-C 113.548 0.944 . . . . 71.45 113.548 -176.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' ILE . . . . . . . . . . . . . 46.3 mt -70.17 133.38 31.95 Favored 'Isoleucine or valine' 0 C--O 1.241 0.615 0 C-N-CA 119.81 -0.756 . . . . 60.1 109.677 -175.809 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -66.87 124.34 22.68 Favored 'General case' 0 C--O 1.242 0.71 0 CA-C-O 121.184 0.516 . . . . 87.11 109.779 176.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' GLY . . . . . . . . . . . . . . . 109.41 -13.24 33.29 Favored Glycine 0 N--CA 1.445 -0.765 0 CA-C-O 118.856 -0.969 . . . . 55.95 113.282 -176.01 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 48.8 t -87.9 126.88 41.38 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 N-CA-C 108.063 -1.088 . . . . 53.06 108.063 179.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' SER . . . . . . . . . . . . . 12.5 t -86.65 -50.05 7.07 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 119.904 -0.718 . . . . 58.08 111.593 178.003 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' GLU . . . . . . . . . . . . . 54.2 mm-40 -151.11 162.47 40.8 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-O 121.489 0.661 . . . . 76.05 109.351 178.191 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' VAL . . . . . 0.444 HG22 ' HE3' ' A' ' 155' ' ' LYS . 2.5 m -134.3 146.08 31.82 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 108.627 -0.879 . . . . 65.63 108.627 171.167 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' GLN . . . . . . . . . . . . . 41.6 tt0 -117.79 120.97 39.56 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 107.6 -1.259 . . . . 77.49 107.6 173.172 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 21.9 p30 . . . . . 0 C--O 1.222 -0.384 0 N-CA-C 109.645 -0.502 . . . . 83.68 109.645 178.302 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' ILE . . . . . . . . . . . . . 7.9 mt . . . . . 0 CA--C 1.545 0.77 0 N-CA-C 110.03 -0.359 . . . . 113.23 110.03 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' GLU . . . . . . . . . . . . . 6.1 tp10 69.83 120.07 0.03 OUTLIER 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.862 1.265 . . . . 121.28 112.964 176.378 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' ASN . . . . . 0.442 ' HA ' ' HG2' ' B' ' 59' ' ' ARG . 0.9 OUTLIER -58.81 -36.87 75.18 Favored 'General case' 0 C--O 1.238 0.448 0 CA-C-N 116.107 -0.497 . . . . 113.04 111.678 -179.138 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' ASN . . . . . . . . . . . . . 84.6 m-20 -59.15 -36.7 75.72 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 112.088 0.403 . . . . 120.2 112.088 -168.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 3.4 m -114.18 13.95 8.17 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.358 0 O-C-N 122.039 -0.413 . . . . 115.76 111.646 -169.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' ARG . . . . . 0.442 ' HG2' ' HA ' ' B' ' 56' ' ' ASN . 0.2 OUTLIER -111.88 139.74 47.12 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-O 121.349 0.595 . . . . 109.69 111.564 -170.218 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' VAL . . . . . . . . . . . . . 20.0 t -132.29 135.2 58.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.342 0 N-CA-C 107.472 -1.307 . . . . 96.98 107.472 172.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' VAL . . . . . . . . . . . . . 19.5 t -108.1 138.57 34.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 N-CA-C 108.245 -1.02 . . . . 90.83 108.245 178.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' VAL . . . . . . . . . . . . . 93.5 t -133.58 105.06 7.03 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 N-CA-C 106.139 -1.8 . . . . 88.2 106.139 -173.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -90.84 138.46 31.57 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.173 -0.677 . . . . 84.49 109.173 -179.