data_2o5a_residue 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 2o5a _Structure_validation_residue.Date_analyzed 2016-10-12 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 ' 2' ' ' SER . . . . . 0.704 ' OG ' ' N ' ' A' ' 3' ' ' ASN . 10.8 t . . . . . 0 N--CA 1.491 1.625 0 CA-C-O 121.058 0.456 . . . . 76.13 110.523 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ASN . . . . . 0.704 ' N ' ' OG ' ' A' ' 2' ' ' SER . 2.5 t30 -140.09 -168.61 2.56 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 115.779 -0.646 . . . . 84.36 112.738 -179.355 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 19.4 mt-30 -64.71 -9.07 17.33 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 113.668 0.988 . . . . 78.62 113.668 -179.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 28.3 mp0 -67.5 -44.46 78.39 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.807 -0.357 . . . . 97.37 111.951 179.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -78.33 -43.03 28.91 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 107.057 -1.46 . . . . 52.81 107.057 179.238 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 21.7 tp -57.51 -47.45 81.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.392 -0.822 . . . . 48.83 112.173 -179.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -67.09 -29.12 68.8 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 108.855 -0.794 . . . . 82.22 108.855 179.043 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 18.4 tp -67.69 -41.51 83.52 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 108.519 -0.919 . . . . 49.44 108.519 179.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -74.74 -39.22 61.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.792 -0.64 . . . . 41.83 111.323 179.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 82.2 t -61.05 -42.14 91.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.412 -0.358 . . . . 38.42 111.069 179.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -65.91 -54.4 26.98 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.507 -0.315 . . . . 43.1 110.749 179.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -48.1 -55.02 11.27 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.139 -0.689 . . . . 40.45 109.139 179.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 2.1 t -60.27 -29.27 43.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.579 -0.737 . . . . 38.07 111.211 179.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -77.74 -31.4 52.1 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 113.546 0.943 . . . . 48.89 113.546 -179.525 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -63.86 -28.8 70.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.739 0.304 . . . . 65.77 110.782 179.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 10.3 mmpt? -93.74 6.08 49.54 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 113.935 1.087 . . . . 41.89 113.935 -179.161 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 25.4 mmtp 73.06 28.46 1.91 Allowed 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 116.027 1.862 . . . . 44.39 116.027 178.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -61.84 133.75 55.86 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.696 -0.853 . . . . 32.09 108.696 179.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 91.5 mt-10 -97.66 155.55 16.94 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 115.112 1.523 . . . . 33.12 115.112 -178.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 53.9 49.26 19.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.047 -0.979 . . . . 27.06 113.52 179.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 55.3 t -67.38 124.86 23.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.093 -0.503 . . . . 26.45 110.552 179.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 62.3 t -136.89 132.33 47.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.913 -0.585 . . . . 27.84 110.875 179.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -104.41 144.62 31.41 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 107.978 -1.119 . . . . 30.4 107.978 179.003 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 88.2 mt -125.24 123.27 39.17 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.981 0.42 . . . . 33.81 110.625 179.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ASN . . . . . 0.858 ' OD1' ' CB ' ' A' ' 28' ' ' LYS . 13.3 t-20 -76.76 105.36 7.78 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 107.461 -1.311 . . . . 40.76 107.461 179.66 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' MSE . . . . . 1.331 ' CG ' 'SE ' ' A' ' 27' ' ' MSE . 7.3 mmm -99.12 35.84 1.83 Allowed 'General case' 0 C--O 1.177 -2.726 0 CA-C-O 123.624 1.678 . . . . 44.23 106.886 -164.977 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LYS . . . . . 0.858 ' CB ' ' OD1' ' A' ' 26' ' ' ASN . 88.4 tttt -105.83 104.19 13.85 Favored 'General case' 0 N--CA 1.403 -2.802 0 N-CA-C 103.629 -2.73 . . . . 50.15 103.629 -154.216 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLY . . . . . 0.437 ' C ' ' CD1' ' B' ' 32' ' ' LEU . . . 107.15 -7.8 37.94 Favored Glycine 0 C--N 1.316 -0.574 0 CA-C-O 125.193 2.552 . . . . 58.22 109.803 -170.099 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.0 mm -116.04 -50.24 4.65 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 CA-C-N 111.831 -2.185 . . . . 59.93 111.812 -170.045 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 36.9 t -118.97 170.55 8.94 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.133 -0.485 . . . . 62.26 111.335 179.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 27.7 mt . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 115.025 -0.989 . . . . 56.49 110.476 -179.313 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 . . . . . 0 CA--C 1.524 -0.052 0 N-CA-C 109.804 -0.443 . . . . 56.2 109.804 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -134.61 143.32 47.25 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.909 -0.587 . . . . 30.6 112.29 179.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 3.1 m-30 -125.43 116.32 21.66 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 104.66 -2.348 . . . . 20.77 104.66 178.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 42.7 tp -100.87 122.56 43.66 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 121.013 -0.275 . . . . 22.0 111.293 -179.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 8.4 mt -114.69 144.71 21.67 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 N-CA-C 114.43 1.27 . . . . 29.43 114.43 -179.583 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 29.2 p -169.73 178.13 4.21 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 107.718 -1.216 . . . . 28.88 107.718 179.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' HIS . . . . . 0.455 ' CD2' ' OH ' ' A' ' 97' ' ' TYR . 3.4 p80 -150.77 161.68 42.18 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 113.224 0.824 . . . . 32.76 113.224 -179.461 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -114.61 161.4 12.76 Favored Glycine 0 N--CA 1.451 -0.303 0 N-CA-C 106.937 -2.465 . . . . 25.49 106.937 178.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ASN . . . . . 0.46 ' N ' ' OE1' ' A' ' 47' ' ' GLN . 77.6 m-20 -93.74 -2.24 54.02 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 113.09 0.774 . . . . 21.99 113.09 -179.142 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 59.6 p -156.49 162.05 39.99 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 107.356 -1.35 . . . . 20.04 107.356 179.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 88.6 mt-10 -65.48 -25.12 67.35 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.536 -0.466 . . . . 21.52 111.115 -179.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -74.74 -36.8 62.63 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.467 -0.568 . . . . 35.68 109.467 178.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLN . . . . . 0.46 ' OE1' ' N ' ' A' ' 43' ' ' ASN . 9.6 tt0 -73.59 -35.55 65.43 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.741 -0.383 . . . . 25.61 110.252 -179.767 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 53.3 t -64.24 -41.35 92.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.344 -0.389 . . . . 22.26 110.143 179.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -71.93 -31.45 66.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.255 -0.43 . . . . 29.3 111.216 179.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.5 -43.5 97.04 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.437 -0.949 . . . . 23.55 108.437 179.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 66.9 mt -63.8 -53.54 43.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.584 -0.735 . . . . 27.77 109.905 179.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.21 -34.34 66.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.63 -0.714 . . . . 22.24 111.793 -179.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 34.0 t-80 -75.26 -39.47 59.78 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.395 0.517 . . . . 26.45 112.395 -179.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 34.0 tp10 -64.09 -32.79 74.47 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 108.631 -0.877 . . . . 45.5 108.631 179.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -69.8 -40.29 76.04 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 108.191 -1.04 . . . . 36.05 108.191 179.26 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -67.48 -47.1 71.05 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.821 -0.807 . . . . 37.0 108.821 179.133 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 56.5 tttm -57.11 -48.76 77.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.644 -0.707 . . . . 60.91 110.57 179.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 10.8 t -66.29 -35.21 74.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 112.236 0.458 . . . . 44.64 112.236 179.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.72 -33.03 74.92 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.96 0.356 . . . . 55.27 111.96 -179.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 -82.98 -15.82 49.72 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.388 0.514 . . . . 68.4 112.388 -179.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 76.8 mt-10 -80.38 -48.9 12.23 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 107.633 -1.247 . . . . 67.19 107.633 178.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -74.6 -6.97 51.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.287 -0.87 . . . . 57.6 110.325 -179.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 71.0 43.12 58.22 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.8 -0.714 . . . . 49.59 113.691 179.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 47.1 mt -103.66 129.91 54.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 N-CA-C 109.681 -0.489 . . . . 41.05 109.681 179.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -77.02 124.22 27.48 Favored 'General case' 0 C--O 1.185 -2.303 0 O-C-N 121.663 -0.648 . . . . 42.7 112.304 -176.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.0 mt -86.14 111.21 20.89 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 N-CA-C 106.647 -1.612 . . . . 40.16 106.647 179.318 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 70.1 mttt -74.86 -39.42 61.57 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.892 -0.595 . . . . 56.8 112.534 -179.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 68.5 mtm180 -144.02 154.85 43.69 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 113.281 0.845 . . . . 38.23 113.281 179.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 10.0 tt -159.85 106.84 1.65 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 104.74 -2.319 . . . . 35.99 104.74 178.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 68.3 mt-10 -133.3 145.94 50.91 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 113.197 0.814 . . . . 53.94 113.197 -177.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 79.7 17.12 76.07 Favored Glycine 0 N--CA 1.451 -0.349 0 CA-C-N 115.604 -0.725 . . . . 32.63 114.905 179.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 68.3 t80 -65.07 -51.56 60.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 117.224 0.512 . . . . 34.16 112.035 -179.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -54.17 -53.72 49.52 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.08 0.4 . . . . 62.81 112.08 -179.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -63.67 -31.72 72.98 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.56 0.578 . . . . 39.7 112.56 -179.485 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . 54.62 40.51 31.92 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 114.054 1.131 . . . . 26.87 114.054 179.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -110.22 -38.03 5.39 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 106.877 -1.527 . . . . 24.06 106.877 178.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' TRP . . . . . 0.559 ' CH2' ' CG ' ' B' ' 103' ' ' LEU . 5.9 t90 -153.43 93.66 1.72 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.182 -1.044 . . . . 22.11 108.182 179.422 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 41.1 t -95.32 127.12 47.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.875 -0.602 . . . . 13.38 110.416 -179.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 7.5 tt -112.04 121.6 45.42 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.994 -0.743 . . . . 18.01 108.994 179.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ILE . . . . . 0.485 ' CD1' ' N ' ' A' ' 80' ' ' ILE . 2.4 mp -115.81 105.68 18.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 108.412 -0.958 . . . . 26.26 108.412 179.72 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 21.5 t0 -86.75 110.06 19.66 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.433 -0.349 . . . . 33.04 110.315 -179.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 84.4 mt -104.22 10.47 35.69 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.411 -0.359 . . . . 32.28 111.167 179.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 100.74 -106.94 3.19 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.646 -0.788 . . . . 36.61 112.623 -179.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ASP . . . . . 0.567 ' CB ' ' CB ' ' A' ' 2' ' ' SER . 64.9 m-20 -62.25 -21.62 65.33 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.924 0.392 . . . . 52.65 110.58 179.815 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 24.7 t -125.78 137.35 57.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.933 -0.576 . . . . 30.07 109.852 179.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 71.1 t -125.46 120.0 56.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 107.533 -1.284 . . . . 20.61 107.533 179.162 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 21.9 t -98.07 137.9 24.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 112.709 0.633 . . . . 15.32 112.709 -179.154 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' HIS . . . . . . . . . . . . . 70.6 m80 -120.24 110.68 16.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.473 -0.785 . . . . 22.68 109.073 178.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 53.2 t -106.3 104.27 16.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 109.44 -0.578 . . . . 16.01 109.44 179.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -95.33 162.34 13.71 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 113.256 0.835 . . . . 17.55 113.256 -179.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 24.5 t-80 -94.36 132.82 38.58 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 101.123 -3.658 . . . . 25.58 101.123 176.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 6.4 pttm -43.59 -24.75 0.13 Allowed 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 114.256 1.206 . . . . 32.35 114.256 -178.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -95.89 1.96 53.32 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 115.017 1.488 . . . . 44.85 115.017 -179.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLU . . . . . 0.444 ' OE2' ' O ' ' A' 3057 ' ' HOH . 24.2 tp10 -71.8 128.27 35.21 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.928 -0.309 . . . . 68.02 110.256 179.932 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ARG . . . . . . . . . . . . . 61.4 mtm180 -69.73 -41.86 74.75 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 115.116 1.524 . . . . 98.95 115.116 -179.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.17 -14.2 16.11 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.641 -0.503 . . . . 63.82 109.641 179.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' TYR . . . . . 0.455 ' OH ' ' CD2' ' A' ' 41' ' ' HIS . 26.6 t80 -77.79 -19.5 54.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.538 -0.755 . . . . 63.86 111.548 -179.755 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -106.33 -2.08 22.