data_1rcb_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 1rcb _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 ' 1' ' ' HIS . . . . . 0.487 ' O ' ' C ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.504 2.271 0 N-CA-C 105.185 -2.154 . . . . 83.090000000000003 105.185 . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' LYS . . . . . 0.487 ' C ' ' O ' ' A' ' 1' ' ' HIS . 13.1 mtmt -4.55 -78.61 0.0 OUTLIER 'General case' 0 C--O 1.255 1.351 1 CA-C-O 111.36 -4.162 . . . . 66.120000000000005 111.194 179.192 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 25.3 m -102.48 28.88 5.61 Favored 'General case' 0 C--O 1.271 2.209 2 N-CA-C 126.4 5.704 . . . . 43.810000000000002 126.4 -176.513 -48.987 -67.083 -81.902 109.936 2.021 101.983 -89.601 -70.781 2 2 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -69.38 160.53 31.16 Favored 'General case' 0 C--N 1.285 -2.216 0 O-C-N 116.85 -3.656 . . . . 38.289999999999999 104.407 175.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . 0.278 1.5 pp -64.92 -10.27 8.98 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 O-C-N 125.285 1.616 . . . . 24.879999999999999 109.287 173.957 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 99.7 m -54.52 -34.3 61.48 Favored 'General case' 0 C--N 1.307 -1.263 0 O-C-N 126.255 2.222 . . . . 26.09 107.096 176.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 62.8 mt -61.52 -42.45 98.84 Favored 'General case' 0 C--N 1.323 -0.581 0 O-C-N 120.97 -1.081 . . . . 28.420000000000002 109.177 177.381 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 34.0 tp60 -65.03 -31.99 73.49 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 115.533 -2.467 . . . . 26.23 109.726 -176.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -66.26 -44.69 82.93 Favored 'General case' 0 C--O 1.187 -2.225 0 C-N-CA 125.166 1.386 . . . . 29.539999999999999 110.33 -178.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 46.8 mt -62.49 -44.9 99.75 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.709 0 CA-C-O 117.238 -1.363 . . . . 18.32 108.926 175.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 83.6 mt -64.34 -51.44 68.23 Favored 'Isoleucine or valine' 0 C--O 1.263 1.81 0 O-C-N 128.743 3.777 . . . . 23.079999999999998 112.662 177.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . 0.271 0.2 OUTLIER -63.0 -19.48 64.38 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 115.267 -2.573 . . . . 43.700000000000003 113.035 -177.439 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 31.3 m -89.01 -25.35 22.04 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 120.588 1.54 . . . . 24.690000000000001 108.898 -177.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . 0.311 0.5 OUTLIER -72.36 -30.93 65.17 Favored 'General case' 0 N--CA 1.509 2.487 0 CA-C-O 124.648 2.166 . . . . 24.129999999999999 106.331 -177.458 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -78.73 -30.8 46.09 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 117.129 -3.482 . . . . 35.619999999999997 110.064 175.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 14.6 m -67.2 -21.82 65.76 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-O 125.852 2.739 . . . . 34.189999999999998 107.932 -178.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -87.23 -37.89 16.84 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 119.576 -1.952 . . . . 34.329999999999998 111.107 -173.226 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' THR . . . . . 0.428 ' O ' ' NZ ' ' A' ' 21' ' ' LYS . 28.6 p -82.2 -8.53 59.65 Favored 'General case' 0 CA--C 1.499 -0.99 0 CA-C-N 113.972 -1.467 . . . . 42.509999999999998 108.792 -176.845 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -84.94 -65.18 1.04 Allowed 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 101.706 -3.442 . . . . 64.540000000000006 101.706 179.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLN . . . . . 0.568 ' CG ' ' O ' ' A' ' 20' ' ' GLN . 3.8 pt20 -72.77 113.98 10.41 Favored 'General case' 0 C--N 1.307 -1.27 0 O-C-N 126.225 2.203 . . . . 67.349999999999994 115.877 -175.412 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LYS . . . . . 0.428 ' NZ ' ' O ' ' A' ' 18' ' ' THR . 18.3 mmtm -93.13 165.48 12.81 Favored 'General case' 0 C--O 1.25 1.116 3 O-C-N 130.498 4.874 . . . . 66.239999999999995 98.359 175.777 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.3 m -168.06 172.31 8.89 Favored 'General case' 0 C--N 1.284 -2.243 1 O-C-N 131.924 5.765 . . . . 54.710000000000001 106.681 -174.641 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.31 -38.72 74.47 Favored 'General case' 0 C--N 1.301 -1.5 0 CA-C-O 125.461 2.553 . . . . 52.25 116.585 -176.485 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' CYS . . . . . 0.448 ' CA ' ' O ' ' A' ' 216' ' ' HOH . 0.1 OUTLIER -87.92 -18.91 28.11 Favored 'General case' 0 C--O 1.267 2.0 1 C-N-CA 132.391 4.276 . . . . 42.969999999999999 118.701 -171.506 -131.396 75.047 87.787 107.205 2.042 98.857 -142.116 -60.232 4 4 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 71.6 p -73.31 10.56 0.96 Allowed 'General case' 0 C--O 1.243 0.711 0 CA-C-N 113.5 -1.682 . . . . 35.859999999999999 113.04 -177.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -117.36 -5.82 11.27 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 126.777 2.548 . . . . 58.549999999999997 105.266 178.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 11.8 mt -67.5 172.52 4.94 Favored 'General case' 0 N--CA 1.512 2.646 0 N-CA-C 101.798 -3.408 . . . . 