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.428 HD12 ' O ' ' B' ' 65' ' ' ARG . 1.5 pp -106.96 149.06 10.73 Favored 'Isoleucine or valine' 0 C--O 1.241 0.654 0 N-CA-C 108.553 -0.906 . . . . 87.81 108.553 -172.989 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' ARG . . . . . 0.471 ' HB2' ' O ' ' B' ' 159' ' ' GLY . 0.6 OUTLIER -61.93 148.43 43.68 Favored 'General case' 0 C--O 1.233 0.233 0 CA-C-N 115.74 -0.664 . . . . 92.71 110.661 -169.431 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.02 -32.71 69.97 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.124 -0.944 . . . . 97.41 111.584 -175.095 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' ASP . . . . . . . . . . . . . 44.1 p-10 -90.73 21.74 3.91 Favored 'General case' 0 C--O 1.234 0.277 0 C-N-CA 124.138 0.975 . . . . 99.28 112.779 -174.718 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 16.3 t -129.73 138.95 52.87 Favored 'Isoleucine or valine' 0 C--O 1.236 0.359 0 N-CA-C 108.456 -0.942 . . . . 99.21 108.456 -177.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' GLU . . . . . 0.536 ' OE1' ' HB2' ' B' ' 72' ' ' SER . 3.0 mm-40 -124.5 70.23 1.11 Allowed 'General case' 0 N--CA 1.464 0.253 0 N-CA-C 109.029 -0.73 . . . . 113.36 109.029 -173.549 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' ASP . . . . . 0.583 ' OD2' ' HB ' ' B' ' 90' ' ' VAL . 11.5 t70 -70.51 -4.76 24.48 Favored 'General case' 0 C--N 1.324 -0.509 0 C-N-CA 118.146 -1.422 . . . . 120.98 113.676 -173.636 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' ASN . . . . . 0.471 ' O ' ' ND2' ' B' ' 71' ' ' ASN . 0.2 OUTLIER -131.25 -0.93 4.04 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 116.175 1.917 . . . . 108.67 116.175 -178.356 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' SER . . . . . 0.536 ' HB2' ' OE1' ' B' ' 69' ' ' GLU . 4.7 m -101.46 106.03 17.1 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 120.044 1.293 . . . . 112.11 107.676 170.569 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' GLN . . . . . . . . . . . . . 4.1 mm-40 -54.42 -56.53 17.71 Favored 'General case' 0 C--O 1.236 0.357 0 CA-C-O 121.429 0.633 . . . . 118.35 110.775 -176.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 1.1 t -65.31 127.59 32.38 Favored 'General case' 0 C--N 1.328 -0.345 0 N-CA-C 109.651 -0.5 . . . . 119.93 109.651 171.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' ILE . . . . . . . . . . . . . 4.2 mt -122.51 124.28 70.41 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 N-CA-C 106.179 -1.785 . . . . 121.63 106.179 173.221 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' GLU . . . . . 0.447 ' O ' ' HG3' ' B' ' 76' ' ' GLU . 2.0 pt-20 -109.58 95.84 5.88 Favored 'General case' 0 C--N 1.328 -0.331 0 N-CA-C 108.622 -0.881 . . . . 129.55 108.622 178.659 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' LYS . . . . . . . . . . . . . 14.6 mmtt -88.45 -51.36 5.76 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 123.857 0.863 . . . . 129.22 109.994 163.169 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' GLU . . . . . 0.41 ' HG3' ' N ' ' B' ' 79' ' ' GLY . 3.5 tp10 -74.91 168.15 20.49 Favored 'General case' 0 N--CA 1.451 -0.411 0 N-CA-C 108.812 -0.81 . . . . 128.72 108.812 155.797 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' GLY . . . . . 0.41 ' N ' ' HG3' ' B' ' 78' ' ' GLU . . . -53.12 -17.36 5.28 Favored Glycine 0 N--CA 1.449 -0.488 0 N-CA-C 115.368 0.907 . . . . 129.13 115.368 179.19 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' GLN . . . . . 0.447 ' HG3' ' H ' ' B' ' 81' ' ' THR . 1.0 OUTLIER -122.35 175.67 6.29 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 118.119 0.959 . . . . 127.33 111.183 -169.314 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' THR . . . . . 0.447 ' H ' ' HG3' ' B' ' 80' ' ' GLN . 1.9 m -41.58 149.55 0.12 Allowed 'General case' 0 C--O 1.234 0.278 0 C-N-CA 129.285 3.034 . . . . 