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.172 0.51 . . . . 76.36 110.712 179.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -114.63 9.09 16.45 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 107.456 -1.313 . . . . 73.86 107.456 178.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' LEU . . . . . 0.402 ' CG ' ' CZ3' ' A' ' 104' ' ' TRP . 3.1 tp -66.66 -0.49 2.92 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 108.386 -0.968 . . . . 78.36 108.386 179.913 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -76.41 -52.04 10.64 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 107.662 -1.236 . . . . 113.3 107.662 179.514 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 59.1 mttm -47.53 -56.1 7.79 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 107.438 -1.319 . . . . 78.68 107.438 179.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' LEU . . . . . 0.448 ' O ' ' C ' ' A' ' 104' ' ' TRP . 15.1 mt -66.25 153.11 43.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.411 -0.813 . . . . 74.76 109.038 178.867 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' TRP . . . . . 0.448 ' C ' ' O ' ' A' ' 103' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.325 -0.482 0 C-N-CA 120.067 -0.653 . . . . 64.65 109.928 177.853 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo . . . . . 0 CA--C 1.527 0.156 0 CA-C-O 120.76 0.233 . . . . 44.84 111.72 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 19.4 p -80.3 174.96 11.08 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 113.02 0.748 . . . . 45.12 113.02 -179.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 21.4 t -126.32 120.78 57.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.483 -0.781 . . . . 43.04 110.474 179.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.4 83.97 0.4 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.052 -0.522 . . . . 44.87 109.807 179.967 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' LEU . . . . . 0.439 ' O ' ' N ' ' A' ' 114' ' ' GLY . 66.9 mt -42.35 -55.97 3.16 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 113.339 0.866 . . . . 50.37 113.339 -179.515 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -68.81 67.42 0.14 Allowed 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 107.9 -1.148 . . . . 64.03 107.9 179.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' GLY . . . . . 0.439 ' N ' ' O ' ' A' ' 112' ' ' LEU . . . . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.56 -1.133 . . . . 60.98 112.37 -179.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' ASN . . . . . 0.401 ' CG ' ' N ' ' B' ' 4' ' ' GLN . 56.0 t30 . . . . . 0 N--CA 1.493 1.678 0 N-CA-C 109.511 -0.552 . . . . 80.72 109.511 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' GLN . . . . . 0.401 ' N ' ' CG ' ' B' ' 3' ' ' ASN . 17.7 mt-30 -60.19 -11.12 5.45 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 113.09 0.774 . . . . 85.19 113.09 -179.761 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' GLU . . . . . . . . . . . . . 24.3 mp0 -68.11 -47.57 67.83 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 111.808 0.299 . . . . 98.0 111.808 179.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.2 -41.76 48.43 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 107.204 -1.406 . . . . 58.16 107.204 179.24 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' LEU . . . . . . . . . . . . . 23.9 tp -58.06 -47.54 82.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.295 -0.866 . . . . 52.32 112.081 -179.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -67.69 -28.3 67.56 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.005 -0.739 . . . . 93.9 109.005 178.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 19.7 tp -68.49 -39.95 81.12 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 108.496 -0.928 . . . . 53.52 108.496 179.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.21 -38.83 55.93 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.65 -0.705 . . . . 44.56 111.352 179.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 97.2 t -61.69 -41.55 90.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.438 -0.347 . . . . 41.37 111.033 179.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -66.59 -54.78 19.81 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.432 -0.349 . . . . 53.94 110.756 179.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -47.64 -54.13 12.82 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.25 -0.648 . . . . 44.8 109.25 179.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' VAL . . . . . . . . . . . . . 2.1 t -61.24 -28.4 43.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.49 -0.777 . . . . 40.78 111.391 179.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -78.92 -30.7 44.89 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 113.356 0.873 . . . . 52.59 113.356 -179.516 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -64.53 -28.77 69.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.835 0.35 . . . . 61.41 110.95 179.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' LYS . . . . . . . . . . . . . 10.7 mmpt? -94.24 6.74 47.71 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 113.959 1.096 . . . . 48.0 113.959 -179.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 28.5 mmtp 72.71 30.11 1.86 Allowed 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 115.991 1.848 . . . . 47.68 115.991 178.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' ALA . . . . . . . . . . . . . . . -62.33 132.93 54.25 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.66 -0.867 . . . . 36.76 108.66 179.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -96.86 154.12 17.48 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 115.246 1.572 . . . . 54.66 115.246 -178.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 53.64 50.22 17.64 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.107 -0.951 . . . . 50.28 113.453 179.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' VAL . . . . . . . . . . . . . 43.0 t -68.3 125.65 26.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.985 0.422 . . . . 35.47 110.682 179.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' VAL . . . . . . . . . . . . . 56.1 t -136.65 131.64 47.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.872 -0.604 . . . . 34.41 110.823 179.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -104.21 146.41 28.81 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 107.748 -1.205 . . . . 36.13 107.748 179.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 86.6 mt -126.82 122.62 35.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.203 -0.453 . . . . 38.84 110.545 -179.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -77.68 109.03 11.31 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 107.43 -1.322 . . . . 47.72 107.43 179.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' MSE . . . . . . . . . . . . . 93.0 mmm -89.7 8.67 30.44 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 113.109 0.781 . . . . 60.18 113.109 -179.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.61 117.64 5.57 Favored 'General case' 0 C--O 1.195 -1.808 0 O-C-N 121.899 -0.501 . . . . 51.12 111.502 175.793 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' GLY . . . . . . . . . . . . . . . 87.96 9.83 70.3 Favored Glycine 0 C--N 1.312 -0.766 0 C-N-CA 119.591 -1.29 . . . . 59.41 111.34 -178.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 11.0 mm -128.88 -50.43 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.869 0.366 . . . . 60.42 111.199 -179.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' SER . . . . . . . . . . . . . 12.1 t -121.62 178.0 5.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.093 -0.503 . . . . 61.83 110.937 -179.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' LEU . . . . . 0.437 ' CD1' ' C ' ' A' ' 29' ' ' GLY . 56.3 mt . . . . . 0 C--N 1.328 -0.35 0 N-CA-C 112.649 0.611 . . . . 68.85 112.649 -179.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 . . . . . 0 C--O 1.201 -1.489 0 N-CA-C 115.419 1.637 . . . . 60.21 115.419 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -135.35 127.61 30.14 Favored 'General case' 0 C--O 1.172 -2.985 0 CA-C-N 116.053 -0.521 . . . . 43.17 111.56 -173.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 -107.17 132.29 53.2 Favored 'General case' 0 C--O 1.155 -3.885 0 N-CA-C 108.759 -0.83 . . . . 37.63 108.759 170.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 12.6 tp -121.19 131.65 54.36 Favored 'General case' 0 C--O 1.174 -2.902 0 C-N-CA 116.706 -1.998 . . . . 38.54 112.359 -178.053 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' ILE . . . . . . . . . . . . . 4.3 mt -122.1 147.19 26.29 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.38 0 CA-C-N 113.3 -1.773 . . . . 39.65 112.953 -177.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' CYS . . . . . . . . . . . . . 31.9 p -170.64 175.84 4.49 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 105.944 -1.873 . . . . 35.68 105.944 179.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' HIS . . . . . 0.46 ' CD2' ' OH ' ' B' ' 97' ' ' TYR . 3.8 p80 -149.62 163.03 39.01 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 113.119 0.785 . . . . 58.09 113.119 -179.279 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . -115.46 161.91 12.68 Favored Glycine 0 N--CA 1.449 -0.498 0 N-CA-C 106.947 -2.461 . . . . 30.46 106.947 178.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -94.18 -1.55 53.97 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 113.018 0.747 . . . . 33.46 113.018 -179.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 24.9 p -157.13 161.2 39.38 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 107.477 -1.305 . . . . 26.61 107.477 179.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 88.7 mt-10 -64.56 -25.14 67.85 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.582 -0.447 . . . . 38.58 111.166 -179.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 76.8 tttt -74.34 -37.25 63.6 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.558 -0.534 . . . . 31.1 109.558 178.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -73.7 -36.02 65.22 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.311 -0.404 . . . . 38.21 110.285 -179.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' VAL . . . . . . . . . . . . . 45.9 t -63.89 -41.19 91.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 N-CA-C 110.111 -0.329 . . . . 25.94 110.111 179.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' GLN . . . . . . . . . . . . . 23.4 mt-30 -72.18 -31.4 65.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.251 -0.431 . . . . 33.49 111.173 179.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.78 -42.3 97.8 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.371 -0.974 . . . . 26.27 108.371 179.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' ILE . . . . . . . . . . . . . 88.3 mt -65.5 -51.93 57.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.456 -0.793 . . . . 29.77 110.631 -179.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.49 -36.93 69.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.879 -0.601 . . . . 22.62 111.108 179.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 21.6 t-80 -72.42 -40.53 67.07 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.559 0.578 . . . . 27.9 112.559 -179.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 32.6 tp10 -62.21 -32.98 73.71 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.777 -0.823 . . . . 52.63 108.777 179.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -70.5 -41.67 72.34 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.144 -1.058 . . . . 38.1 108.144 179.326 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -65.14 -48.29 74.06 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 108.838 -0.801 . . . . 39.22 108.838 179.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' LYS . . . . . . . . . . . . . 56.8 tttm -57.46 -48.34 79.44 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.542 -0.753 . . . . 68.34 110.538 -179.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 15.8 t -65.94 -34.58 71.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 N-CA-C 112.341 0.497 . . . . 46.21 112.341 179.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.12 -32.87 74.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.375 -0.375 . . . . 57.29 111.829 -179.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 81.6 mt-30 -82.67 -15.03 53.55 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.37 0.507 . . . . 77.49 112.37 -179.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' GLU . . . . . . . . . . . . . 78.7 mt-10 -81.2 -48.85 11.52 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 107.598 -1.26 . . . . 63.16 107.598 178.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' GLN . . . . . . . . . . . . . 5.0 tp60 -74.34 -7.66 53.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.383 -0.826 . . . . 75.91 110.403 -179.534 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . 71.81 40.0 58.75 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.832 -0.699 . . . . 54.29 113.602 179.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 3.4 mt -106.39 142.59 18.95 Favored 'Isoleucine or valine' 0 C--O 1.175 -2.827 0 O-C-N 120.428 -1.63 . . . . 50.33 108.636 179.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -93.22 123.76 36.73 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 114.589 1.329 . . . . 46.33 114.589 -167.811 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' ILE . . . . . . . . . . . . . 27.8 mt -84.09 113.42 22.9 Favored 'Isoleucine or valine' 0 N--CA 1.401 -2.925 0 N-CA-C 104.379 -2.452 . . . . 45.29 104.379 -174.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -75.91 -39.22 56.71 Favored 'General case' 0 C--N 1.295 -1.775 0 CA-C-N 114.949 -1.023 . . . . 67.52 112.741 177.209 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 67.4 mtm180 -144.31 155.53 43.86 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 113.254 0.835 . . . . 40.76 113.254 179.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' LEU . . . . . . . . . . . . . 10.3 tt -160.71 107.22 1.49 Allowed 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 104.636 -2.357 . . . . 35.72 104.636 178.502 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -133.81 146.01 50.27 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.997 0.74 . . . . 44.45 112.997 -178.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . 79.92 18.86 71.53 Favored Glycine 0 N--CA 1.451 -0.309 0 N-CA-C 114.942 0.737 . . . . 34.1 114.942 179.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' TYR . . . . . . . . . . . . . 73.1 t80 -67.23 -49.63 63.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 117.097 0.448 . . . . 37.0 111.929 -179.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -55.02 -53.09 60.24 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.194 0.442 . . . . 64.36 112.194 179.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -64.9 -31.41 72.63 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.612 0.597 . . . . 58.98 112.612 -179.5 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' ALA . . . . . . . . . . . . . . . 54.23 39.86 31.18 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 114.216 1.191 . . . . 30.46 114.216 179.206 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' ARG . . . . . . . . . . . . . 24.2 mmm180 -110.22 -35.12 6.18 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 107.095 -1.446 . . . . 37.13 107.095 178.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' TRP . . . . . . . . . . . . . 5.9 t90 -156.18 92.35 1.33 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.993 -1.003 . . . . 33.27 108.355 179.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' VAL . . . . . . . . . . . . . 23.6 t -94.73 128.88 45.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.859 -0.61 . . . . 15.74 110.526 -179.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 7.2 tt -113.01 124.01 51.64 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.204 -0.665 . . . . 23.61 109.204 179.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' ILE . . . . . 0.677 ' CD1' ' N ' ' B' ' 80' ' ' ILE . 0.7 OUTLIER -118.7 105.21 17.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 108.56 -0.904 . . . . 27.19 108.56 179.617 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' ASP . . . . . . . . . . . . . 21.7 t0 -85.12 109.35 18.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 41.45 110.238 -179.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 80.7 mt -102.97 10.05 38.39 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.557 -0.292 . . . . 35.25 111.096 -179.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 99.97 -105.7 3.04 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.761 -0.733 . . . . 40.72 112.658 179.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' ASP . . . . . . . . . . . . . 