33.640000000000001 101.798 175.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 62.0 p -117.12 156.36 27.75 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 115.045 1.498 . . . . 29.489999999999998 115.045 -178.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 20.1 m -124.7 151.87 30.45 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.691 1 C-N-CA 133.036 4.535 . . . . 25.699999999999999 107.297 177.592 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 30.7 m -65.9 119.36 11.17 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 104.572 -2.381 . . . . 32.32 104.572 173.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ASP . . . . . 0.45 ' CB ' ' OG ' ' A' ' 107' ' ' SER . 44.6 t0 -68.17 81.37 0.23 Allowed 'General case' 0 C--N 1.3 -1.561 1 CA-C-O 111.672 -4.014 . . . . 33.030000000000001 107.11 -178.942 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 3.6 pt -65.7 -9.09 7.31 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.82 0 O-C-N 128.119 3.387 . . . . 34.509999999999998 111.93 178.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -97.98 35.29 1.75 Allowed 'General case' 0 C--O 1.277 2.535 0 O-C-N 119.515 -1.991 . . . . 46.82 110.675 177.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -117.25 19.89 13.93 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 126.963 2.105 . . . . 50.479999999999997 108.524 -179.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -97.72 175.09 6.31 Favored 'General case' 0 C--O 1.257 1.461 0 CA-C-O 124.027 1.87 . . . . 56.68 106.753 176.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.4 p -133.21 -39.89 0.92 Allowed 'General case' 0 C--N 1.305 -1.364 1 C-N-CA 134.488 5.115 . . . . 67.510000000000005 107.636 176.212 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LYS . . . . . 0.443 ' CG ' ' N ' ' A' ' 38' ' ' ASN . 0.0 OUTLIER -28.99 -51.75 0.1 Allowed 'General case' 0 C--O 1.25 1.106 1 C-N-CA 135.284 5.433 . . . . 81.709999999999994 116.671 174.89 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ASN . . . . . 0.54 ' N ' ' ND2' ' A' ' 38' ' ' ASN 0.273 1.0 OUTLIER 59.16 124.13 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.333 2 N-CA-C 123.567 4.655 . . . . 76.900000000000006 123.567 174.232 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' THR . . . . . 0.661 ' O ' ' CB ' ' A' ' 40' ' ' THR . 0.8 OUTLIER -94.72 -52.26 4.36 Favored 'General case' 0 N--CA 1.393 -3.319 2 C-N-CA 150.017 11.327 . . . . 68.680000000000007 131.334 -167.483 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' THR . . . . . 0.661 ' CB ' ' O ' ' A' ' 39' ' ' THR . 1.3 t 107.93 135.45 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 124.141 3.155 . . . . 57.359999999999999 106.161 -177.321 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -42.39 -41.57 2.91 Favored 'General case' 0 C--N 1.286 -2.161 0 C-N-CA 128.259 2.624 . . . . 61.530000000000001 116.846 -177.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.03 -45.12 93.82 Favored 'General case' 0 C--N 1.289 -2.054 1 C-N-CA 133.037 4.535 . . . . 53.329999999999998 110.846 178.796 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLU . . . . . 0.427 ' O ' ' CG ' ' A' ' 47' ' ' ARG . 23.3 mt-10 -86.95 -18.63 30.3 Favored 'General case' 0 CA--C 1.494 -1.183 0 O-C-N 120.192 -1.567 . . . . 56.200000000000003 109.405 179.882 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 m -62.87 -44.75 95.29 Favored 'General case' 0 C--N 1.291 -1.963 0 C-N-CA 113.806 -3.158 . . . . 33.560000000000002 103.593 177.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' PHE . . . . . 0.555 ' CE1' ' CE ' ' A' ' 120' ' ' MET 0.308 17.9 m-30 -66.36 -38.5 87.71 Favored 'General case' 0 C--O 1.259 1.565 1 O-C-N 130.962 5.164 . . . . 32.969999999999999 111.581 -175.731 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 12.4 t -66.5 -38.61 87.64 Favored 'General case' 0 C--O 1.25 1.109 0 CA-C-O 126.903 3.239 . . . . 32.920000000000002 113.392 177.047 168.916 -93.72 154.212 104.242 2.026 100.668 114.659 -92.537 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ARG . . . . . 0.427 ' CG ' ' O ' ' A' ' 43' ' ' GLU . 9.0 mtm180 -69.3 -40.93 77.41 Favored 'General case' 0 C--O 1.243 0.731 0 CA-C-N 112.171 -2.286 . . . . 55.890000000000001 108.059 -177.463 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.51 -42.15 68.34 Favored 'General case' 0 C--N 1.291 -1.965 0 CA-C-O 122.543 1.163 . . . . 21.969999999999999 109.939 177.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -58.39 -45.65 87.92 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 105.53 -2.026 . . . . 19.949999999999999 105.53 177.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . 0.294 24.4 m -61.07 -57.23 13.43 Favored 'General case' 0 C--N 1.305 -1.328 0 N-CA-C 108.787 -0.82 . . . . 21.489999999999998 108.787 178.334 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . 0.363 0.9 OUTLIER -48.76 -43.15 13.86 Favored 'Isoleucine or valine' 0 C--O 1.296 3.509 0 O-C-N 117.193 -3.442 . . . . 23.609999999999999 112.657 -179.883 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -72.34 -33.69 67.5 Favored 'General case' 0 C--N 1.272 -2.776 0 O-C-N 118.856 -2.403 . . . . 21.690000000000001 116.942 174.739 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ARG . . . . . 0.405 ' O ' ' OG ' ' A' ' 57' ' ' SER . 0.0 OUTLIER -67.23 -38.42 85.2 Favored 'General case' 0 N--CA 1.482 1.15 1 CA-C-O 129.935 4.684 . . . . 48.990000000000002 103.282 178.719 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLN . . . . . 0.627 ' O ' ' ND1' ' A' ' 58' ' ' HIS . 1.6 mt-30 -56.24 -55.71 29.94 Favored 'General case' 0 C--O 1.206 -1.186 1 O-C-N 113.08 -6.013 . . . . 49.289999999999999 110.522 -177.204 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 39.2 t80 -56.82 -70.6 0.12 Allowed 'General case' 0 C--N 1.3 -1.564 1 CA-C-N 108.172 -4.104 . . . . 23.969999999999999 113.779 -175.902 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 7.4 p90 -53.41 -35.25 60.21 Favored 'General case' 0 C--O 1.251 1.172 0 C-N-CA 113.994 -3.082 . . . . 29.18 109.73 -178.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' SER . . . . . 0.405 ' OG ' ' O ' ' A' ' 53' ' ' ARG 0.379 88.4 p -65.24 -43.44 91.39 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-O 117.09 -1.433 . . . . 38.479999999999997 108.962 -176.185 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' HIS . . . . . 0.627 ' ND1' ' O ' ' A' ' 54' ' ' GLN . 45.4 m80 -73.54 -15.91 61.28 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-O 116.664 -1.636 . . . . 50.219999999999999 113.545 175.451 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 -128.34 9.11 6.08 Favored 'General case' 0 C--O 1.259 1.585 0 N-CA-C 117.066 2.247 . . . . 27.609999999999999 117.066 -177.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLU . . . . . 0.772 ' O ' ' CE1' ' A' ' 76' ' ' HIS . 4.6 tt0 -56.48 -38.18 71.37 Favored 'General case' 0 N--CA 1.501 2.114 0 CA-C-O 122.324 1.059 . . . . 42.159999999999997 109.613 177.801 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' LYS . . . . . 0.696 ' CD ' ' O ' ' A' ' 60' ' ' GLU . 6.5 mmtt -130.76 53.82 1.94 Allowed 'General case' 0 C--N 1.314 -0.956 0 C-N-CA 119.146 -1.021 . . . . 51.130000000000003 112.479 -178.033 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ASP . . . . . 0.669 ' OD2' ' NH1' ' A' ' 64' ' ' ARG . 64.5 t0 -96.31 126.2 41.35 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 106.624 -1.621 . . . . 26.670000000000002 106.624 -175.572 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 28.3 m -52.56 -36.0 54.94 Favored 'General case' 0 C--N 1.285 -2.228 0 CA-C-O 112.878 -3.439 . . . . 32.43 106.86 -178.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ARG . . . . . 0.669 ' NH1' ' OD2' ' A' ' 62' ' ' ASP 0.337 0.0 OUTLIER -68.41 -15.03 63.41 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-O 115.379 -2.248 . . . . 30.59 111.499 -175.146 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 81.4 m -109.05 -31.35 7.65 Favored 'General case' 0 CA--C 1.463 -2.371 1 N-CA-C 122.351 4.204 . . . . 32.119999999999997 122.351 -174.868 -60.232 -142.116 87.787 98.857 2.042 107.205 75.047 -131.396 2 2 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 59.1 mt -47.25 -35.13 7.3 Favored 'General case' 0 CA--C 1.49 -1.33 0 CA-C-O 116.148 -1.882 . . . . 20.5 115.757 -177.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 86.99 156.13 28.84 Favored Glycine 0 CA--C 1.548 2.133 0 N-CA-C 105.791 -2.924 . . . . 22.859999999999999 105.791 -179.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -92.01 -56.99 2.87 Favored 'General case' 0 C--N 1.272 -2.766 1 C-N-CA 140.36 7.464 . . . . 21.780000000000001 112.412 177.424 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 57.6 p -76.99 168.27 20.38 Favored 'General case' 0 CA--C 1.553 1.069 0 O-C-N 127.431 2.957 . . . . 24.16 107.586 -179.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -83.6 -15.38 49.27 Favored 'General case' 0 C--O 1.254 1.337 0 O-C-N 126.145 2.153 . . . . 32.140000000000001 107.549 175.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' GLN . . . . . 0.408 ' CG ' ' N ' ' A' ' 72' ' ' GLN . 0.8 OUTLIER -70.4 -45.8 65.23 Favored 'General case' 0 C--O 1.19 -2.042 0 N-CA-C 104.229 -2.508 . . . . 44.729999999999997 104.229 173.889 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLN . . . . . 0.408 ' N ' ' CG ' ' A' ' 71' ' ' GLN . 37.9 mt-30 -66.09 -39.84 90.3 Favored 'General case' 0 N--CA 1.439 -0.999 0 CA-C-N 113.111 -1.859 . . . . 36.509999999999998 114.34 -175.765 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -68.49 -40.93 80.72 Favored 'General case' 0 C--N 1.299 -1.609 0 CA-C-O 123.609 1.671 . . . . 25.460000000000001 110.302 -179.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 36.6 t-80 -60.6 -47.37 86.51 Favored 'General case' 0 N--CA 1.437 -1.096 0 C-N-CA 127.254 2.222 . . . . 52.530000000000001 111.774 -179.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 53.1 mtm180 -65.31 -38.12 89.2 Favored 'General case' 0 C--O 1.274 2.35 0 N-CA-C 106.966 -1.494 . . . . 54.509999999999998 106.966 179.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' HIS . . . . . 0.772 ' CE1' ' O ' ' A' ' 60' ' ' GLU . 28.5 t-80 -63.95 -47.35 80.77 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 116.283 -1.818 . . . . 23.210000000000001 112.242 -178.571 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 6.6 mtmt -58.73 -40.42 83.71 Favored 'General case' 0 C--N 1.28 -2.439 0 O-C-N 127.334 2.896 . . . . 42.210000000000001 108.37 178.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -66.58 -47.54 72.43 Favored 'General case' 0 C--N 1.31 -1.13 0 C-N-CA 126.496 1.918 . . . . 51.240000000000002 111.262 179.166 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -52.68 -44.45 66.25 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 126.449 2.343 . . . . 22.16 109.633 179.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ILE . . . . . 0.516 ' CG2' ' NZ ' ' A' ' 84' ' ' LYS . 