122.68 115.077 -176.273 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' VAL . . . . . . . . . . . . . . . . . . . . 0 C--O 1.234 0.277 0 CA-C-O 120.975 0.417 . . . . 119.32 110.515 165.48 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' ASP . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.433 0 CA-C-O 120.446 0.165 . . . . 115.14 111.291 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' TYR . . . . . 0.471 ' O ' ' N ' ' B' ' 89' ' ' LYS . 3.2 t80 -164.54 -145.3 0.08 Allowed 'General case' 0 C--O 1.239 0.506 0 N-CA-C 114.534 1.309 . . . . 117.17 114.534 175.935 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' HIS . . . . . 0.512 ' CD2' ' HD1' ' B' ' 91' ' ' TYR . 1.9 m170 -48.27 -11.05 0.03 OUTLIER 'General case' 0 C--O 1.235 0.309 0 C-N-CA 126.694 1.997 . . . . 118.09 114.313 -162.036 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' LYS . . . . . 0.471 ' N ' ' O ' ' B' ' 87' ' ' TYR . 1.2 ttpt -57.65 -11.78 2.38 Favored 'General case' 0 C--O 1.234 0.246 0 C-N-CA 119.453 -0.899 . . . . 119.78 112.072 175.642 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' VAL . . . . . 0.601 ' O ' HD12 ' B' ' 94' ' ' LEU . 66.3 t -72.31 -59.82 3.03 Favored 'Isoleucine or valine' 0 C--O 1.24 0.553 0 C-N-CA 119.904 -0.718 . . . . 117.06 109.764 163.18 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' TYR . . . . . 0.512 ' HD1' ' CD2' ' B' ' 88' ' ' HIS . 1.0 OUTLIER -35.77 -83.96 0.01 OUTLIER 'General case' 0 C--N 1.346 0.418 0 C-N-CA 125.323 1.449 . . . . 122.29 112.928 178.3 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -79.9 -5.9 56.42 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 119.141 -0.457 . . . . 120.3 111.245 -166.365 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' SER . . . . . . . . . . . . . 96.8 p -62.24 -33.46 74.63 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 118.542 -1.263 . . . . 116.93 111.219 168.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' LEU . . . . . 0.601 HD12 ' O ' ' B' ' 90' ' ' VAL . 2.0 mp -76.79 -25.5 53.4 Favored 'General case' 0 C--O 1.233 0.187 0 N-CA-C 114.018 1.118 . . . . 119.8 114.018 170.437 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' LYS . . . . . . . . . . . . . 11.1 tptt -60.82 -50.54 73.04 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 120.499 -0.48 . . . . 120.22 110.688 178.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 . . . . . 0 N--CA 1.464 0.242 0 CA-C-O 120.908 0.385 . . . . 119.55 111.037 177.515 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' VAL . . . . . 0.771 HG22 HG13 ' B' ' 139' ' ' VAL . 18.3 t . . . . . 0 C--O 1.237 0.436 0 N-CA-C 112.513 0.561 . . . . 103.03 112.513 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' THR . . . . . . . . . . . . . 1.3 t -160.83 154.36 22.08 Favored 'General case' 0 C--O 1.233 0.233 0 C-N-CA 123.373 0.669 . . . . 100.36 109.837 -176.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' PHE . . . . . . . . . . . . . 81.0 t80 -97.15 135.32 39.27 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 124.421 1.088 . . . . 89.0 110.668 -175.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' SER . . . . . . . . . . . . . 16.5 t -123.31 115.36 21.55 Favored 'General case' 0 N--CA 1.466 0.353 0 N-CA-C 108.383 -0.969 . . . . 85.07 108.383 178.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -74.7 155.41 37.74 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 122.132 0.968 . . . . 79.14 111.107 -174.579 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 5.1 ptpt -63.77 -31.06 72.11 Favored 'General case' 0 C--O 1.239 0.523 0 CA-C-N 115.059 -0.973 . . . . 80.02 111.991 171.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' GLU . . . . . . . . . . . . . 27.4 mp0 -75.01 -35.62 61.97 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.335 -0.546 . . . . 75.82 111.419 -177.