61.8 m-20 -63.51 -20.59 65.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.963 0.411 . . . . 63.55 110.431 179.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' VAL . . . . . . . . . . . . . 10.3 t -126.87 136.35 61.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.799 -0.637 . . . . 35.3 109.969 179.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 79.7 t -124.66 121.22 60.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 107.487 -1.301 . . . . 22.47 107.487 179.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' VAL . . . . . . . . . . . . . 9.4 t -100.37 136.59 31.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 N-CA-C 112.709 0.633 . . . . 18.82 112.709 -179.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' HIS . . . . . . . . . . . . . 73.2 m80 -118.57 109.83 16.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.554 -0.748 . . . . 33.91 109.09 178.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' VAL . . . . . . . . . . . . . 44.3 t -105.0 104.58 17.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 109.382 -0.599 . . . . 19.64 109.382 179.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' PHE . . . . . . . . . . . . . 72.0 m-85 -96.32 162.77 13.36 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 113.353 0.871 . . . . 21.84 113.353 -179.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' HIS . . . . . . . . . . . . . 26.0 t-80 -94.39 134.43 36.9 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 101.143 -3.651 . . . . 30.47 101.143 177.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 9.1 pttm -45.37 -22.48 0.14 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 114.218 1.192 . . . . 54.22 114.218 -178.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -98.61 4.46 48.04 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 114.886 1.439 . . . . 49.93 114.886 -179.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' GLU . . . . . . . . . . . . . 24.0 tp10 -73.89 129.14 37.29 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.771 -0.372 . . . . 88.35 110.078 179.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' ARG . . . . . . . . . . . . . 61.8 mtm180 -70.22 -42.5 72.22 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 115.072 1.508 . . . . 118.92 115.072 -179.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.34 -15.67 17.7 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.608 -0.516 . . . . 70.54 109.608 179.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' TYR . . . . . 0.46 ' OH ' ' CD2' ' B' ' 41' ' ' HIS . 21.8 t80 -77.13 -18.82 57.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.544 -0.753 . . . . 74.35 111.623 -179.835 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -106.09 -3.65 21.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.148 0.499 . . . . 113.43 110.639 179.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -113.38 8.99 18.12 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 107.664 -1.236 . . . . 85.91 107.664 178.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' LEU . . . . . . . . . . . . . 3.5 tp -67.01 1.25 2.04 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.543 -0.91 . . . . 85.43 108.543 179.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -77.44 -52.64 8.76 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 107.554 -1.276 . . . . 117.28 107.554 179.388 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' LYS . . . . . . . . . . . . . 61.6 mttm -46.93 -57.14 5.27 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 107.332 -1.359 . . . . 80.8 107.332 179.084 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' LEU . . . . . 0.559 ' CG ' ' CH2' ' A' ' 77' ' ' TRP . 33.9 mt -57.69 125.33 22.48 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 105.515 -2.031 . . . . 80.5 105.515 178.46 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.331 -0.236 0 CA-C-N 115.564 -0.744 . . . . 76.68 110.95 -179.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo . . . . . 0 N--CA 1.466 -0.137 0 CA-C-O 120.853 0.272 . . . . 79.18 112.134 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 51.2 p -76.17 122.52 24.45 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 113.076 0.769 . . . . 77.34 113.076 -179.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' VAL . . . . . . . . . . . . . 83.7 t -73.53 144.81 12.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 108.843 -0.799 . . . . 74.02 108.843 179.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -85.14 151.46 24.1 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.91 -0.404 . . . . 84.75 109.91 -179.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' LEU . . . . . . . . . . . . . 23.8 mt . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.164 -0.922 . . . . 82.0 111.612 -179.744 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' ' MN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' ' MN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ' MN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' ' MN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 3002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 3004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 3005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 3006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 3008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 3020 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 3021 ' ' HOH . . . . . 0.408 ' O ' ' CD2' ' A' ' 103' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 3024 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 3025 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 3026 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 3029 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 3030 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 3034 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 3035 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 3040 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 3047 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 3050 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 3052 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 3054 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 3055 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 3056 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 3057 ' ' HOH . . . . . 0.444 ' O ' ' OE2' ' A' ' 94' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 3007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 3012 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 3015 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 3016 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 3017 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 3018 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 3023 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 3031 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 3036 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 3037 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 3038 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 3042 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 3045 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 3046 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 3048 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 3049 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 3053 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' SER . . . . . 0.704 ' OG ' ' N ' ' A' ' 3' ' ' ASN . 10.8 t . . . . . 0 N--CA 1.491 1.625 0 CA-C-O 121.058 0.456 . . . . 76.13 110.523 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ASN . . . . . 0.704 ' N ' ' OG ' ' A' ' 2' ' ' SER . 2.5 t30 -140.09 -168.61 2.56 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 115.779 -0.646 . . . . 84.36 112.738 -179.355 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.5 mt-30 -64.71 -9.07 17.33 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 113.668 0.988 . . . . 78.62 113.668 -179.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' GLU . . . . . 0.507 ' OE2' ' HB3' ' A' ' 3' ' ' ASN . 28.3 mp0 -67.5 -44.46 78.39 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.807 -0.357 . . . . 97.37 111.951 179.855 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' LEU . . . . . 0.642 HD21 HD13 ' A' ' 64' ' ' ILE . 0.1 OUTLIER -78.33 -43.03 28.91 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 107.057 -1.46 . . . . 52.81 107.057 179.238 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LEU . . . . . 0.591 ' O ' HG23 ' A' ' 11' ' ' VAL . 21.7 tp -57.51 -47.45 81.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.392 -0.822 . . . . 48.83 112.173 -179.667 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -67.09 -29.12 68.8 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 108.855 -0.794 . . . . 82.22 108.855 179.043 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LEU . . . . . 0.409 HD23 ' CD1' ' A' ' 64' ' ' ILE . 18.4 tp -67.69 -41.51 83.52 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 108.519 -0.919 . . . . 49.44 108.519 179.931 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -74.74 -39.22 61.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.792 -0.64 . . . . 41.83 111.323 179.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' VAL . . . . . 0.591 HG23 ' O ' ' A' ' 7' ' ' LEU . 82.2 t -61.05 -42.14 91.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.412 -0.358 . . . . 38.42 111.069 179.987 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 63.5 m-20 -65.91 -54.4 26.98 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.507 -0.315 . . . . 43.1 110.749 179.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -48.1 -55.02 11.27 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.139 -0.689 . . . . 40.45 109.139 179.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' VAL . . . . . 0.672 HG13 ' HB3' ' A' ' 19' ' ' ALA . 2.1 t -60.27 -29.27 43.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.579 -0.737 . . . . 38.07 111.211 179.498 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -77.74 -31.4 52.1 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 113.546 0.943 . . . . 48.89 113.546 -179.525 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -63.86 -28.8 70.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.739 0.304 . . . . 65.77 110.782 179.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LYS . . . . . 0.687 ' HE2' ' HA ' ' A' ' 17' ' ' LYS . 10.3 mmpt? -93.74 6.08 49.54 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 113.935 1.087 . . . . 41.89 113.935 -179.161 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LYS . . . . . 0.406 ' HB2' ' O ' ' A' ' 17' ' ' LYS . 25.4 mmtp 73.06 28.46 1.91 Allowed 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 116.027 1.862 . . . . 44.39 116.027 178.687 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ALA . . . . . 0.672 ' HB3' HG13 ' A' ' 14' ' ' VAL . . . -61.84 133.75 55.86 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.696 -0.853 . . . . 32.09 108.696 179.471 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 91.5 mt-10 -97.66 155.55 16.94 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 115.112 1.523 . . . . 33.12 115.112 -178.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 53.9 49.26 19.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.047 -0.979 . . . . 27.06 113.52 179.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 55.3 t -67.38 124.86 23.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.093 -0.503 . . . . 26.45 110.552 179.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 62.3 t -136.89 132.33 47.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.913 -0.585 . . . . 27.84 110.875 179.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -104.41 144.62 31.41 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 107.978 -1.119 . . . . 30.4 107.978 179.003 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LEU . . . . . 0.509 ' O ' ' HG2' ' A' ' 27' ' ' MSE . 88.2 mt -125.24 123.27 39.17 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.981 0.42 . . . . 33.81 110.625 179.999 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ASN . . . . . 0.858 ' OD1' ' CB ' ' A' ' 28' ' ' LYS . 13.3 t-20 -76.76 105.36 7.78 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 107.461 -1.311 . . . . 40.76 107.461 179.66 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' MSE . . . . . 1.331 ' CG ' 'SE ' ' A' ' 27' ' ' MSE . 7.3 mmm -99.12 35.84 1.83 Allowed 'General case' 0 C--O 1.177 -2.726 0 CA-C-O 123.624 1.678 . . . . 44.23 106.886 -164.977 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LYS . . . . . 0.858 ' CB ' ' OD1' ' A' ' 26' ' ' ASN . 88.4 tttt -105.83 104.19 13.85 Favored 'General case' 0 N--CA 1.403 -2.802 0 N-CA-C 103.629 -2.73 . . . . 50.15 103.629 -154.216 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLY . . . . . 0.905 ' C ' HD12 ' B' ' 32' ' ' LEU . . . 107.15 -7.8 37.94 Favored Glycine 0 C--N 1.316 -0.574 0 CA-C-O 125.193 2.552 . . . . 58.22 109.803 -170.099 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.0 mm -116.04 -50.24 4.65 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 CA-C-N 111.831 -2.185 . . . . 59.93 111.812 -170.045 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' SER . . . . . 0.611 ' HB2' ' HE3' ' A' ' 27' ' ' MSE . 36.9 t -118.97 170.55 8.94 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.133 -0.485 . . . . 62.26 111.335 179.602 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LEU . . . . . 0.748 HD21 HD21 ' B' ' 32' ' ' LEU . 27.7 mt . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 115.025 -0.989 . . . . 56.49 110.476 -179.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 . . . . . 0 CA--C 1.524 -0.052 0 N-CA-C 109.804 -0.443 . . . . 56.2 109.804 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 36' ' ' PHE . . . . . 0.588 ' HB2' HG22 ' A' ' 85' ' ' VAL . 49.9 m-85 -134.61 143.32 47.25 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.909 -0.587 . . . . 30.6 112.29 179.79 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' PHE . . . . . 0.471 ' CE2' ' HE2' ' A' ' 27' ' ' MSE . 3.1 m-30 -125.43 116.32 21.66 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 104.66 -2.348 . . . . 20.77 104.66 178.306 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 42.7 tp -100.87 122.56 43.66 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 121.013 -0.275 . . . . 22.0 111.293 -179.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 8.4 mt -114.69 144.71 21.67 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 N-CA-C 114.43 1.27 . . . . 29.43 114.43 -179.583 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 29.2 p -169.73 178.13 4.21 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 107.718 -1.216 . . . . 28.88 107.718 179.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' HIS . . . . . 0.568 ' C ' ' CD2' ' A' ' 41' ' ' HIS . 2.9 p-80 -150.77 161.68 42.18 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 113.224 0.824 . . . . 32.76 113.224 -179.461 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -114.61 161.4 12.76 Favored Glycine 0 N--CA 1.451 -0.303 0 N-CA-C 106.937 -2.465 . . . . 25.49 106.937 178.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 22.6 m120 -93.74 -2.24 54.02 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 113.09 0.774 . . . . 21.99 113.09 -179.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 59.6 p -156.49 162.05 39.99 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 107.356 -1.35 . . . . 20.04 107.356 179.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 88.6 mt-10 -65.48 -25.12 67.35 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.536 -0.466 . . . . 21.52 111.115 -179.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -74.74 -36.8 62.63 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.467 -0.568 . . . . 35.68 109.467 178.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLN . . . . . 0.494 ' O ' HG13 ' A' ' 51' ' ' ILE . 9.6 tt0 -73.59 -35.55 65.43 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.741 -0.383 . . . . 25.61 110.252 -179.767 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' VAL . . . . . 0.536 HG13 HG12 ' A' ' 89' ' ' VAL . 53.3 t -64.24 -41.35 92.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.344 -0.389 . . . . 22.26 110.143 179.681 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 82.1 mt-30 -71.93 -31.45 66.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.255 -0.43 . . . . 29.3 111.216 179.516 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.5 -43.5 97.04 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.437 -0.949 . . . . 23.55 108.437 179.378 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ILE . . . . . 0.589 HD13 ' HB2' ' A' ' 19' ' ' ALA . 66.9 mt -63.8 -53.54 43.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.584 -0.735 . . . . 27.77 109.905 179.776 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.21 -34.34 66.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.63 -0.714 . . . . 