4.2 mm -74.99 -33.67 30.14 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.761 0 C-N-CA 125.391 1.477 . . . . 23.57 113.622 -177.385 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 17.4 tpp180 -64.26 -46.86 81.85 Favored 'General case' 0 C--O 1.206 -1.212 0 N-CA-C 105.501 -2.037 . . . . 63.340000000000003 105.501 -178.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -68.07 -54.8 15.62 Favored 'General case' 0 N--CA 1.415 -2.2 1 CA-C-O 111.298 -4.191 . . . . 31.649999999999999 108.523 -176.666 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.22 -31.01 41.01 Favored 'General case' 0 C--N 1.286 -2.188 0 O-C-N 127.272 2.858 . . . . 18.84 111.822 176.691 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LYS . . . . . 0.516 ' NZ ' ' CG2' ' A' ' 80' ' ' ILE . 8.8 mttp -85.35 -30.04 24.0 Favored 'General case' 0 N--CA 1.429 -1.483 1 O-C-N 116.075 -4.141 . . . . 28.809999999999999 111.97 -178.266 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.82 -49.95 74.26 Favored 'General case' 0 C--N 1.305 -1.363 1 O-C-N 130.407 4.817 . . . . 47.270000000000003 106.225 170.257 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . 0.302 0.0 OUTLIER -66.58 -36.07 81.74 Favored 'General case' 0 N--CA 1.504 2.245 0 CA-C-O 126.279 2.942 . . . . 18.300000000000001 109.96 176.211 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -60.94 -53.51 56.39 Favored 'General case' 0 N--CA 1.421 -1.903 0 CA-C-N 113.01 -1.905 . . . . 26.809999999999999 109.334 -175.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 55.3 ttp85 -52.12 -50.79 60.98 Favored 'General case' 0 C--N 1.284 -2.249 0 CA-C-O 126.428 3.013 . . . . 42.140000000000001 108.318 177.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . 0.314 56.3 m-20 -64.48 -43.48 94.04 Favored 'General case' 0 C--O 1.28 2.682 0 CA-C-O 113.021 -3.371 . . . . 30.93 111.137 -177.729 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 94.4 mt -64.76 -45.97 84.14 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 123.384 2.811 . . . . 20.129999999999999 108.554 178.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -67.73 -18.29 64.85 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-O 114.077 -2.868 . . . . 20.719999999999999 110.997 -177.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -78.56 -31.98 43.53 Favored Glycine 0 C--N 1.298 -1.564 1 O-C-N 130.037 4.585 . . . . 26.219999999999999 112.638 -177.642 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 3.1 tp -90.01 -35.88 15.26 Favored 'General case' 0 C--N 1.308 -1.204 1 C-N-CA 132.235 4.214 . . . . 31.010000000000002 105.047 -176.55 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -60.16 -76.98 0.04 OUTLIER 'General case' 0 C--O 1.244 0.796 0 O-C-N 126.945 2.653 . . . . 38.799999999999997 104.316 176.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 75.94 31.89 54.52 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 104.924 -3.27 . . . . 48.479999999999997 104.924 177.78 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -151.33 152.28 32.95 Favored 'General case' 0 C--O 1.257 1.499 1 N-CA-C 98.565 -4.605 . . . . 58.359999999999999 98.565 177.545 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . 0.311 17.8 m120 -129.15 -3.93 5.01 Favored 'General case' 0 C--N 1.303 -1.424 1 O-C-N 129.566 4.291 . . . . 66.650000000000006 106.804 -179.713 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' SER . . . . . 0.467 ' O ' ' SG ' ' A' ' 99' ' ' CYS . 60.4 p -75.75 107.01 7.63 Favored 'General case' 0 C--O 1.278 2.585 0 N-CA-C 117.011 2.226 . . . . 65.879999999999995 117.011 179.189 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' CYS . . . . . 0.467 ' SG ' ' O ' ' A' ' 98' ' ' SER 0.462 1.5 m -132.77 117.85 15.31 Favored Pre-proline 0 CA--C 1.492 -1.261 1 N-CA-C 122.95 4.426 . . . . 61.140000000000001 122.95 178.478 -92.537 114.659 154.212 100.668 2.026 104.242 -93.72 168.916 4 3 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' PRO . . . . . 0.653 ' O ' ' NZ ' ' A' ' 102' ' ' LYS . 0.5 OUTLIER -101.36 61.97 0.04 OUTLIER 'Trans proline' 0 C--O 1.26 1.58 1 C-N-CA 126.234 4.623 . . . . 62.479999999999997 113.841 -178.694 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . 0.334 27.0 t -58.5 127.2 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.703 0 N-CA-C 103.324 -2.843 . . . . 59.859999999999999 103.324 178.543 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' LYS . . . . . 0.653 ' NZ ' ' O ' ' A' ' 100' ' ' PRO . 0.0 OUTLIER -125.3 -34.1 2.76 Favored 'General case' 0 C--O 1.247 0.924 0 N-CA-C 116.267 1.951 . . . . 55.590000000000003 116.267 -176.7 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' GLU . . . . . 0.505 ' N ' ' OE1' ' A' ' 103' ' ' GLU . 1.1 mp0 -45.74 165.63 0.02 OUTLIER 'General case' 0 C--O 1.252 1.228 0 CA-C-O 123.307 1.527 . . . . 57.68 108.814 -179.941 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ALA . . . . . 0.415 ' O ' ' C ' ' A' ' 105' ' ' ASN . . . -118.88 -47.74 2.49 Favored 'General case' 0 C--O 1.256 1.436 0 CA-C-N 112.838 -1.983 . . . . 50.740000000000002 114.969 179.956 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ASN . . . . . 0.465 ' CB ' ' O ' ' A' ' 230' ' ' HOH 0.412 15.5 t30 -63.8 155.63 29.78 Favored 'General case' 0 N--CA 1.493 1.706 1 C-N-CA 108.585 -5.246 . . . . 54.719999999999999 104.45 -176.865 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . 0.322 14.6 mm-40 -101.07 154.48 18.69 Favored 'General case' 0 N--CA 1.417 -2.103 1 C-N-CA 133.372 4.669 . . . . 47.859999999999999 108.882 175.386 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' SER . . . . . 