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -67.15 -45.93 75.6 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 120.748 -0.381 . . . . 103.27 110.744 172.11 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' GLN . . . . . . . . . . . . . 45.0 mt-30 -51.15 -40.9 59.61 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 120.593 -0.443 . . . . 76.55 110.97 178.021 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' TYR . . . . . 0.425 ' O ' HG23 ' B' ' 116' ' ' THR . 91.5 t80 -69.31 -39.94 77.94 Favored 'General case' 0 C--O 1.235 0.309 0 C-N-CA 120.742 -0.383 . . . . 69.76 111.828 -179.205 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' GLU . . . . . 0.543 ' HG3' ' N ' ' B' ' 114' ' ' LYS . 5.0 pt-20 -64.49 -39.01 93.0 Favored 'General case' 0 C--O 1.243 0.718 0 C-N-CA 119.074 -1.05 . . . . 88.72 111.123 175.393 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' LYS . . . . . 0.543 ' N ' ' HG3' ' B' ' 113' ' ' GLU . 6.7 mmtt -64.34 -37.14 86.46 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 109.87 -0.419 . . . . 76.82 109.87 179.271 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 59.8 tp -64.15 -47.48 79.72 Favored 'General case' 0 C--O 1.243 0.736 0 CA-C-O 120.85 0.357 . . . . 61.08 111.166 -179.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' THR . . . . . 0.425 HG23 ' O ' ' B' ' 112' ' ' TYR . 16.0 p -65.78 -33.06 74.98 Favored 'General case' 0 C--O 1.232 0.176 0 C-N-CA 118.753 -1.179 . . . . 65.25 111.192 177.098 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' GLU . . . . . . . . . . . . . 6.1 tt0 -62.76 -37.36 86.32 Favored 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 119.568 -0.853 . . . . 71.94 110.184 178.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' ILE . . . . . . . . . . . . . 77.1 mt -79.88 -43.77 22.82 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.223 0 C-N-CA 122.885 0.474 . . . . 59.22 111.306 -175.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' MET . . . . . . . . . . . . . 50.0 mmm -92.25 -10.76 37.36 Favored 'General case' 0 C--O 1.241 0.621 0 N-CA-C 114.019 1.118 . . . . 79.33 114.019 -172.522 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' GLY . . . . . . . . . . . . . . . 105.8 -169.39 15.95 Favored Glycine 0 N--CA 1.443 -0.841 0 N-CA-C 110.35 -1.1 . . . . 71.62 110.35 -173.166 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' ASP . . . . . . . . . . . . . 23.7 p-10 -51.98 175.36 0.02 OUTLIER 'General case' 0 C--O 1.236 0.391 0 N-CA-C 115.014 1.487 . . . . 84.52 115.014 -164.389 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' ASN . . . . . 0.449 ' HB3' ' OE2' ' B' ' 127' ' ' GLU . 0.9 OUTLIER -49.08 159.59 0.26 Allowed 'General case' 0 C--O 1.238 0.495 0 CA-C-N 115.334 -0.848 . . . . 93.47 112.913 -177.91 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' TRP . . . . . 0.536 ' CD1' ' N ' ' B' ' 123' ' ' TRP . 5.1 m0 -102.8 85.01 2.48 Favored 'General case' 0 C--N 1.322 -0.609 0 N-CA-C 104.33 -2.47 . . . . 82.21 104.33 171.739 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' LYS . . . . . . . . . . . . . 7.6 tttm -59.24 -27.04 65.4 Favored 'General case' 0 C--N 1.34 0.162 0 CA-C-N 114.892 -1.049 . . . . 91.98 112.339 -165.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' ILE . . . . . . . . . . . . . 1.5 mp -72.58 -13.8 16.7 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 112.752 0.649 . . . . 69.62 112.752 -174.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -108.69 -6.85 15.77 Favored 'General case' 0 N--CA 1.451 -0.418 0 N-CA-C 113.77 1.026 . . . . 80.78 113.77 -177.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' GLU . . . . . 0.449 ' OE2' ' HB3' ' B' ' 122' ' ' ASN . 7.5 mm-40 -62.92 -33.94 76.39 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 119.038 0.835 . . . . 84.34 112.037 -171.359 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' GLY . . . . . . . . . . . . . . . -77.96 5.2 54.87 Favored Glycine 0 N--CA 1.443 -0.864 0 N-CA-C 117.851 1.9 . . . . 