22.24 111.793 -179.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 34.0 t-80 -75.26 -39.47 59.78 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.395 0.517 . . . . 26.45 112.395 -179.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 34.0 tp10 -64.09 -32.79 74.47 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 108.631 -0.877 . . . . 45.5 108.631 179.519 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' LEU . . . . . 0.725 HD11 HG21 ' A' ' 87' ' ' VAL . 0.6 OUTLIER -69.8 -40.29 76.04 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 108.191 -1.04 . . . . 36.05 108.191 179.26 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -67.48 -47.1 71.05 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.821 -0.807 . . . . 37.0 108.821 179.133 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' LYS . . . . . 0.612 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 56.5 tttm -57.11 -48.76 77.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.644 -0.707 . . . . 60.91 110.57 179.838 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 10.8 t -66.29 -35.21 74.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 112.236 0.458 . . . . 44.64 112.236 179.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.72 -33.03 74.92 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.96 0.356 . . . . 55.27 111.96 -179.645 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 -82.98 -15.82 49.72 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.388 0.514 . . . . 68.4 112.388 -179.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLU . . . . . 0.612 ' HG3' ' O ' ' A' ' 57' ' ' LYS . 76.8 mt-10 -80.38 -48.9 12.23 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 107.633 -1.247 . . . . 67.19 107.633 178.725 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -74.6 -6.97 51.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.287 -0.87 . . . . 57.6 110.325 -179.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 71.0 43.12 58.22 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.8 -0.714 . . . . 49.59 113.691 179.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ILE . . . . . 0.642 HD13 HD21 ' A' ' 6' ' ' LEU . 47.1 mt -103.66 129.91 54.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 N-CA-C 109.681 -0.489 . . . . 41.05 109.681 179.815 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -77.02 124.22 27.48 Favored 'General case' 0 C--O 1.185 -2.303 0 O-C-N 121.663 -0.648 . . . . 42.7 112.304 -176.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.0 mt -86.14 111.21 20.89 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 N-CA-C 106.647 -1.612 . . . . 40.16 106.647 179.318 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 70.1 mttt -74.86 -39.42 61.57 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.892 -0.595 . . . . 56.8 112.534 -179.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ARG . . . . . 0.635 ' HB2' ' HB2' ' A' ' 81' ' ' ASP . 68.5 mtm180 -144.02 154.85 43.69 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 113.281 0.845 . . . . 38.23 113.281 179.782 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LEU . . . . . 0.515 ' HA ' ' O ' ' A' ' 79' ' ' LEU . 10.0 tt -159.85 106.84 1.65 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 104.74 -2.319 . . . . 35.99 104.74 178.497 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 68.3 mt-10 -133.3 145.94 50.91 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 113.197 0.814 . . . . 53.94 113.197 -177.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 79.7 17.12 76.07 Favored Glycine 0 N--CA 1.451 -0.349 0 CA-C-N 115.604 -0.725 . . . . 32.63 114.905 179.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' TYR . . . . . 0.41 ' HB2' HD21 ' A' ' 69' ' ' LEU . 68.3 t80 -65.07 -51.56 60.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 117.224 0.512 . . . . 34.16 112.035 -179.675 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -54.17 -53.72 49.52 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.08 0.4 . . . . 62.81 112.08 -179.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -63.67 -31.72 72.98 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.56 0.578 . . . . 39.7 112.56 -179.485 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . 54.62 40.51 31.92 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 114.054 1.131 . . . . 26.87 114.054 179.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -110.22 -38.03 5.39 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 106.877 -1.527 . . . . 24.06 106.877 178.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' TRP . . . . . 0.779 ' CH2' ' HG ' ' B' ' 103' ' ' LEU . 5.9 t90 -153.43 93.66 1.72 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.182 -1.044 . . . . 22.11 108.182 179.422 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' VAL . . . . . 0.457 HG12 HD11 ' A' ' 80' ' ' ILE . 41.1 t -95.32 127.12 47.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.875 -0.602 . . . . 13.38 110.416 -179.918 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LEU . . . . . 0.515 ' O ' ' HA ' ' A' ' 69' ' ' LEU . 7.5 tt -112.04 121.6 45.42 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.994 -0.743 . . . . 18.01 108.994 179.726 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ILE . . . . . 0.708 HD12 ' N ' ' A' ' 80' ' ' ILE . 2.4 mp -115.81 105.68 18.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 108.412 -0.958 . . . . 26.26 108.412 179.72 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ASP . . . . . 0.635 ' HB2' ' HB2' ' A' ' 68' ' ' ARG . 21.5 t0 -86.75 110.06 19.66 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.433 -0.349 . . . . 33.04 110.315 -179.643 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' LEU . . . . . 0.412 HD11 HD22 ' A' ' 55' ' ' LEU . 84.4 mt -104.22 10.47 35.69 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.411 -0.359 . . . . 32.28 111.167 179.932 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 100.74 -106.94 3.19 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.646 -0.788 . . . . 36.61 112.623 -179.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ASP . . . . . 0.68 ' OD2' ' HB2' ' A' ' 2' ' ' SER . 64.9 m-20 -62.25 -21.62 65.33 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.924 0.392 . . . . 52.65 110.58 179.815 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' VAL . . . . . 0.588 HG22 ' HB2' ' A' ' 36' ' ' PHE . 24.7 t -125.78 137.35 57.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.933 -0.576 . . . . 30.07 109.852 179.222 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 71.1 t -125.46 120.0 56.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 107.533 -1.284 . . . . 20.61 107.533 179.162 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' VAL . . . . . 0.725 HG21 HD11 ' A' ' 55' ' ' LEU . 21.9 t -98.07 137.9 24.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 112.709 0.633 . . . . 15.32 112.709 -179.154 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' HIS . . . . . 0.417 ' HB3' ' CE1' ' A' ' 90' ' ' PHE . 55.4 m-70 -120.24 110.68 16.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.473 -0.785 . . . . 22.68 109.073 178.883 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 89' ' ' VAL . . . . . 0.536 HG12 HG13 ' A' ' 48' ' ' VAL . 53.2 t -106.3 104.27 16.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 109.44 -0.578 . . . . 16.01 109.44 179.898 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 90' ' ' PHE . . . . . 0.524 ' CD2' ' HB2' ' A' ' 97' ' ' TYR . 66.1 m-85 -95.33 162.34 13.71 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 113.256 0.835 . . . . 17.55 113.256 -179.678 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 24.5 t-80 -94.36 132.82 38.58 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 101.123 -3.658 . . . . 25.58 101.123 176.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 6.4 pttm -43.59 -24.75 0.13 Allowed 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 114.256 1.206 . . . . 32.35 114.256 -178.205 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -95.89 1.96 53.32 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 115.017 1.488 . . . . 44.85 115.017 -179.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLU . . . . . 0.521 ' OE2' ' HA ' ' A' ' 94' ' ' GLU . 24.2 tp10 -71.8 128.27 35.21 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.928 -0.309 . . . . 68.02 110.256 179.932 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ARG . . . . . 0.714 ' NH2' ' H ' ' B' ' 95' ' ' ARG . 61.4 mtm180 -69.73 -41.86 74.75 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 115.116 1.524 . . . . 98.95 115.116 -179.134 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.17 -14.2 16.11 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.641 -0.503 . . . . 63.82 109.641 179.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' TYR . . . . . 0.524 ' HB2' ' CD2' ' A' ' 90' ' ' PHE . 26.6 t80 -77.79 -19.5 54.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.538 -0.755 . . . . 63.86 111.548 -179.755 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -106.33 -2.08 22.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.172 0.51 . . . . 76.36 110.712 179.521 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ASN . . . . . 0.448 ' C ' ' H ' ' A' ' 101' ' ' GLU . 87.1 m-20 -114.63 9.09 16.45 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 107.456 -1.313 . . . . 73.86 107.456 178.732 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 100' ' ' LEU . . . . . 0.739 ' HG ' ' CZ3' ' A' ' 104' ' ' TRP . 3.1 tp -66.66 -0.49 2.92 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 108.386 -0.968 . . . . 78.36 108.386 179.913 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' GLU . . . . . 0.448 ' H ' ' C ' ' A' ' 99' ' ' ASN . 0.0 OUTLIER -76.41 -52.04 10.64 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 107.662 -1.236 . . . . 113.3 107.662 179.514 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 102' ' ' LYS . . . . . 0.654 ' HB3' ' CD1' ' B' ' 79' ' ' LEU . 59.1 mttm -47.53 -56.1 7.79 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 107.438 -1.319 . . . . 78.68 107.438 179.046 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' LEU . . . . . 0.543 HD12 HD12 ' A' ' 100' ' ' LEU . 15.1 mt -66.25 153.11 43.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.411 -0.813 . . . . 74.76 109.038 178.867 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' TRP . . . . . 0.739 ' CZ3' ' HG ' ' A' ' 100' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.325 -0.482 0 C-N-CA 120.067 -0.653 . . . . 64.65 109.928 177.853 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo . . . . . 0 CA--C 1.527 0.156 0 CA-C-O 120.76 0.233 . . . . 44.84 111.72 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 19.4 p -80.3 174.96 11.08 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 113.02 0.748 . . . . 45.12 113.02 -179.019 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 21.4 t -126.32 120.78 57.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.483 -0.781 . . . . 43.04 110.474 179.801 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.4 83.97 0.4 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.052 -0.522 . . . . 44.87 109.807 179.967 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 112' ' ' LEU . . . . . 0.425 ' O ' ' N ' ' A' ' 114' ' ' GLY . 66.9 mt -42.35 -55.97 3.16 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 113.339 0.866 . . . . 50.37 113.339 -179.515 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -68.81 67.42 0.14 Allowed 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 107.9 -1.148 . . . . 64.03 107.9 179.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' GLY . . . . . 0.425 ' N ' ' O ' ' A' ' 112' ' ' LEU . . . . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.56 -1.133 . . . . 60.98 112.37 -179.607 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 3' ' ' ASN . . . . . 0.544 ' CG ' ' H ' ' B' ' 4' ' ' GLN . 56.0 t30 . . . . . 0 N--CA 1.493 1.678 0 N-CA-C 109.511 -0.552 . . . . 80.72 109.511 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' GLN . . . . . 0.544 ' H ' ' CG ' ' B' ' 3' ' ' ASN . 57.8 mt-30 -60.19 -11.12 5.45 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 113.09 0.774 . . . . 85.19 113.09 -179.761 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 5' ' ' GLU . . . . . 0.536 ' OE2' ' HB3' ' B' ' 3' ' ' ASN . 24.3 mp0 -68.11 -47.57 67.83 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 111.808 0.299 . . . . 98.0 111.808 179.732 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.2 -41.76 48.43 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 107.204 -1.406 . . . . 58.16 107.204 179.24 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 7' ' ' LEU . . . . . 0.65 ' O ' HG23 ' B' ' 11' ' ' VAL . 23.9 tp -58.06 -47.54 82.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.295 -0.866 . . . . 52.32 112.081 -179.612 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -67.69 -28.3 67.56 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.005 -0.739 . . . . 93.9 109.005 178.973 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 19.7 tp -68.49 -39.95 81.12 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 108.496 -0.928 . . . . 53.52 108.496 179.85 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.21 -38.83 55.93 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.65 -0.705 . . . . 44.56 111.352 179.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' VAL . . . . . 0.65 HG23 ' O ' ' B' ' 7' ' ' LEU . 97.2 t -61.69 -41.55 90.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.438 -0.347 . . . . 41.37 111.033 179.975 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 53.8 m-20 -66.59 -54.78 19.81 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.432 -0.349 . . . . 53.94 110.756 179.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -47.64 -54.13 12.82 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.25 -0.648 . . . . 44.8 109.25 179.51 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' VAL . . . . . 0.644 HG13 ' CB ' ' B' ' 19' ' ' ALA . 2.1 t -61.24 -28.4 43.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.49 -0.777 . . . . 40.78 111.391 179.329 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 15' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -78.92 -30.7 44.89 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 113.356 0.873 . . . . 52.59 113.356 -179.516 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -64.53 -28.77 69.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.835 0.35 . . . . 61.41 110.95 179.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' LYS . . . . . 0.765 ' HE2' ' HA ' ' B' ' 17' ' ' LYS . 10.7 mmpt? -94.24 6.74 47.71 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 113.959 1.096 . . . . 48.0 113.959 -179.266 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 28.5 mmtp 72.71 30.11 1.86 Allowed 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 115.991 1.848 . . . . 47.68 115.991 178.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' ALA . . . . . 0.644 ' CB ' HG13 ' B' ' 14' ' ' VAL . . . -62.33 132.93 54.25 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.66 -0.867 . . . . 36.76 108.66 179.359 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -96.86 154.12 17.48 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 115.246 1.572 . . . . 54.66 115.246 -178.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' GLN . . . . . . . . . . . . . 6.9 mt-30 53.64 50.22 17.64 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.107 -0.951 . . . . 50.28 113.453 179.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' VAL . . . . . 0.408 HG13 HD11 ' B' ' 38' ' ' LEU . 43.0 t -68.3 125.65 26.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.985 0.422 . . . . 35.47 110.682 179.614 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 23' ' ' VAL . . . . . 0.442 ' O ' HD12 ' B' ' 38' ' ' LEU . 56.1 t -136.65 131.64 47.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.872 -0.604 . . . . 34.41 110.823 179.824 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 24' ' ' ALA . . . . . 0.883 ' HB3' ' HB ' ' B' ' 110' ' ' VAL . . . -104.21 146.41 28.81 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 107.748 -1.205 . . . . 36.13 107.748 179.062 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 86.6 mt -126.82 122.62 35.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.203 -0.453 . . . . 38.84 110.545 -179.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' ASN . . . . . 0.511 ' OD1' ' HB3' ' B' ' 28' ' ' LYS . 10.3 t-20 -77.68 109.03 11.31 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 107.43 -1.322 . . . . 47.72 107.43 179.463 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 27' ' ' MSE . . . . . . . . . . . . . 93.0 mmm -89.7 8.67 30.44 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 113.109 0.781 . . . . 60.18 113.109 -179.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' LYS . . . . . 