0.45 ' OG ' ' CB ' ' A' ' 31' ' ' ASP . 0.0 OUTLIER -140.74 145.01 35.86 Favored 'General case' 0 C--N 1.293 -1.862 0 CA-C-O 116.677 -1.63 . . . . 33.649999999999999 107.012 176.821 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . 0.321 68.2 p -57.62 162.71 2.85 Favored 'General case' 0 N--CA 1.508 2.462 0 C-N-CA 115.6 -2.44 . . . . 25.960000000000001 106.857 179.557 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.6 tp -65.46 -40.38 93.12 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 115.779 -2.368 . . . . 19.93 107.897 -179.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -47.72 -39.13 16.83 Favored 'General case' 0 C--O 1.251 1.164 0 C-N-CA 125.596 1.558 . . . . 52.030000000000001 111.285 -178.239 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 56.2 m-20 -81.72 -35.37 29.84 Favored 'General case' 0 C--N 1.293 -1.853 0 CA-C-O 117.607 -1.187 . . . . 37.039999999999999 112.624 -179.663 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 63.3 t80 -59.43 -50.66 73.08 Favored 'General case' 0 C--N 1.308 -1.223 0 C-N-CA 127.491 2.316 . . . . 26.239999999999998 107.258 177.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 61.1 mt -62.74 -42.32 99.62 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-O 115.371 -2.252 . . . . 23.870000000000001 111.227 175.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.54 -45.09 62.85 Favored 'General case' 0 N--CA 1.484 1.24 0 O-C-N 126.271 2.232 . . . . 51.719999999999999 111.91 -179.586 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 1.8 ttm180 -73.12 -42.28 63.07 Favored 'General case' 0 C--N 1.303 -1.416 1 C-N-CA 133.008 4.523 . . . . 48.579999999999998 112.009 179.188 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . 0.257 0.0 OUTLIER -65.17 -31.61 72.88 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-O 127.127 3.346 . . . . 25.93 103.678 178.462 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . 0.313 72.9 tttt -62.21 -43.82 97.96 Favored 'General case' 0 N--CA 1.499 2.007 0 CA-C-N 111.03 -2.804 . . . . 34.68 107.362 -175.638 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . 0.254 3.2 m -69.04 -57.65 5.15 Favored 'General case' 0 C--O 1.206 -1.194 0 O-C-N 118.752 -2.468 . . . . 25.41 113.92 -177.602 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 36.1 mt -43.12 -45.05 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 N-CA-C 104.619 -2.363 . . . . 21.149999999999999 104.619 173.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' MET . . . . . 0.555 ' CE ' ' CE1' ' A' ' 45' ' ' PHE . 31.7 mmt -75.55 -26.1 57.71 Favored 'General case' 0 C--O 1.255 1.353 1 CA-C-O 110.29 -4.671 . . . . 28.350000000000001 109.34 -178.074 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . 0.457 0.0 OUTLIER -78.65 -24.43 45.2 Favored 'General case' 0 N--CA 1.509 2.475 1 CA-C-N 126.014 4.006 . . . . 49.729999999999997 111.447 -176.575 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 23.1 tp10 -68.71 -51.44 41.57 Favored 'General case' 0 C--O 1.262 1.738 1 C-N-CA 133.129 4.571 . . . . 41.850000000000001 108.429 172.753 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' LYS . . . . . 0.47 ' NZ ' ' O ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -51.0 -38.97 54.48 Favored 'General case' 0 N--CA 1.488 1.437 2 CA-C-N 127.559 4.708 . . . . 39.140000000000001 109.211 176.968 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 15.0 t80 -60.71 -57.78 11.25 Favored 'General case' 0 C--O 1.257 1.481 0 CA-C-N 113.481 -1.69 . . . . 24.120000000000001 112.823 177.514 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 43.2 m -51.88 -44.49 63.74 Favored 'General case' 0 N--CA 1.486 1.354 0 O-C-N 117.397 -3.314 . . . . 35.93 110.595 175.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 33.3 mtpt -62.69 -12.16 21.83 Favored 'General case' 0 C--O 1.257 1.455 0 O-C-N 121.209 -0.932 . . . . 50.57 111.962 178.123 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 82.2 m -101.08 -5.14 26.13 Favored 'General case' 0 C--O 1.267 2.011 0 CA-C-O 118.231 -0.89 . . . . 35.920000000000002 113.264 -179.651 -70.781 -89.601 -81.902 101.983 2.021 109.936 -67.083 -48.987 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 3.6 p -136.6 -32.98 0.81 Allowed 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 118.061 2.615 . . . . 46.460000000000001 118.061 179.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 27.9 t . . . . . 0 C--O 1.303 3.894 2 C-N-CA 139.221 7.008 . . . . 57.579999999999998 123.797 -172.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . 0.448 ' O ' ' CA ' ' A' ' 24' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 228' ' ' HOH . . . . . 0.553 ' O ' ' NZ ' ' A' ' 61' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 230' ' ' HOH . . . . . 0.465 ' O ' ' CB ' ' A' ' 105' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' HIS . . . . . 0.51 ' HB2' HD12 ' A' ' 93' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.504 2.271 0 N-CA-C 105.185 -2.154 . . . . 83.090000000000003 105.185 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 2' ' ' LYS . . . . . 0.487 ' C ' ' O ' ' A' ' 1' ' ' HIS . 13.1 mtmt -4.55 -78.61 0.0 OUTLIER 'General case' 0 C--O 1.255 1.351 1 CA-C-O 111.36 -4.162 . . . . 66.120000000000005 111.194 179.192 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 25.3 m -102.48 28.88 5.61 Favored 'General case' 0 C--O 1.271 2.209 2 N-CA-C 126.4 5.704 . . . . 