86.75 117.851 -179.16 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -130.84 173.51 10.89 Favored 'General case' 0 N--CA 1.478 0.939 0 O-C-N 124.989 1.052 . . . . 87.01 110.527 -176.592 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' ALA . . . . . . . . . . . . . . . -63.97 157.3 25.36 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 114.796 1.406 . . . . 81.63 114.796 -176.564 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' ASN . . . . . . . . . . . . . 42.8 t-20 -73.29 118.35 67.97 Favored Pre-proline 0 C--O 1.243 0.732 0 CA-C-N 115.037 -0.983 . . . . 81.77 109.868 178.843 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -82.23 -9.18 11.66 Favored 'Trans proline' 0 CA--C 1.51 -0.678 0 N-CA-C 114.069 0.757 . . . . 76.95 114.069 -176.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' LEU . . . . . . . . . . . . . 10.0 mt -78.35 173.06 12.72 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 119.504 -0.878 . . . . 74.73 109.472 179.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 134' ' ' TYR . . . . . . . . . . . . . 42.8 m-85 -114.41 135.99 53.49 Favored 'General case' 0 C--O 1.239 0.523 0 CA-C-N 115.674 -0.693 . . . . 76.95 109.789 -173.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 135' ' ' ASP . . . . . . . . . . . . . 21.4 m-20 -55.49 146.17 20.88 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 108.163 -1.051 . . . . 83.75 108.163 163.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 136' ' ' ALA . . . . . . . . . . . . . . . -148.01 171.65 15.48 Favored 'General case' 0 C--N 1.324 -0.519 0 C-N-CA 119.502 -0.879 . . . . 83.0 109.125 -176.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 137' ' ' TYR . . . . . 0.486 ' OH ' ' OD1' ' B' ' 70' ' ' ASP . 50.0 m-85 -125.14 120.02 30.19 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 106.932 -1.507 . . . . 106.05 106.932 170.971 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 138' ' ' ILE . . . . . . . . . . . . . 6.1 mm -83.15 131.92 32.61 Favored 'Isoleucine or valine' 0 C--O 1.239 0.516 0 N-CA-C 107.869 -1.16 . . . . 99.22 107.869 172.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 139' ' ' VAL . . . . . 0.771 HG13 HG22 ' B' ' 103' ' ' VAL . 32.6 t . . . . . 0 C--N 1.329 -0.303 0 CA-C-N 116.42 -0.355 . . . . 99.0 110.367 -170.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 143' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 0.361 0 CA-C-O 119.814 -0.136 . . . . 126.59 111.214 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 144' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -55.4 -49.72 15.25 Favored 'Trans proline' 0 N--CA 1.481 0.779 0 N-CA-C 115.109 1.157 . . . . 121.75 115.109 -170.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 145' ' ' ASN . . . . . . . . . . . . . 5.4 m-20 -73.82 -17.08 61.12 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 118.916 0.78 . . . . 124.0 111.716 -178.008 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 146' ' ' ASP . . . . . . . . . . . . . 14.6 t70 -94.73 66.38 3.15 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 122.363 1.077 . . . . 123.35 109.072 179.613 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 147' ' ' VAL . . . . . 0.627 HG23 ' H ' ' B' ' 148' ' ' LYS . 3.9 m -127.47 -67.88 0.69 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.447 0 CA-C-N 115.279 -0.873 . . . . 118.99 111.523 -176.992 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 148' ' ' LYS . . . . . 0.627 ' H ' HG23 ' B' ' 147' ' ' VAL . 5.3 mmtt -45.01 -27.57 0.57 Allowed 'General case' 0 C--O 1.234 0.252 0 C-N-CA 124.765 1.226 . . . . 118.92 111.338 -177.267 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 149' ' ' THR . . . . . . . . . . . . . 48.9 p -64.78 -65.01 0.73 Allowed 'General case' 0 C--O 1.239 0.533 0 CA-C-N 116.07 -0.514 . . . . 120.02 111.671 -175.825 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 150' ' ' ILE . . . . . 