0.511 ' HB3' ' OD1' ' B' ' 26' ' ' ASN . 0.0 OUTLIER -60.61 117.64 5.57 Favored 'General case' 0 C--O 1.195 -1.808 0 O-C-N 121.899 -0.501 . . . . 51.12 111.502 175.793 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 29' ' ' GLY . . . . . 0.479 ' C ' HD12 ' A' ' 32' ' ' LEU . . . 87.96 9.83 70.3 Favored Glycine 0 C--N 1.312 -0.766 0 C-N-CA 119.591 -1.29 . . . . 59.41 111.34 -178.637 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 11.0 mm -128.88 -50.43 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.869 0.366 . . . . 60.42 111.199 -179.475 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' SER . . . . . 0.56 ' O ' HD23 ' B' ' 32' ' ' LEU . 12.1 t -121.62 178.0 5.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.093 -0.503 . . . . 61.83 110.937 -179.582 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 32' ' ' LEU . . . . . 0.905 HD12 ' C ' ' A' ' 29' ' ' GLY . 56.3 mt . . . . . 0 C--N 1.328 -0.35 0 N-CA-C 112.649 0.611 . . . . 68.85 112.649 -179.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' ASP . . . . . 0.724 ' HB2' ' O ' ' B' ' 84' ' ' ASP . 1.7 m-20 . . . . . 0 C--O 1.201 -1.489 0 N-CA-C 115.419 1.637 . . . . 60.21 115.419 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' PHE . . . . . 0.674 ' HB2' HG22 ' B' ' 85' ' ' VAL . 55.0 m-85 -135.35 127.61 30.14 Favored 'General case' 0 C--O 1.172 -2.985 0 CA-C-N 116.053 -0.521 . . . . 43.17 111.56 -173.127 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 37' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 -107.17 132.29 53.2 Favored 'General case' 0 C--O 1.155 -3.885 0 N-CA-C 108.759 -0.83 . . . . 37.63 108.759 170.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' LEU . . . . . 0.442 HD12 ' O ' ' B' ' 23' ' ' VAL . 12.6 tp -121.19 131.65 54.36 Favored 'General case' 0 C--O 1.174 -2.902 0 C-N-CA 116.706 -1.998 . . . . 38.54 112.359 -178.053 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 39' ' ' ILE . . . . . 0.444 HD13 HD23 ' B' ' 100' ' ' LEU . 4.3 mt -122.1 147.19 26.29 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.38 0 CA-C-N 113.3 -1.773 . . . . 39.65 112.953 -177.119 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 40' ' ' CYS . . . . . . . . . . . . . 31.9 p -170.64 175.84 4.49 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 105.944 -1.873 . . . . 35.68 105.944 179.763 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' HIS . . . . . 0.549 ' CD2' ' C ' ' B' ' 41' ' ' HIS . 3.0 p-80 -149.62 163.03 39.01 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 113.119 0.785 . . . . 58.09 113.119 -179.279 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . -115.46 161.91 12.68 Favored Glycine 0 N--CA 1.449 -0.498 0 N-CA-C 106.947 -2.461 . . . . 30.46 106.947 178.519 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' ASN . . . . . . . . . . . . . 22.0 m120 -94.18 -1.55 53.97 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 113.018 0.747 . . . . 33.46 113.018 -179.028 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 24.9 p -157.13 161.2 39.38 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 107.477 -1.305 . . . . 26.61 107.477 179.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 88.7 mt-10 -64.56 -25.14 67.85 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.582 -0.447 . . . . 38.58 111.166 -179.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 76.8 tttt -74.34 -37.25 63.6 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.558 -0.534 . . . . 31.1 109.558 178.815 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -73.7 -36.02 65.22 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.311 -0.404 . . . . 38.21 110.285 -179.894 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' VAL . . . . . 0.455 HG13 HG12 ' B' ' 89' ' ' VAL . 45.9 t -63.89 -41.19 91.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 N-CA-C 110.111 -0.329 . . . . 25.94 110.111 179.924 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 49' ' ' GLN . . . . . 0.434 ' HG3' ' HB2' ' B' ' 75' ' ' ALA . 82.9 mt-30 -72.18 -31.4 65.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.251 -0.431 . . . . 33.49 111.173 179.569 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.78 -42.3 97.8 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.371 -0.974 . . . . 26.27 108.371 179.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' ILE . . . . . 0.559 HD13 ' HB2' ' B' ' 19' ' ' ALA . 88.3 mt -65.5 -51.93 57.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.456 -0.793 . . . . 29.77 110.631 -179.967 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.49 -36.93 69.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.879 -0.601 . . . . 22.62 111.108 179.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 21.6 t-80 -72.42 -40.53 67.07 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.559 0.578 . . . . 27.9 112.559 -179.129 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 32.6 tp10 -62.21 -32.98 73.71 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.777 -0.823 . . . . 52.63 108.777 179.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' LEU . . . . . 0.706 HD11 HG21 ' B' ' 87' ' ' VAL . 0.5 OUTLIER -70.5 -41.67 72.34 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.144 -1.058 . . . . 38.1 108.144 179.326 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 56' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -65.14 -48.29 74.06 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 108.838 -0.801 . . . . 39.22 108.838 179.143 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' LYS . . . . . 0.612 ' O ' ' HG3' ' B' ' 61' ' ' GLU . 56.8 tttm -57.46 -48.34 79.44 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.542 -0.753 . . . . 68.34 110.538 -179.975 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 15.8 t -65.94 -34.58 71.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 N-CA-C 112.341 0.497 . . . . 46.21 112.341 179.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.12 -32.87 74.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.375 -0.375 . . . . 57.29 111.829 -179.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 81.6 mt-30 -82.67 -15.03 53.55 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.37 0.507 . . . . 77.49 112.37 -179.429 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' GLU . . . . . 0.612 ' HG3' ' O ' ' B' ' 57' ' ' LYS . 78.7 mt-10 -81.2 -48.85 11.52 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 107.598 -1.26 . . . . 63.16 107.598 178.866 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 62' ' ' GLN . . . . . 0.843 ' HB3' HD12 ' B' ' 64' ' ' ILE . 5.0 tp60 -74.34 -7.66 53.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.383 -0.826 . . . . 75.91 110.403 -179.534 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . 71.81 40.0 58.75 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.832 -0.699 . . . . 54.29 113.602 179.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' ILE . . . . . 0.843 HD12 ' HB3' ' B' ' 62' ' ' GLN . 3.4 mt -106.39 142.59 18.95 Favored 'Isoleucine or valine' 0 C--O 1.175 -2.827 0 O-C-N 120.428 -1.63 . . . . 50.33 108.636 179.301 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -93.22 123.76 36.73 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 114.589 1.329 . . . . 46.33 114.589 -167.811 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 66' ' ' ILE . . . . . . . . . . . . . 27.8 mt -84.09 113.42 22.9 Favored 'Isoleucine or valine' 0 N--CA 1.401 -2.925 0 N-CA-C 104.379 -2.452 . . . . 45.29 104.379 -174.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -75.91 -39.22 56.71 Favored 'General case' 0 C--N 1.295 -1.775 0 CA-C-N 114.949 -1.023 . . . . 67.52 112.741 177.209 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' ARG . . . . . 0.675 ' HB2' ' HB2' ' B' ' 81' ' ' ASP . 67.4 mtm180 -144.31 155.53 43.86 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 113.254 0.835 . . . . 40.76 113.254 179.718 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 69' ' ' LEU . . . . . 0.581 ' HA ' ' O ' ' B' ' 79' ' ' LEU . 10.3 tt -160.71 107.22 1.49 Allowed 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 104.636 -2.357 . . . . 35.72 104.636 178.502 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -133.81 146.01 50.27 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.997 0.74 . . . . 44.45 112.997 -178.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . 79.92 18.86 71.53 Favored Glycine 0 N--CA 1.451 -0.309 0 N-CA-C 114.942 0.737 . . . . 34.1 114.942 179.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' TYR . . . . . 0.431 ' HB2' HD21 ' B' ' 69' ' ' LEU . 73.1 t80 -67.23 -49.63 63.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 117.097 0.448 . . . . 37.0 111.929 -179.565 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 73' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -55.02 -53.09 60.24 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.194 0.442 . . . . 64.36 112.194 179.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -64.9 -31.41 72.63 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.612 0.597 . . . . 58.98 112.612 -179.5 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 75' ' ' ALA . . . . . 0.434 ' HB2' ' HG3' ' B' ' 49' ' ' GLN . . . 54.23 39.86 31.18 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 114.216 1.191 . . . . 30.46 114.216 179.206 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 76' ' ' ARG . . . . . . . . . . . . . 24.2 mmm180 -110.22 -35.12 6.18 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 107.095 -1.446 . . . . 37.13 107.095 178.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' TRP . . . . . . . . . . . . . 5.9 t90 -156.18 92.35 1.33 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.993 -1.003 . . . . 33.27 108.355 179.315 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' VAL . . . . . 0.497 HG12 HD11 ' B' ' 80' ' ' ILE . 23.6 t -94.73 128.88 45.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.859 -0.61 . . . . 15.74 110.526 -179.852 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 79' ' ' LEU . . . . . 0.733 ' C ' HD12 ' B' ' 80' ' ' ILE . 7.2 tt -113.01 124.01 51.64 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.204 -0.665 . . . . 23.61 109.204 179.664 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 80' ' ' ILE . . . . . 0.88 ' N ' HD12 ' B' ' 80' ' ' ILE . 0.7 OUTLIER -118.7 105.21 17.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 108.56 -0.904 . . . . 27.19 108.56 179.617 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 81' ' ' ASP . . . . . 0.675 ' HB2' ' HB2' ' B' ' 68' ' ' ARG . 21.7 t0 -85.12 109.35 18.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 41.45 110.238 -179.46 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 82' ' ' LEU . . . . . 0.49 HD11 HD22 ' B' ' 55' ' ' LEU . 80.7 mt -102.97 10.05 38.39 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.557 -0.292 . . . . 35.25 111.096 -179.992 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 99.97 -105.7 3.04 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.761 -0.733 . . . . 40.72 112.658 179.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' ASP . . . . . 0.724 ' O ' ' HB2' ' B' ' 35' ' ' ASP . 61.8 m-20 -63.51 -20.59 65.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.963 0.411 . . . . 63.55 110.431 179.991 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 85' ' ' VAL . . . . . 0.674 HG22 ' HB2' ' B' ' 36' ' ' PHE . 10.3 t -126.87 136.35 61.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.799 -0.637 . . . . 35.3 109.969 179.23 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 79.7 t -124.66 121.22 60.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 107.487 -1.301 . . . . 22.47 107.487 179.086 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' VAL . . . . . 0.706 HG21 HD11 ' B' ' 55' ' ' LEU . 9.4 t -100.37 136.59 31.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 N-CA-C 112.709 0.633 . . . . 18.82 112.709 -179.046 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 88' ' ' HIS . . . . . 0.44 ' HB3' ' CE1' ' B' ' 90' ' ' PHE . 59.1 m-70 -118.57 109.83 16.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.554 -0.748 . . . . 33.91 109.09 178.875 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 89' ' ' VAL . . . . . 0.455 HG12 HG13 ' B' ' 48' ' ' VAL . 44.3 t -105.0 104.58 17.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 109.382 -0.599 . . . . 19.64 109.382 179.984 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 90' ' ' PHE . . . . . 0.535 ' CD2' ' HB2' ' B' ' 97' ' ' TYR . 72.0 m-85 -96.32 162.77 13.36 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 113.353 0.871 . . . . 21.84 113.353 -179.767 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 91' ' ' HIS . . . . . . . . . . . . . 26.0 t-80 -94.39 134.43 36.9 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 101.143 -3.651 . . . . 30.47 101.143 177.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 9.1 pttm -45.37 -22.48 0.14 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 114.218 1.192 . . . . 54.22 114.218 -178.118 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -98.61 4.46 48.04 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 114.886 1.439 . . . . 49.93 114.886 -179.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' GLU . . . . . 0.516 ' OE2' ' HA ' ' B' ' 94' ' ' GLU . 24.0 tp10 -73.89 129.14 37.29 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.771 -0.372 . . . . 88.35 110.078 179.887 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 95' ' ' ARG . . . . . 0.714 ' H ' ' NH2' ' A' ' 95' ' ' ARG . 61.8 mtm180 -70.22 -42.5 72.22 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 115.072 1.508 . . . . 118.92 115.072 -179.107 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.34 -15.67 17.7 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.608 -0.516 . . . . 70.54 109.608 179.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' TYR . . . . . 0.535 ' HB2' ' CD2' ' B' ' 90' ' ' PHE . 21.8 t80 -77.13 -18.82 57.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.544 -0.753 . . . . 74.35 111.623 -179.835 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 98' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -106.09 -3.65 21.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.148 0.499 . . . . 113.43 110.639 179.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' ASN . . . . . 0.471 ' C ' ' H ' ' B' ' 101' ' ' GLU . 77.1 m-20 -113.38 8.99 18.12 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 107.664 -1.236 . . . . 85.91 107.664 178.565 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 100' ' ' LEU . . . . . 0.699 HD12 HD12 ' B' ' 103' ' ' LEU . 3.5 tp -67.01 1.25 2.04 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.543 -0.91 . . . . 85.43 108.543 179.844 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 101' ' ' GLU . . . . . 0.471 ' H ' ' C ' ' B' ' 99' ' ' ASN . 0.0 OUTLIER -77.44 -52.64 8.76 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 107.554 -1.276 . . . . 117.28 107.554 179.388 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 102' ' ' LYS . . . . . 0.625 ' HE3' ' HB3' ' A' ' 77' ' ' TRP . 61.6 mttm -46.93 -57.14 5.27 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 107.332 -1.359 . . . . 80.8 107.332 179.084 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 103' ' ' LEU . . . . . 0.779 ' HG ' ' CH2' ' A' ' 77' ' ' TRP . 33.9 mt -57.69 125.33 22.48 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 105.515 -2.031 . . . . 80.5 105.515 178.46 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 104' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.331 -0.236 0 CA-C-N 115.564 -0.744 . . . . 76.68 110.95 -179.293 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 108' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo . . . . . 0 N--CA 1.466 -0.137 0 CA-C-O 120.853 0.272 . . . . 79.18 112.134 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 51.2 p -76.17 122.52 24.45 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 113.076 0.769 . . . . 77.34 113.076 -179.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' VAL . . . . . 0.883 ' HB ' ' HB3' ' B' ' 24' ' ' ALA . 83.7 t -73.53 144.81 12.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 108.843 -0.799 . . . . 74.02 108.843 179.344 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 111' ' ' GLU . . . . . 0.417 ' O ' HD23 ' B' ' 112' ' ' LEU . 10.3 tp10 -85.14 151.46 24.1 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.91 -0.404 . . . . 84.75 109.91 -179.709 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 112' ' ' LEU . . . . . 0.417 HD23 ' O ' ' B' ' 111' ' ' GLU . 23.8 mt . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.164 -0.922 . . . . 82.0 111.612 -179.