43.810000000000002 126.4 -176.513 -48.987 -67.083 -81.902 109.936 2.021 101.983 -89.601 -70.781 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -69.38 160.53 31.16 Favored 'General case' 0 C--N 1.285 -2.216 0 O-C-N 116.85 -3.656 . . . . 38.289999999999999 104.407 175.138 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . 0.278 1.5 pp -64.92 -10.27 8.98 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 O-C-N 125.285 1.616 . . . . 24.879999999999999 109.287 173.957 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 99.7 m -54.52 -34.3 61.48 Favored 'General case' 0 C--N 1.307 -1.263 0 O-C-N 126.255 2.222 . . . . 26.09 107.096 176.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 62.8 mt -61.52 -42.45 98.84 Favored 'General case' 0 C--N 1.323 -0.581 0 O-C-N 120.97 -1.081 . . . . 28.420000000000002 109.177 177.381 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 34.0 tp60 -65.03 -31.99 73.49 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 115.533 -2.467 . . . . 26.23 109.726 -176.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -66.26 -44.69 82.93 Favored 'General case' 0 C--O 1.187 -2.225 0 C-N-CA 125.166 1.386 . . . . 29.539999999999999 110.33 -178.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 46.8 mt -62.49 -44.9 99.75 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.709 0 CA-C-O 117.238 -1.363 . . . . 18.32 108.926 175.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 83.6 mt -64.34 -51.44 68.23 Favored 'Isoleucine or valine' 0 C--O 1.263 1.81 0 O-C-N 128.743 3.777 . . . . 23.079999999999998 112.662 177.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . 0.271 0.2 OUTLIER -63.0 -19.48 64.38 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 115.267 -2.573 . . . . 43.700000000000003 113.035 -177.439 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 31.3 m -89.01 -25.35 22.04 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 120.588 1.54 . . . . 24.690000000000001 108.898 -177.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LEU . . . . . 0.662 HD21 HD13 ' A' ' 116' ' ' LEU 0.311 0.5 OUTLIER -72.36 -30.93 65.17 Favored 'General case' 0 N--CA 1.509 2.487 0 CA-C-O 124.648 2.166 . . . . 24.129999999999999 106.331 -177.458 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -78.73 -30.8 46.09 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 117.129 -3.482 . . . . 35.619999999999997 110.064 175.718 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' SER . . . . . 0.573 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 14.6 m -67.2 -21.82 65.76 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-O 125.852 2.739 . . . . 34.189999999999998 107.932 -178.705 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -87.23 -37.89 16.84 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 119.576 -1.952 . . . . 34.329999999999998 111.107 -173.226 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' THR . . . . . 0.581 HG23 ' O ' ' A' ' 14' ' ' LEU . 28.6 p -82.2 -8.53 59.65 Favored 'General case' 0 CA--C 1.499 -0.99 0 CA-C-N 113.972 -1.467 . . . . 42.509999999999998 108.792 -176.845 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -84.94 -65.18 1.04 Allowed 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 101.706 -3.442 . . . . 64.540000000000006 101.706 179.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLN . . . . . 0.865 ' O ' ' HG3' ' A' ' 20' ' ' GLN . 1.1 pt20 -72.77 113.98 10.41 Favored 'General case' 0 C--N 1.307 -1.27 0 O-C-N 126.225 2.203 . . . . 67.349999999999994 115.877 -175.412 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 18.3 mmtm -93.13 165.48 12.81 Favored 'General case' 0 C--O 1.25 1.116 3 O-C-N 130.498 4.874 . . . . 66.239999999999995 98.359 175.777 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.3 m -168.06 172.31 8.89 Favored 'General case' 0 C--N 1.284 -2.243 1 O-C-N 131.924 5.765 . . . . 54.710000000000001 106.681 -174.641 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.31 -38.72 74.47 Favored 'General case' 0 C--N 1.301 -1.5 0 CA-C-O 125.461 2.553 . . . . 52.25 116.585 -176.485 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' CYS . . . . . 0.448 ' CA ' ' O ' ' A' ' 216' ' ' HOH . 0.1 OUTLIER -87.92 -18.91 28.11 Favored 'General case' 0 C--O 1.267 2.0 1 C-N-CA 132.391 4.276 . . . . 42.969999999999999 118.701 -171.506 -131.396 75.047 87.787 107.205 2.042 98.857 -142.116 -60.232 4 4 . 1 . 001 ecloud build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 71.6 p -73.31 10.56 0.96 Allowed 'General case' 0 C--O 1.243 0.711 0 CA-C-N 113.5 -1.682 . . . . 35.859999999999999 113.04 -177.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -117.36 -5.82 11.27 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 126.777 2.548 . . . . 58.549999999999997 105.266 178.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LEU . . . . . 0.494 ' O ' ' HA ' ' A' ' 108' ' ' THR . 11.8 mt -67.5 172.52 4.94 Favored 'General case' 0 N--CA 1.512 2.646 0 N-CA-C 101.798 -3.408 . . . . 33.640000000000001 101.798 175.957 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' THR . . . . . 0.404 ' HB ' ' HB3' ' A' ' 106' ' ' GLN . 62.0 p -117.12 156.36 27.75 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 115.045 1.498 . . . . 29.489999999999998 115.045 -178.771 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' VAL . . . . . 0.483 HG21 ' CD2' ' A' ' 112' ' ' PHE . 20.1 m -124.7 151.87 30.45 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.691 1 C-N-CA 133.036 4.535 . . . . 25.699999999999999 107.297 177.592 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 30.7 m -65.9 119.36 11.17 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 104.572 -2.381 . . . . 