0.65 HD12 ' HB3' ' B' ' 153' ' ' ASP . 10.9 tp -71.31 -19.82 20.99 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.129 0 O-C-N 121.93 -0.481 . . . . 115.3 110.757 -174.964 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 151' ' ' ALA . . . . . . . . . . . . . . . -58.3 -58.88 6.55 Favored 'General case' 0 C--O 1.238 0.459 0 O-C-N 121.545 -0.722 . . . . 108.2 110.107 170.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 152' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -50.08 -47.57 53.57 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.046 0.45 . . . . 113.46 110.563 169.686 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 153' ' ' ASP . . . . . 0.65 ' HB3' HD12 ' B' ' 150' ' ' ILE . 1.3 t0 -57.32 -39.72 76.42 Favored 'General case' 0 C--N 1.327 -0.402 0 O-C-N 121.789 -0.569 . . . . 110.07 112.298 179.902 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 154' ' ' ALA . . . . . . . . . . . . . . . -71.85 -27.65 63.03 Favored 'General case' 0 C--O 1.24 0.569 0 C-N-CA 120.409 -0.516 . . . . 104.95 111.771 -171.648 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 155' ' ' LYS . . . . . . . . . . . . . 4.6 ttpt -71.88 -14.84 62.06 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 119.738 -0.785 . . . . 107.91 111.544 177.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 156' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.83 -44.54 89.5 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-O 120.598 0.237 . . . . 107.08 111.314 179.772 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 157' ' ' ILE . . . . . 0.493 ' H ' HD12 ' B' ' 157' ' ' ILE . 5.0 mp -56.92 138.41 17.72 Favored 'Isoleucine or valine' 0 C--O 1.238 0.459 0 CA-C-O 121.279 0.561 . . . . 99.21 110.856 -167.99 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 158' ' ' GLU . . . . . 0.423 ' O ' HG22 ' B' ' 157' ' ' ILE . 26.2 pt-20 -64.59 148.22 51.28 Favored 'General case' 0 C--O 1.237 0.418 0 CA-C-O 121.464 0.649 . . . . 112.43 109.842 173.266 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 159' ' ' GLY . . . . . 0.471 ' O ' ' HB2' ' B' ' 65' ' ' ARG . . . 88.38 -30.97 5.0 Favored Glycine 0 CA--C 1.528 0.899 0 N-CA-C 116.744 1.458 . . . . 99.85 116.744 -177.06 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 57.1 t -66.57 136.86 25.95 Favored 'Isoleucine or valine' 0 C--O 1.24 0.584 0 CA-C-N 117.866 0.833 . . . . 94.27 110.119 -177.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 161' ' ' SER . . . . . . . . . . . . . 2.8 t -85.83 -60.68 1.95 Allowed 'General case' 0 C--O 1.235 0.326 0 CA-C-N 116.179 -0.464 . . . . 87.08 110.946 177.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 162' ' ' GLU . . . . . . . . . . . . . 73.7 mm-40 -146.47 166.63 25.86 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-O 121.328 0.585 . . . . 79.62 109.686 -179.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 163' ' ' VAL . . . . . . . . . . . . . 4.3 m -138.08 151.57 25.33 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 N-CA-C 109.163 -0.68 . . . . 88.71 109.163 172.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 164' ' ' GLN . . . . . . . . . . . . . 26.0 tt0 -133.75 138.01 45.52 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 116.122 -0.49 . . . . 87.7 110.457 -177.328 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 165' ' ' ASP . . . . . . . . . . . . . 1.9 p30 . . . . . 0 C--O 1.237 0.398 0 CA-C-O 121.645 0.736 . . . . 96.17 112.51 -177.63 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' UMQ . . . . . 0.443 H4'1 ' H21' ' A' ' 201' ' ' UMQ . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' TRS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . 0.643 ' O ' ' N ' ' A' ' 121' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 306' ' ' HOH . . . . . 0.525 ' O ' ' HG2' ' A' ' 124' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_