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' ' MN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 127' ' ' ' MN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ' MN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 126' ' ' ' MN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 127' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 3002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 3004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 3005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 3006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 3008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 3020 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 3021 ' ' HOH . . . . . 0.489 ' O ' HD23 ' A' ' 103' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 3024 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 3025 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 3026 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 3029 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 3030 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 3034 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 3035 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 3040 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 3047 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 3050 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 3052 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 3054 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 3055 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 3056 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 3057 ' ' HOH . . . . . 0.444 ' O ' ' OE2' ' A' ' 94' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 3007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 3012 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 3015 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 3016 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 3017 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 3018 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 3023 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 3031 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 3036 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 3037 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 3038 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 3042 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 3045 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 3046 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 3048 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 3049 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 3053 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' SER . . . . . 0.704 ' OG ' ' N ' ' A' ' 3' ' ' ASN . 10.8 t . . . . . 0 N--CA 1.491 1.625 0 CA-C-O 121.058 0.456 . . . . 76.129999999999995 110.523 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ASN . . . . . 0.704 ' N ' ' OG ' ' A' ' 2' ' ' SER . 2.5 t30 -140.09 -168.61 2.56 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-N 115.779 -0.646 . . . . 84.359999999999999 112.738 -179.355 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 19.4 mt-30 -64.71 -9.07 17.33 Favored 'General case' 0 C--N 1.326 -0.426 0 N-CA-C 113.668 0.988 . . . . 78.620000000000005 113.668 -179.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.507 ' OE2' ' HB3' ' A' ' 3' ' ' ASN . 28.3 mp0 -67.5 -44.46 78.39 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 120.807 -0.357 . . . . 97.370000000000005 111.951 179.855 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.642 HD21 HD13 ' A' ' 64' ' ' ILE . 0.1 OUTLIER -78.33 -43.03 28.91 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 107.057 -1.46 . . . . 52.810000000000002 107.057 179.238 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.591 ' O ' HG23 ' A' ' 11' ' ' VAL . 21.7 tp -57.51 -47.45 81.93 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 115.392 -0.822 . . . . 48.829999999999998 112.173 -179.667 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 10.1 mt-30 -67.09 -29.12 68.8 Favored 'General case' 0 CA--C 1.518 -0.276 0 N-CA-C 108.855 -0.794 . . . . 82.219999999999999 108.855 179.043 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.409 HD23 ' CD1' ' A' ' 64' ' ' ILE . 18.4 tp -67.69 -41.51 83.52 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 108.519 -0.919 . . . . 49.439999999999998 108.519 179.931 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -74.74 -39.22 61.97 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 115.792 -0.64 . . . . 41.829999999999998 111.323 179.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.591 HG23 ' O ' ' A' ' 7' ' ' LEU . 82.2 t -61.05 -42.14 91.98 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.257 0 CA-C-N 116.412 -0.358 . . . . 38.420000000000002 111.069 179.987 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 3.7 m120 -65.91 -54.4 26.98 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.507 -0.315 . . . . 43.100000000000001 110.749 179.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -48.1 -55.02 11.27 Favored 'General case' 0 C--N 1.329 -0.316 0 N-CA-C 109.139 -0.689 . . . . 40.450000000000003 109.139 179.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.672 HG13 ' HB3' ' A' ' 19' ' ' ALA . 2.1 t -60.27 -29.27 43.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 CA-C-N 115.579 -0.737 . . . . 38.07 111.211 179.498 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -77.74 -31.4 52.1 Favored 'General case' 0 C--N 1.33 -0.265 0 N-CA-C 113.546 0.943 . . . . 48.890000000000001 113.546 -179.525 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 98.5 m-20 -63.86 -28.8 70.09 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-O 120.739 0.304 . . . . 65.769999999999996 110.782 179.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.687 ' HE2' ' HA ' ' A' ' 17' ' ' LYS . 10.3 mmpt? -93.74 6.08 49.54 Favored 'General case' 0 C--N 1.329 -0.306 0 N-CA-C 113.935 1.087 . . . . 41.890000000000001 113.935 -179.161 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.406 ' HB2' ' O ' ' A' ' 17' ' ' LYS . 25.4 mmtp 73.06 28.46 1.91 Allowed 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 116.027 1.862 . . . . 44.390000000000001 116.027 178.687 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ALA . . . . . 0.672 ' HB3' HG13 ' A' ' 14' ' ' VAL . . . -61.84 133.75 55.86 Favored 'General case' 0 C--N 1.329 -0.293 0 N-CA-C 108.696 -0.853 . . . . 32.090000000000003 108.696 179.471 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLU . . . . . . . . . . . . . 91.5 mt-10 -97.66 155.55 16.94 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 115.112 1.523 . . . . 33.119999999999997 115.112 -178.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 53.9 49.26 19.42 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.047 -0.979 . . . . 27.059999999999999 113.52 179.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 55.3 t -67.38 124.86 23.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.093 -0.503 . . . . 26.449999999999999 110.552 179.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 62.3 t -136.89 132.33 47.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 115.913 -0.585 . . . . 27.84 110.875 179.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -104.41 144.62 31.41 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 107.978 -1.119 . . . . 30.399999999999999 107.978 179.003 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.509 ' O ' ' HG2' ' A' ' 27' ' ' MSE . 88.2 mt -125.24 123.27 39.17 Favored 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 120.981 0.42 . . . . 33.810000000000002 110.625 179.999 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.858 ' OD1' ' CB ' ' A' ' 28' ' ' LYS . 13.3 t-20 -76.76 105.36 7.78 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 107.461 -1.311 . . . . 40.759999999999998 107.461 179.66 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' MSE . . . . . 1.331 'SE ' ' CG ' ' A' ' 27' ' ' MSE . 7.3 mmm -99.12 35.84 1.83 Allowed 'General case' 0 C--O 1.177 -2.726 0 CA-C-O 123.624 1.678 . . . . 44.229999999999997 106.886 -164.977 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LYS . . . . . 0.858 ' CB ' ' OD1' ' A' ' 26' ' ' ASN . 88.4 tttt -105.83 104.19 13.85 Favored 'General case' 0 N--CA 1.403 -2.802 0 N-CA-C 103.629 -2.73 . . . . 50.149999999999999 103.629 -154.216 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLY . . . . . 0.905 ' C ' HD12 ' B' ' 32' ' ' LEU . . . 107.15 -7.8 37.94 Favored Glycine 0 C--N 1.316 -0.574 0 CA-C-O 125.193 2.552 . . . . 58.219999999999999 109.803 -170.099 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 5.0 mm -116.04 -50.24 4.65 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.489 0 CA-C-N 111.831 -2.185 . . . . 59.93 111.812 -170.045 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' SER . . . . . 0.611 ' HB2' ' HE3' ' A' ' 27' ' ' MSE . 36.9 t -118.97 170.55 8.94 Favored 'General case' 0 N--CA 1.449 -0.478 0 CA-C-N 116.133 -0.485 . . . . 62.259999999999998 111.335 179.602 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.748 HD21 HD21 ' B' ' 32' ' ' LEU . 27.7 mt . . . . . 0 C--N 1.33 -0.279 0 CA-C-N 115.025 -0.989 . . . . 56.490000000000002 110.476 -179.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 . . . . . 0 CA--C 1.524 -0.052 0 N-CA-C 109.804 -0.443 . . . . 56.200000000000003 109.804 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' PHE . . . . . 0.588 ' HB2' HG22 ' A' ' 85' ' ' VAL . 49.9 m-85 -134.61 143.32 47.25 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-N 115.909 -0.587 . . . . 30.600000000000001 112.29 179.79 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.471 ' CE2' ' HE2' ' A' ' 27' ' ' MSE . 3.1 m-30 -125.43 116.32 21.66 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 104.66 -2.348 . . . . 20.77 104.66 178.306 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 42.7 tp -100.87 122.56 43.66 Favored 'General case' 0 C--N 1.33 -0.246 0 C-N-CA 121.013 -0.275 . . . . 22.0 111.293 -179.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ILE . . . . . . . . . . . . . 8.4 mt -114.69 144.71 21.67 Favored 'Isoleucine or valine' 0 C--O 1.234 0.255 0 N-CA-C 114.43 1.27 . . . . 29.43 114.43 -179.583 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 29.2 p -169.73 178.13 4.21 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 107.718 -1.216 . . . . 28.879999999999999 107.718 179.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.644 ' HD2' ' OH ' ' A' ' 97' ' ' TYR . 3.4 p80 -150.77 161.68 42.18 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 113.224 0.824 . . . . 32.759999999999998 113.224 -179.461 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -114.61 161.4 12.76 Favored Glycine 0 N--CA 1.451 -0.303 0 N-CA-C 106.937 -2.465 . . . . 25.489999999999998 106.937 178.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 77.6 m-20 -93.74 -2.24 54.02 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 113.09 0.774 . . . . 21.989999999999998 113.09 -179.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 59.6 p -156.49 162.05 39.99 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 107.356 -1.35 . . . . 20.039999999999999 107.356 179.353 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 88.6 mt-10 -65.48 -25.12 67.35 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.536 -0.466 . . . . 21.52 111.115 -179.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 80.4 tttt -74.74 -36.8 62.63 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 109.467 -0.568 . . . . 35.68 109.467 178.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.494 ' O ' HG13 ' A' ' 51' ' ' ILE . 9.6 tt0 -73.59 -35.55 65.43 Favored 'General case' 0 C--N 1.33 -0.262 0 C-N-CA 120.741 -0.383 . . . . 25.609999999999999 110.252 -179.767 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.536 HG13 HG12 ' A' ' 89' ' ' VAL . 53.3 t -64.24 -41.35 92.13 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.344 -0.389 . . . . 22.260000000000002 110.143 179.681 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 21.2 mt-30 -71.93 -31.45 66.36 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 116.255 -0.43 . . . . 29.300000000000001 111.216 179.516 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.5 -43.5 97.04 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 108.437 -0.949 . . . . 23.550000000000001 108.437 179.378 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.589 HD13 ' HB2' ' A' ' 19' ' ' ALA . 66.9 mt -63.8 -53.54 43.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.345 0 CA-C-N 115.584 -0.735 . . . . 27.77 109.905 179.776 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.21 -34.34 66.19 Favored 'General case' 0 C--N 1.327 -0.378 0 CA-C-N 115.63 -0.714 . . . . 22.239999999999998 111.793 -179.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' HIS . . . . . . . . . . . . . 34.0 t-80 -75.26 -39.47 59.78 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.395 0.517 . . . . 26.449999999999999 112.395 -179.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 34.0 tp10 -64.09 -32.79 74.47 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 108.631 -0.877 . . . . 45.5 108.631 179.519 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.725 HD11 HG21 ' A' ' 87' ' ' VAL . 0.6 OUTLIER -69.8 -40.29 76.04 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 108.191 -1.04 . . . . 36.049999999999997 108.191 179.26 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 81.8 tttt -67.48 -47.1 71.05 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.821 -0.807 . . . . 37.0 108.821 179.133 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.612 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 56.5 tttm -57.11 -48.76 77.84 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.644 -0.707 . . . . 60.909999999999997 110.57 179.838 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 10.8 t -66.29 -35.21 74.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 N-CA-C 112.236 0.458 . . . . 44.640000000000001 112.236 179.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ALA . . . . . . . . . . . . . . . -65.72 -33.03 74.92 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 111.96 0.356 . . . . 55.270000000000003 111.96 -179.645 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 82.9 mt-30 -82.98 -15.82 49.72 Favored 'General case' 0 C--N 1.328 -0.333 0 N-CA-C 112.388 0.514 . . . . 68.400000000000006 112.388 -179.469 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.612 ' HG3' ' O ' ' A' ' 57' ' ' LYS . 76.8 mt-10 -80.38 -48.9 12.23 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 107.633 -1.247 . . . . 67.189999999999998 107.633 178.725 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 7.0 tp60 -74.6 -6.97 51.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 115.287 -0.87 . . . . 57.600000000000001 110.325 -179.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 71.0 43.12 58.22 Favored Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.8 -0.714 . . . . 49.590000000000003 113.691 179.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ILE . . . . . 0.642 HD13 HD21 ' A' ' 6' ' ' LEU . 47.1 mt -103.66 129.91 54.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 N-CA-C 109.681 -0.489 . . . . 41.049999999999997 109.681 179.815 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -77.02 124.22 27.48 Favored 'General case' 0 C--O 1.185 -2.303 0 O-C-N 121.663 -0.648 . . . . 42.700000000000003 112.304 -176.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 81.0 mt -86.14 111.21 20.89 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.757 0 N-CA-C 106.647 -1.612 . . . . 40.159999999999997 106.647 179.318 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' LYS . . . . . . . . . . . . . 70.1 mttt -74.86 -39.42 61.57 Favored 'General case' 0 C--N 1.327 -0.405 0 CA-C-N 115.892 -0.595 . . . . 56.799999999999997 112.534 -179.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ARG . . . . . 0.635 ' HB2' ' HB2' ' A' ' 81' ' ' ASP . 68.5 mtm180 -144.02 154.85 43.69 Favored 'General case' 0 C--N 1.328 -0.335 0 N-CA-C 113.281 0.845 . . . . 38.229999999999997 113.281 179.782 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.515 ' HA ' ' O ' ' A' ' 79' ' ' LEU . 10.0 tt -159.85 106.84 1.65 Allowed 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 104.74 -2.319 . . . . 35.990000000000002 104.74 178.497 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 68.3 mt-10 -133.3 145.94 50.91 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 113.197 0.814 . . . . 53.939999999999998 113.197 -177.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 79.7 17.12 76.07 Favored Glycine 0 N--CA 1.451 -0.349 0 CA-C-N 115.604 -0.725 . . . . 32.630000000000003 114.905 179.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.41 ' HB2' HD21 ' A' ' 69' ' ' LEU . 68.3 t80 -65.07 -51.56 60.76 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-N 117.224 0.512 . . . . 34.159999999999997 112.035 -179.675 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 4.9 mt-10 -54.17 -53.72 49.52 Favored 'General case' 0 C--N 1.331 -0.227 0 N-CA-C 112.08 0.4 . . . . 62.810000000000002 112.08 -179.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -63.67 -31.72 72.98 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 112.56 0.578 . . . . 