32.32 104.572 173.191 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ASP . . . . . 0.496 ' HB2' ' OG ' ' A' ' 107' ' ' SER . 44.6 t0 -68.17 81.37 0.23 Allowed 'General case' 0 C--N 1.3 -1.561 1 CA-C-O 111.672 -4.014 . . . . 33.030000000000001 107.11 -178.942 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ILE . . . . . 0.489 HG22 HG13 ' A' ' 101' ' ' VAL . 3.6 pt -65.7 -9.09 7.31 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.82 0 O-C-N 128.119 3.387 . . . . 34.509999999999998 111.93 178.932 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -97.98 35.29 1.75 Allowed 'General case' 0 C--O 1.277 2.535 0 O-C-N 119.515 -1.991 . . . . 46.82 110.675 177.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -117.25 19.89 13.93 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 126.963 2.105 . . . . 50.479999999999997 108.524 -179.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ALA . . . . . 0.664 ' HB2' ' OE2' ' A' ' 103' ' ' GLU . . . -97.72 175.09 6.31 Favored 'General case' 0 C--O 1.257 1.461 0 CA-C-O 124.027 1.87 . . . . 56.68 106.753 176.469 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.4 p -133.21 -39.89 0.92 Allowed 'General case' 0 C--N 1.305 -1.364 1 C-N-CA 134.488 5.115 . . . . 67.510000000000005 107.636 176.212 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LYS . . . . . 0.715 ' HG2' ' N ' ' A' ' 38' ' ' ASN . 0.0 OUTLIER -28.99 -51.75 0.1 Allowed 'General case' 0 C--O 1.25 1.106 1 C-N-CA 135.284 5.433 . . . . 81.709999999999994 116.671 174.89 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ASN . . . . . 0.715 ' N ' ' HG2' ' A' ' 37' ' ' LYS 0.273 7.8 m-20 59.16 124.13 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.333 2 N-CA-C 123.567 4.655 . . . . 76.900000000000006 123.567 174.232 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 39' ' ' THR . . . . . 0.671 ' O ' ' HB ' ' A' ' 40' ' ' THR . 0.8 OUTLIER -94.72 -52.26 4.36 Favored 'General case' 0 N--CA 1.393 -3.319 2 C-N-CA 150.017 11.327 . . . . 68.680000000000007 131.334 -167.483 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 40' ' ' THR . . . . . 0.671 ' HB ' ' O ' ' A' ' 39' ' ' THR . 1.3 t 107.93 135.45 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 124.141 3.155 . . . . 57.359999999999999 106.161 -177.321 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -42.39 -41.57 2.91 Favored 'General case' 0 C--N 1.286 -2.161 0 C-N-CA 128.259 2.624 . . . . 61.530000000000001 116.846 -177.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' LYS . . . . . 0.405 ' HD3' ' HB2' ' A' ' 96' ' ' LEU . 0.0 OUTLIER -63.03 -45.12 93.82 Favored 'General case' 0 C--N 1.289 -2.054 1 C-N-CA 133.037 4.535 . . . . 53.329999999999998 110.846 178.796 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLU . . . . . 0.814 ' O ' ' HG3' ' A' ' 47' ' ' ARG . 23.3 mt-10 -86.95 -18.63 30.3 Favored 'General case' 0 CA--C 1.494 -1.183 0 O-C-N 120.192 -1.567 . . . . 56.200000000000003 109.405 179.882 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 m -62.87 -44.75 95.29 Favored 'General case' 0 C--N 1.291 -1.963 0 C-N-CA 113.806 -3.158 . . . . 33.560000000000002 103.593 177.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' PHE . . . . . 0.633 ' HE1' ' CE ' ' A' ' 120' ' ' MET 0.308 17.9 m-30 -66.36 -38.5 87.71 Favored 'General case' 0 C--O 1.259 1.565 1 O-C-N 130.962 5.164 . . . . 32.969999999999999 111.581 -175.731 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 12.4 t -66.5 -38.61 87.64 Favored 'General case' 0 C--O 1.25 1.109 0 CA-C-O 126.903 3.239 . . . . 32.920000000000002 113.392 177.047 168.916 -93.72 154.212 104.242 2.026 100.668 114.659 -92.537 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ARG . . . . . 0.814 ' HG3' ' O ' ' A' ' 43' ' ' GLU . 9.0 mtm180 -69.3 -40.93 77.41 Favored 'General case' 0 C--O 1.243 0.731 0 CA-C-N 112.171 -2.286 . . . . 55.890000000000001 108.059 -177.463 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.51 -42.15 68.34 Favored 'General case' 0 C--N 1.291 -1.965 0 CA-C-O 122.543 1.163 . . . . 21.969999999999999 109.939 177.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -58.39 -45.65 87.92 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 105.53 -2.026 . . . . 19.949999999999999 105.53 177.411 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . 0.294 24.4 m -61.07 -57.23 13.43 Favored 'General case' 0 C--N 1.305 -1.328 0 N-CA-C 108.787 -0.82 . . . . 21.489999999999998 108.787 178.334 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' VAL . . . . . 0.506 HG11 ' CE2' ' A' ' 112' ' ' PHE 0.363 0.9 OUTLIER -48.76 -43.15 13.86 Favored 'Isoleucine or valine' 0 C--O 1.296 3.509 0 O-C-N 117.193 -3.442 . . . . 23.609999999999999 112.657 -179.883 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -72.34 -33.69 67.5 Favored 'General case' 0 C--N 1.272 -2.776 0 O-C-N 118.856 -2.403 . . . . 21.690000000000001 116.942 174.739 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.23 -38.42 85.2 Favored 'General case' 0 N--CA 1.482 1.15 1 CA-C-O 129.935 4.684 . . . . 48.990000000000002 103.282 178.719 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLN . . . . . 0.627 ' O ' ' ND1' ' A' ' 58' ' ' HIS . 1.6 mt-30 -56.24 -55.71 29.94 Favored 'General case' 0 C--O 1.206 -1.186 1 O-C-N 113.08 -6.013 . . . . 49.289999999999999 110.522 -177.204 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 39.2 t80 -56.82 -70.6 0.12 Allowed 'General case' 0 C--N 1.3 -1.564 1 CA-C-N 108.172 -4.104 . . . . 