39.700000000000003 112.56 -179.485 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . 54.62 40.51 31.92 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 114.054 1.131 . . . . 26.870000000000001 114.054 179.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 22.3 mmm180 -110.22 -38.03 5.39 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 106.877 -1.527 . . . . 24.059999999999999 106.877 178.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.779 ' CH2' ' HG ' ' B' ' 103' ' ' LEU . 5.9 t90 -153.43 93.66 1.72 Allowed 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.182 -1.044 . . . . 22.109999999999999 108.182 179.422 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' VAL . . . . . 0.457 HG12 HD11 ' A' ' 80' ' ' ILE . 41.1 t -95.32 127.12 47.57 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 CA-C-N 115.875 -0.602 . . . . 13.380000000000001 110.416 -179.918 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.515 ' O ' ' HA ' ' A' ' 69' ' ' LEU . 7.5 tt -112.04 121.6 45.42 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 108.994 -0.743 . . . . 18.010000000000002 108.994 179.726 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.708 ' N ' HD12 ' A' ' 80' ' ' ILE . 2.4 mp -115.81 105.68 18.94 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 N-CA-C 108.412 -0.958 . . . . 26.260000000000002 108.412 179.72 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ASP . . . . . 0.635 ' HB2' ' HB2' ' A' ' 68' ' ' ARG . 21.5 t0 -86.75 110.06 19.66 Favored 'General case' 0 C--N 1.327 -0.413 0 CA-C-N 116.433 -0.349 . . . . 33.039999999999999 110.315 -179.643 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' LEU . . . . . 0.412 HD11 HD22 ' A' ' 55' ' ' LEU . 84.4 mt -104.22 10.47 35.69 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.411 -0.359 . . . . 32.280000000000001 111.167 179.932 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 100.74 -106.94 3.19 Favored Glycine 0 N--CA 1.45 -0.403 0 C-N-CA 120.646 -0.788 . . . . 36.609999999999999 112.623 -179.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ASP . . . . . 0.68 ' OD2' ' HB2' ' A' ' 2' ' ' SER . 64.9 m-20 -62.25 -21.62 65.33 Favored 'General case' 0 C--N 1.327 -0.412 0 CA-C-O 120.924 0.392 . . . . 52.649999999999999 110.58 179.815 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.588 HG22 ' HB2' ' A' ' 36' ' ' PHE . 24.7 t -125.78 137.35 57.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 115.933 -0.576 . . . . 30.07 109.852 179.222 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 71.1 t -125.46 120.0 56.69 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.407 0 N-CA-C 107.533 -1.284 . . . . 20.609999999999999 107.533 179.162 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.725 HG21 HD11 ' A' ' 55' ' ' LEU . 21.9 t -98.07 137.9 24.32 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.383 0 N-CA-C 112.709 0.633 . . . . 15.32 112.709 -179.154 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' HIS . . . . . 0.596 ' HD2' ' HE1' ' A' ' 77' ' ' TRP . 70.6 m80 -120.24 110.68 16.88 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.473 -0.785 . . . . 22.68 109.073 178.883 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.536 HG12 HG13 ' A' ' 48' ' ' VAL . 53.2 t -106.3 104.27 16.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.379 0 N-CA-C 109.44 -0.578 . . . . 16.010000000000002 109.44 179.898 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' PHE . . . . . 0.524 ' CD2' ' HB2' ' A' ' 97' ' ' TYR . 66.1 m-85 -95.33 162.34 13.71 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 113.256 0.835 . . . . 17.550000000000001 113.256 -179.678 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' HIS . . . . . . . . . . . . . 24.5 t-80 -94.36 132.82 38.58 Favored 'General case' 0 C--N 1.327 -0.411 0 N-CA-C 101.123 -3.658 . . . . 25.579999999999998 101.123 176.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' LYS . . . . . . . . . . . . . 6.4 pttm -43.59 -24.75 0.13 Allowed 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 114.256 1.206 . . . . 32.350000000000001 114.256 -178.205 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -95.89 1.96 53.32 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 115.017 1.488 . . . . 44.850000000000001 115.017 -179.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLU . . . . . 0.521 ' HA ' ' OE2' ' A' ' 94' ' ' GLU . 24.2 tp10 -71.8 128.27 35.21 Favored 'General case' 0 C--N 1.33 -0.258 0 C-N-CA 120.928 -0.309 . . . . 68.019999999999996 110.256 179.932 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ARG . . . . . 0.714 ' NH2' ' H ' ' B' ' 95' ' ' ARG . 61.4 mtm180 -69.73 -41.86 74.75 Favored 'General case' 0 C--N 1.331 -0.208 0 N-CA-C 115.116 1.524 . . . . 98.950000000000003 115.116 -179.134 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -60.17 -14.2 16.11 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.641 -0.503 . . . . 63.82 109.641 179.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' TYR . . . . . 0.644 ' OH ' ' HD2' ' A' ' 41' ' ' HIS . 26.6 t80 -77.79 -19.5 54.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 115.538 -0.755 . . . . 63.859999999999999 111.548 -179.755 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 95.1 m-85 -106.33 -2.08 22.66 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 121.172 0.51 . . . . 76.359999999999999 110.712 179.521 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.448 ' C ' ' H ' ' A' ' 101' ' ' GLU . 5.6 m120 -114.63 9.09 16.45 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 107.456 -1.313 . . . . 73.859999999999999 107.456 178.732 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.739 ' HG ' ' CZ3' ' A' ' 104' ' ' TRP . 3.1 tp -66.66 -0.49 2.92 Favored 'General case' 0 C--N 1.328 -0.356 0 N-CA-C 108.386 -0.968 . . . . 78.359999999999999 108.386 179.913 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' GLU . . . . . 0.448 ' H ' ' C ' ' A' ' 99' ' ' ASN . 0.0 OUTLIER -76.41 -52.04 10.64 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 107.662 -1.236 . . . . 113.3 107.662 179.514 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.654 ' HB3' ' CD1' ' B' ' 79' ' ' LEU . 59.1 mttm -47.53 -56.1 7.79 Favored 'General case' 0 C--N 1.332 -0.192 0 N-CA-C 107.438 -1.319 . . . . 78.680000000000007 107.438 179.046 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.543 HD12 HD12 ' A' ' 100' ' ' LEU . 15.1 mt -66.25 153.11 43.41 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.411 -0.813 . . . . 74.760000000000005 109.038 178.867 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' TRP . . . . . 0.739 ' CZ3' ' HG ' ' A' ' 100' ' ' LEU . 0.1 OUTLIER . . . . . 0 C--N 1.325 -0.482 0 C-N-CA 120.067 -0.653 . . . . 64.650000000000006 109.928 177.853 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo . . . . . 0 CA--C 1.527 0.156 0 CA-C-O 120.76 0.233 . . . . 44.840000000000003 111.72 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' THR . . . . . . . . . . . . . 19.4 p -80.3 174.96 11.08 Favored 'General case' 0 C--N 1.33 -0.273 0 N-CA-C 113.02 0.748 . . . . 45.119999999999997 113.02 -179.019 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 21.4 t -126.32 120.78 57.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 115.483 -0.781 . . . . 43.039999999999999 110.474 179.801 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -69.4 83.97 0.4 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.052 -0.522 . . . . 44.869999999999997 109.807 179.967 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' LEU . . . . . 0.425 ' O ' ' N ' ' A' ' 114' ' ' GLY . 66.9 mt -42.35 -55.97 3.16 Favored 'General case' 0 C--N 1.332 -0.171 0 N-CA-C 113.339 0.866 . . . . 50.369999999999997 113.339 -179.515 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -68.81 67.42 0.14 Allowed 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 107.9 -1.148 . . . . 64.030000000000001 107.9 179.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' GLY . . . . . 0.425 ' N ' ' O ' ' A' ' 112' ' ' LEU . . . . . . . . 0 C--O 1.249 1.077 0 CA-C-O 118.56 -1.133 . . . . 60.979999999999997 112.37 -179.607 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' ASN . . . . . 0.544 ' CG ' ' H ' ' B' ' 4' ' ' GLN . 56.0 t30 . . . . . 0 N--CA 1.493 1.678 0 N-CA-C 109.511 -0.552 . . . . 80.719999999999999 109.511 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' GLN . . . . . 0.544 ' H ' ' CG ' ' B' ' 3' ' ' ASN . 17.7 mt-30 -60.19 -11.12 5.45 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 113.09 0.774 . . . . 85.189999999999998 113.09 -179.761 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' GLU . . . . . 0.536 ' OE2' ' HB3' ' B' ' 3' ' ' ASN . 24.3 mp0 -68.11 -47.57 67.83 Favored 'General case' 0 C--N 1.328 -0.326 0 N-CA-C 111.808 0.299 . . . . 98.0 111.808 179.732 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -76.2 -41.76 48.43 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 107.204 -1.406 . . . . 58.159999999999997 107.204 179.24 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' LEU . . . . . 0.65 ' O ' HG23 ' B' ' 11' ' ' VAL . 23.9 tp -58.06 -47.54 82.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 115.295 -0.866 . . . . 52.32 112.081 -179.612 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 12.1 mt-30 -67.69 -28.3 67.56 Favored 'General case' 0 C--N 1.331 -0.229 0 N-CA-C 109.005 -0.739 . . . . 93.900000000000006 109.005 178.973 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 19.7 tp -68.49 -39.95 81.12 Favored 'General case' 0 C--N 1.328 -0.353 0 N-CA-C 108.496 -0.928 . . . . 53.520000000000003 108.496 179.85 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -76.21 -38.83 55.93 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 115.65 -0.705 . . . . 44.560000000000002 111.352 179.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' VAL . . . . . 0.65 HG23 ' O ' ' B' ' 7' ' ' LEU . 97.2 t -61.69 -41.55 90.86 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 CA-C-N 116.438 -0.347 . . . . 41.369999999999997 111.033 179.975 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -66.59 -54.78 19.81 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.432 -0.349 . . . . 53.939999999999998 110.756 179.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' ALA . . . . . . . . . . . . . . . -47.64 -54.13 12.82 Favored 'General case' 0 C--N 1.331 -0.216 0 N-CA-C 109.25 -0.648 . . . . 44.799999999999997 109.25 179.51 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' VAL . . . . . 0.644 HG13 ' CB ' ' B' ' 19' ' ' ALA . 2.1 t -61.24 -28.4 43.75 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 115.49 -0.777 . . . . 40.780000000000001 111.391 179.329 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -78.92 -30.7 44.89 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 113.356 0.873 . . . . 52.590000000000003 113.356 -179.516 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' ASP . . . . . . . . . . . . . 95.7 m-20 -64.53 -28.77 69.88 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.835 0.35 . . . . 61.409999999999997 110.95 179.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' LYS . . . . . 0.765 ' HE2' ' HA ' ' B' ' 17' ' ' LYS . 10.7 mmpt? -94.24 6.74 47.71 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 113.959 1.096 . . . . 48.0 113.959 -179.266 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 28.5 mmtp 72.71 30.11 1.86 Allowed 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 115.991 1.848 . . . . 47.68 115.991 178.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' ALA . . . . . 0.644 ' CB ' HG13 ' B' ' 14' ' ' VAL . . . -62.33 132.93 54.25 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 108.66 -0.867 . . . . 36.759999999999998 108.66 179.359 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' GLU . . . . . . . . . . . . . 91.9 mt-10 -96.86 154.12 17.48 Favored 'General case' 0 C--N 1.329 -0.317 0 N-CA-C 115.246 1.572 . . . . 54.659999999999997 115.246 -178.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 53.64 50.22 17.64 Favored 'General case' 0 C--N 1.331 -0.212 0 CA-C-N 115.107 -0.951 . . . . 50.280000000000001 113.453 179.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' VAL . . . . . 0.408 HG13 HD11 ' B' ' 38' ' ' LEU . 43.0 t -68.3 125.65 26.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-O 120.985 0.422 . . . . 35.469999999999999 110.682 179.614 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' VAL . . . . . 0.442 ' O ' HD12 ' B' ' 38' ' ' LEU . 56.1 t -136.65 131.64 47.67 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.351 0 CA-C-N 115.872 -0.604 . . . . 34.409999999999997 110.823 179.824 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' ALA . . . . . 0.883 ' HB3' ' HB ' ' B' ' 110' ' ' VAL . . . -104.21 146.41 28.81 Favored 'General case' 0 C--N 1.328 -0.341 0 N-CA-C 107.748 -1.205 . . . . 36.130000000000003 107.748 179.062 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 86.6 mt -126.82 122.62 35.24 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.203 -0.453 . . . . 38.840000000000003 110.545 -179.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' ASN . . . . . 0.511 ' OD1' ' HB3' ' B' ' 28' ' ' LYS . 10.3 t-20 -77.68 109.03 11.31 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 107.43 -1.322 . . . . 47.719999999999999 107.43 179.463 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' MSE . . . . . . . . . . . . . 93.0 mmm -89.7 8.67 30.44 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 113.109 0.781 . . . . 60.18 113.109 -179.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' LYS . . . . . 0.511 ' HB3' ' OD1' ' B' ' 26' ' ' ASN . 0.0 OUTLIER -60.61 117.64 5.57 Favored 'General case' 0 C--O 1.195 -1.808 0 O-C-N 121.899 -0.501 . . . . 51.119999999999997 111.502 175.793 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' GLY . . . . . 0.479 ' C ' HD12 ' A' ' 32' ' ' LEU . . . 87.96 9.83 70.3 Favored Glycine 0 C--N 1.312 -0.766 0 C-N-CA 119.591 -1.29 . . . . 59.409999999999997 111.34 -178.637 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 11.0 mm -128.88 -50.43 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.331 -0.233 0 CA-C-O 120.869 0.366 . . . . 60.420000000000002 111.199 -179.475 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' SER . . . . . 0.56 ' O ' HD23 ' B' ' 32' ' ' LEU . 12.1 t -121.62 178.0 5.01 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.093 -0.503 . . . . 61.829999999999998 110.937 -179.582 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' LEU . . . . . 0.905 HD12 ' C ' ' A' ' 29' ' ' GLY . 56.3 mt . . . . . 0 C--N 1.328 -0.35 0 N-CA-C 112.649 0.611 . . . . 68.849999999999994 112.649 -179.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' ASP . . . . . 0.724 ' HB2' ' O ' ' B' ' 84' ' ' ASP . 1.7 m-20 . . . . . 0 C--O 1.201 -1.489 0 N-CA-C 115.419 1.637 . . . . 60.210000000000001 115.419 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' PHE . . . . . 0.674 ' HB2' HG22 ' B' ' 85' ' ' VAL . 55.0 m-85 -135.35 127.61 30.14 Favored 'General case' 0 C--O 1.172 -2.985 0 CA-C-N 116.053 -0.521 . . . . 43.170000000000002 111.56 -173.127 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' PHE . . . . . . . . . . . . . 7.0 m-30 -107.17 132.29 53.2 Favored 'General case' 0 C--O 1.155 -3.885 0 N-CA-C 108.759 -0.83 . . . . 37.630000000000003 108.759 170.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' LEU . . . . . 0.442 HD12 ' O ' ' B' ' 23' ' ' VAL . 12.6 tp -121.19 131.65 54.36 Favored 'General case' 0 C--O 1.174 -2.902 0 C-N-CA 116.706 -1.998 . . . . 38.539999999999999 112.359 -178.053 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' ILE . . . . . 0.444 HD13 HD23 ' B' ' 100' ' ' LEU . 4.3 mt -122.1 147.19 26.29 Favored 'Isoleucine or valine' 0 C--N 1.281 -2.38 0 CA-C-N 113.3 -1.773 . . . . 39.649999999999999 112.953 -177.119 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' CYS . . . . . . . . . . . . . 31.9 p -170.64 175.84 4.49 Favored 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 105.944 -1.873 . . . . 35.68 105.944 179.763 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' HIS . . . . . 0.659 ' HD2' ' OH ' ' B' ' 97' ' ' TYR . 3.8 p80 -149.62 163.03 39.01 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 113.119 0.785 . . . . 58.090000000000003 113.119 -179.279 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' GLY . . . . . . . . . . . . . . . -115.46 161.91 12.68 Favored Glycine 0 N--CA 1.449 -0.498 0 N-CA-C 106.947 -2.461 . . . . 30.460000000000001 106.947 178.519 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' ASN . . . . . . . . . . . . . 74.9 m-20 -94.18 -1.55 53.97 Favored 'General case' 0 C--N 1.327 -0.379 0 N-CA-C 113.018 0.747 . . . . 33.460000000000001 113.018 -179.028 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' SER . . . . . . . . . . . . . 24.9 p -157.13 161.2 39.38 Favored 'General case' 0 C--N 1.327 -0.374 0 N-CA-C 107.477 -1.305 . . . . 26.609999999999999 107.477 179.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 88.7 mt-10 -64.56 -25.14 67.85 Favored 'General case' 0 C--N 1.327 -0.393 0 C-N-CA 120.582 -0.447 . . . . 38.579999999999998 111.166 -179.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' LYS . . . . . . . . . . . . . 76.8 tttt -74.34 -37.25 63.6 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 109.558 -0.534 . . . . 31.100000000000001 109.558 178.815 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 13.1 tt0 -73.7 -36.02 65.22 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.311 -0.404 . . . . 38.210000000000001 110.285 -179.894 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' VAL . . . . . 0.455 HG13 HG12 ' B' ' 89' ' ' VAL . 45.9 t -63.89 -41.19 91.72 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 N-CA-C 110.111 -0.329 . . . . 25.940000000000001 110.111 179.924 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' GLN . . . . . 0.434 ' HG3' ' HB2' ' B' ' 75' ' ' ALA . 23.4 mt-30 -72.18 -31.4 65.88 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.251 -0.431 . . . . 33.490000000000002 111.173 179.569 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.78 -42.3 97.8 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 108.371 -0.974 . . . . 26.27 108.371 179.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' ILE . . . . . 0.559 HD13 ' HB2' ' B' ' 19' ' ' ALA . 88.3 mt -65.5 -51.93 57.48 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 CA-C-N 115.456 -0.793 . . . . 29.77 110.631 -179.967 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -56.49 -36.93 69.68 Favored 'General case' 0 C--N 1.327 -0.396 0 CA-C-N 115.879 -0.601 . . . . 22.620000000000001 111.108 179.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' HIS . . . . . . . . . . . . . 21.6 t-80 -72.42 -40.53 67.07 Favored 'General case' 0 C--N 1.33 -0.271 0 N-CA-C 112.559 0.578 . . . . 27.899999999999999 112.559 -179.129 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' GLU . . . . . . . . . . . . . 32.6 tp10 -62.21 -32.98 73.71 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 108.777 -0.823 . . . . 52.630000000000003 108.777 179.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' LEU . . . . . 0.706 HD11 HG21 ' B' ' 87' ' ' VAL . 0.5 OUTLIER -70.5 -41.67 72.34 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.144 -1.058 . . . . 38.100000000000001 108.144 179.326 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -65.14 -48.29 74.06 Favored 'General case' 0 C--N 1.33 -0.264 0 N-CA-C 108.838 -0.801 . . . . 39.219999999999999 108.838 179.143 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' LYS . . . . . 0.612 ' O ' ' HG3' ' B' ' 61' ' ' GLU . 56.8 tttm -57.46 -48.34 79.44 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 115.542 -0.753 . . . . 68.340000000000003 110.538 -179.975 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' VAL . . . . . . . . . . . . . 15.8 t -65.94 -34.58 71.26 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.23 0 N-CA-C 112.341 0.497 . . . . 46.210000000000001 112.341 179.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' ALA . . . . . . . . . . . . . . . -67.12 -32.87 74.3 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.375 -0.375 . . . . 57.289999999999999 111.829 -179.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 81.6 mt-30 -82.67 -15.03 53.55 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 112.37 0.507 . . . . 77.489999999999995 112.37 -179.429 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' GLU . . . . . 0.612 ' HG3' ' O ' ' B' ' 57' ' ' LYS . 78.7 mt-10 -81.2 -48.85 11.52 Favored 'General case' 0 C--N 1.331 -0.221 0 N-CA-C 107.598 -1.26 . . . . 63.159999999999997 107.598 178.866 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' GLN . . . . . 0.843 ' HB3' HD12 ' B' ' 64' ' ' ILE . 5.0 tp60 -74.34 -7.66 53.59 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 115.383 -0.826 . . . . 75.909999999999997 110.403 -179.534 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' GLY . . . . . . . . . . . . . . . 71.81 40.0 58.75 Favored Glycine 0 N--CA 1.452 -0.298 0 C-N-CA 120.832 -0.699 . . . . 54.289999999999999 113.602 179.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.843 HD12 ' HB3' ' B' ' 62' ' ' GLN . 3.4 mt -106.39 142.59 18.95 Favored 'Isoleucine or valine' 0 C--O 1.175 -2.827 0 O-C-N 120.428 -1.63 . . . . 50.329999999999998 108.636 179.301 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -93.22 123.76 36.73 Favored 'General case' 0 C--N 1.305 -1.35 0 N-CA-C 114.589 1.329 . . . . 46.329999999999998 114.589 -167.811 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' ILE . . . . . . . . . . . . . 27.8 mt -84.09 113.42 22.9 Favored 'Isoleucine or valine' 0 N--CA 1.401 -2.925 0 N-CA-C 104.379 -2.452 . . . . 45.289999999999999 104.379 -174.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -75.91 -39.22 56.71 Favored 'General case' 0 C--N 1.295 -1.775 0 CA-C-N 114.949 -1.023 . . . . 67.519999999999996 112.741 177.209 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' ARG . . . . . 0.675 ' HB2' ' HB2' ' B' ' 81' ' ' ASP . 67.4 mtm180 -144.31 155.53 43.86 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 113.254 0.835 . . . . 40.759999999999998 113.254 179.718 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' LEU . . . . . 0.581 ' HA ' ' O ' ' B' ' 79' ' ' LEU . 10.3 tt -160.71 107.22 1.49 Allowed 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 104.636 -2.357 . . . . 35.719999999999999 104.636 178.502 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 56.8 mt-10 -133.81 146.01 50.27 Favored 'General case' 0 C--N 1.328 -0.35 0 N-CA-C 112.997 0.74 . . . . 44.450000000000003 112.997 -178.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . 79.92 18.86 71.53 Favored Glycine 0 N--CA 1.451 -0.309 0 N-CA-C 114.942 0.737 . . . . 34.100000000000001 114.942 179.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' TYR . . . . . 0.431 ' HB2' HD21 ' B' ' 69' ' ' LEU . 73.1 t80 -67.23 -49.63 63.75 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-N 117.097 0.448 . . . . 37.0 111.929 -179.565 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' GLU . . . . . . . . . . . . . 5.2 mt-10 -55.02 -53.09 60.24 Favored 'General case' 0 C--N 1.331 -0.231 0 N-CA-C 112.194 0.442 . . . . 64.359999999999999 112.194 179.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -64.9 -31.41 72.63 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 112.612 0.597 . . . . 58.979999999999997 112.612 -179.5 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' ALA . . . . . 0.434 ' HB2' ' HG3' ' B' ' 49' ' ' GLN . . . 54.23 39.86 31.18 Favored 'General case' 0 C--N 1.328 -0.348 0 N-CA-C 114.216 1.191 . . . . 30.460000000000001 114.216 179.206 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' ARG . . . . . . . . . . . . . 24.2 mmm180 -110.22 -35.12 6.18 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 107.095 -1.446 . . . . 37.130000000000003 107.095 178.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' TRP . . . . . 0.65 ' HE1' ' HD2' ' B' ' 88' ' ' HIS . 5.9 t90 -156.18 92.35 1.33 Allowed 'General case' 0 C--N 1.327 -0.407 0 CA-C-N 114.993 -1.003 . . . . 33.270000000000003 108.355 179.315 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' VAL . . . . . 0.497 HG12 HD11 ' B' ' 80' ' ' ILE . 23.6 t -94.73 128.88 45.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 115.859 -0.61 . . . . 15.74 110.526 -179.852 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.733 ' C ' HD12 ' B' ' 80' ' ' ILE . 7.2 tt -113.01 124.01 51.64 Favored 'General case' 0 C--N 1.327 -0.376 0 N-CA-C 109.204 -0.665 . . . . 23.609999999999999 109.204 179.664 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' ILE . . . . . 0.88 ' N ' HD12 ' B' ' 80' ' ' ILE . 0.7 OUTLIER -118.7 105.21 17.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 N-CA-C 108.56 -0.904 . . . . 27.190000000000001 108.56 179.617 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' ASP . . . . . 0.675 ' HB2' ' HB2' ' B' ' 68' ' ' ARG . 21.7 t0 -85.12 109.35 18.19 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 41.450000000000003 110.238 -179.46 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' LEU . . . . . 0.49 HD11 HD22 ' B' ' 55' ' ' LEU . 80.7 mt -102.97 10.05 38.39 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-N 116.557 -0.292 . . . . 35.25 111.096 -179.992 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' GLY . . . . . . . . . . . . . . . 99.97 -105.7 3.04 Favored Glycine 0 N--CA 1.452 -0.279 0 C-N-CA 120.761 -0.733 . . . . 40.719999999999999 112.658 179.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' ASP . . . . . 0.724 ' O ' ' HB2' ' B' ' 35' ' ' ASP . 61.8 m-20 -63.51 -20.59 65.73 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.963 0.411 . . . . 63.549999999999997 110.431 179.991 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' VAL . . . . . 0.674 HG22 ' HB2' ' B' ' 36' ' ' PHE . 10.3 t -126.87 136.35 61.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 115.799 -0.637 . . . . 35.299999999999997 109.969 179.23 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' VAL . . . . . . . . . . . . . 79.7 t -124.66 121.22 60.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 107.487 -1.301 . . . . 22.469999999999999 107.487 179.086 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' VAL . . . . . 0.706 HG21 HD11 ' B' ' 55' ' ' LEU . 9.4 t -100.37 136.59 31.11 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.41 0 N-CA-C 112.709 0.633 . . . . 18.82 112.709 -179.046 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' HIS . . . . . 0.65 ' HD2' ' HE1' ' B' ' 77' ' ' TRP . 73.2 m80 -118.57 109.83 16.63 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.554 -0.748 . . . . 33.909999999999997 109.09 178.875 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' VAL . . . . . 0.455 HG12 HG13 ' B' ' 48' ' ' VAL . 44.3 t -105.0 104.58 17.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 N-CA-C 109.382 -0.599 . . . . 19.640000000000001 109.382 179.984 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' PHE . . . . . 0.535 ' CD2' ' HB2' ' B' ' 97' ' ' TYR . 72.0 m-85 -96.32 162.77 13.36 Favored 'General case' 0 C--N 1.33 -0.263 0 N-CA-C 113.353 0.871 . . . . 21.84 113.353 -179.767 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' HIS . . . . . . . . . . . . . 26.0 t-80 -94.39 134.43 36.9 Favored 'General case' 0 C--N 1.326 -0.424 0 N-CA-C 101.143 -3.651 . . . . 30.469999999999999 101.143 177.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' LYS . . . . . . . . . . . . . 9.1 pttm -45.37 -22.48 0.14 Allowed 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 114.218 1.192 . . . . 54.219999999999999 114.218 -178.118 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' ASP . . . . . . . . . . . . . 69.8 m-20 -98.61 4.46 48.04 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 114.886 1.439 . . . . 49.93 114.886 -179.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' GLU . . . . . 0.516 ' OE2' ' HA ' ' B' ' 94' ' ' GLU . 24.0 tp10 -73.89 129.14 37.29 Favored 'General case' 0 C--N 1.328 -0.334 0 C-N-CA 120.771 -0.372 . . . . 88.349999999999994 110.078 179.887 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' ARG . . . . . 0.714 ' H ' ' NH2' ' A' ' 95' ' ' ARG . 61.8 mtm180 -70.22 -42.5 72.22 Favored 'General case' 0 C--N 1.33 -0.251 0 N-CA-C 115.072 1.508 . . . . 118.92 115.072 -179.107 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.34 -15.67 17.7 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.608 -0.516 . . . . 70.540000000000006 109.608 179.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' TYR . . . . . 0.659 ' OH ' ' HD2' ' B' ' 41' ' ' HIS . 21.8 t80 -77.13 -18.82 57.63 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 115.544 -0.753 . . . . 74.349999999999994 111.623 -179.835 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -106.09 -3.65 21.28 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.148 0.499 . . . . 113.43000000000001 110.639 179.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' ASN . . . . . 0.471 ' C ' ' H ' ' B' ' 101' ' ' GLU . 4.4 m120 -113.38 8.99 18.12 Favored 'General case' 0 C--N 1.327 -0.378 0 N-CA-C 107.664 -1.236 . . . . 85.909999999999997 107.664 178.565 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' LEU . . . . . 0.699 HD12 HD12 ' B' ' 103' ' ' LEU . 3.5 tp -67.01 1.25 2.04 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.543 -0.91 . . . . 85.430000000000007 108.543 179.844 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' GLU . . . . . 0.471 ' H ' ' C ' ' B' ' 99' ' ' ASN . 0.0 OUTLIER -77.44 -52.64 8.76 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 107.554 -1.276 . . . . 117.28 107.554 179.388 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' LYS . . . . . 0.625 ' HE3' ' HB3' ' A' ' 77' ' ' TRP . 61.6 mttm -46.93 -57.14 5.27 Favored 'General case' 0 CA--C 1.519 -0.216 0 N-CA-C 107.332 -1.359 . . . . 80.799999999999997 107.332 179.084 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' LEU . . . . . 0.779 ' HG ' ' CH2' ' A' ' 77' ' ' TRP . 33.9 mt -57.69 125.33 22.48 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 105.515 -2.031 . . . . 80.5 105.515 178.46 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' TRP . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.331 -0.236 0 CA-C-N 115.564 -0.744 . . . . 76.680000000000007 110.95 -179.293 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo . . . . . 0 N--CA 1.466 -0.137 0 CA-C-O 120.853 0.272 . . . . 79.180000000000007 112.134 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' THR . . . . . . . . . . . . . 51.2 p -76.17 122.52 24.45 Favored 'General case' 0 C--N 1.33 -0.247 0 N-CA-C 113.076 0.769 . . . . 77.340000000000003 113.076 -179.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' VAL . . . . . 0.883 ' HB ' ' HB3' ' B' ' 24' ' ' ALA . 83.7 t -73.53 144.81 12.27 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 N-CA-C 108.843 -0.799 . . . . 74.019999999999996 108.843 179.344 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' GLU . . . . . 0.417 ' O ' HD23 ' B' ' 112' ' ' LEU . 10.3 tp10 -85.14 151.46 24.1 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 109.91 -0.404 . . . . 84.75 109.91 -179.709 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' LEU . . . . . 0.417 HD23 ' O ' ' B' ' 111' ' ' GLU . 23.8 mt . . . . . 0 C--O 1.25 1.085 0 CA-C-O 118.164 -0.922 . . . . 82.0 111.612 -179.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' ' MN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' ' MN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ' MN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' ' MN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 3002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 3004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 3005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 3006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 3008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 3020 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 3021 ' ' HOH . . . . . 0.489 ' O ' HD23 ' A' ' 103' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 3024 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 3025 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 3026 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 3029 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 3030 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 3034 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 3035 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 3040 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 3047 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 3050 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 3052 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 3054 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 3055 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 3056 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 3057 ' ' HOH . . . . . 0.444 ' O ' ' OE2' ' A' ' 94' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 3007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 3012 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 3015 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 3016 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 3017 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 3018 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 3023 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 3031 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 3036 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 3037 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 3038 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 3042 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 3045 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 3046 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 3048 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 3049 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 3053 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_