23.969999999999999 113.779 -175.902 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 7.4 p90 -53.41 -35.25 60.21 Favored 'General case' 0 C--O 1.251 1.172 0 C-N-CA 113.994 -3.082 . . . . 29.18 109.73 -178.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . 0.379 88.4 p -65.24 -43.44 91.39 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-O 117.09 -1.433 . . . . 38.479999999999997 108.962 -176.185 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' HIS . . . . . 0.627 ' ND1' ' O ' ' A' ' 54' ' ' GLN . 45.4 m80 -73.54 -15.91 61.28 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-O 116.664 -1.636 . . . . 50.219999999999999 113.545 175.451 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' HIS . . . . . 0.498 ' O ' ' HE1' ' A' ' 76' ' ' HIS . 90.2 m-70 -128.34 9.11 6.08 Favored 'General case' 0 C--O 1.259 1.585 0 N-CA-C 117.066 2.247 . . . . 27.609999999999999 117.066 -177.705 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLU . . . . . 1.178 ' O ' ' HD3' ' A' ' 61' ' ' LYS . 4.6 tt0 -56.48 -38.18 71.37 Favored 'General case' 0 N--CA 1.501 2.114 0 CA-C-O 122.324 1.059 . . . . 42.159999999999997 109.613 177.801 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' LYS . . . . . 1.178 ' HD3' ' O ' ' A' ' 60' ' ' GLU . 6.5 mmtt -130.76 53.82 1.94 Allowed 'General case' 0 C--N 1.314 -0.956 0 C-N-CA 119.146 -1.021 . . . . 51.130000000000003 112.479 -178.033 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ASP . . . . . 0.669 ' OD2' ' NH1' ' A' ' 64' ' ' ARG . 64.5 t0 -96.31 126.2 41.35 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 106.624 -1.621 . . . . 26.670000000000002 106.624 -175.572 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 28.3 m -52.56 -36.0 54.94 Favored 'General case' 0 C--N 1.285 -2.228 0 CA-C-O 112.878 -3.439 . . . . 32.43 106.86 -178.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ARG . . . . . 0.669 ' NH1' ' OD2' ' A' ' 62' ' ' ASP 0.337 0.0 OUTLIER -68.41 -15.03 63.41 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-O 115.379 -2.248 . . . . 30.59 111.499 -175.146 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 81.4 m -109.05 -31.35 7.65 Favored 'General case' 0 CA--C 1.463 -2.371 1 N-CA-C 122.351 4.204 . . . . 32.119999999999997 122.351 -174.868 -60.232 -142.116 87.787 98.857 2.042 107.205 75.047 -131.396 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' LEU . . . . . 0.798 HD21 ' HD2' ' A' ' 61' ' ' LYS . 59.1 mt -47.25 -35.13 7.3 Favored 'General case' 0 CA--C 1.49 -1.33 0 CA-C-O 116.148 -1.882 . . . . 20.5 115.757 -177.861 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLY . . . . . 0.72 ' HA3' ' HB3' ' A' ' 72' ' ' GLN . . . 86.99 156.13 28.84 Favored Glycine 0 CA--C 1.548 2.133 0 N-CA-C 105.791 -2.924 . . . . 22.859999999999999 105.791 -179.307 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -92.01 -56.99 2.87 Favored 'General case' 0 C--N 1.272 -2.766 1 C-N-CA 140.36 7.464 . . . . 21.780000000000001 112.412 177.424 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 57.6 p -76.99 168.27 20.38 Favored 'General case' 0 CA--C 1.553 1.069 0 O-C-N 127.431 2.957 . . . . 24.16 107.586 -179.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -83.6 -15.38 49.27 Favored 'General case' 0 C--O 1.254 1.337 0 O-C-N 126.145 2.153 . . . . 32.140000000000001 107.549 175.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' GLN . . . . . 0.749 ' HG2' ' N ' ' A' ' 72' ' ' GLN . 0.8 OUTLIER -70.4 -45.8 65.23 Favored 'General case' 0 C--O 1.19 -2.042 0 N-CA-C 104.229 -2.508 . . . . 44.729999999999997 104.229 173.889 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLN . . . . . 0.749 ' N ' ' HG2' ' A' ' 71' ' ' GLN . 37.9 mt-30 -66.09 -39.84 90.3 Favored 'General case' 0 N--CA 1.439 -0.999 0 CA-C-N 113.111 -1.859 . . . . 36.509999999999998 114.34 -175.765 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -68.49 -40.93 80.72 Favored 'General case' 0 C--N 1.299 -1.609 0 CA-C-O 123.609 1.671 . . . . 25.460000000000001 110.302 -179.167 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 36.6 t-80 -60.6 -47.37 86.51 Favored 'General case' 0 N--CA 1.437 -1.096 0 C-N-CA 127.254 2.222 . . . . 52.530000000000001 111.774 -179.993 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ARG . . . . . 0.406 ' HG3' ' O ' ' A' ' 71' ' ' GLN . 53.1 mtm180 -65.31 -38.12 89.2 Favored 'General case' 0 C--O 1.274 2.35 0 N-CA-C 106.966 -1.494 . . . . 54.509999999999998 106.966 179.277 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' HIS . . . . . 0.566 ' CD2' HD23 ' A' ' 66' ' ' LEU . 86.3 t60 -63.95 -47.35 80.77 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 116.283 -1.818 . . . . 23.210000000000001 112.242 -178.571 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 6.6 mtmt -58.73 -40.42 83.71 Favored 'General case' 0 C--N 1.28 -2.439 0 O-C-N 127.334 2.896 . . . . 42.210000000000001 108.37 178.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 6.0 mt-30 -66.58 -47.54 72.43 Favored 'General case' 0 C--N 1.31 -1.13 0 C-N-CA 126.496 1.918 . . . . 51.240000000000002 111.262 179.166 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LEU . . . . . 0.4 HD23 ' OE1' ' A' ' 20' ' ' GLN . 1.3 tm? -52.68 -44.45 66.25 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 126.449 2.343 . . . . 22.16 109.633 179.376 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ILE . . . . . 0.731 ' O ' ' HG3' ' A' ' 84' ' ' LYS . 4.2 mm -74.99 -33.67 30.14 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.761 0 C-N-CA 125.391 1.477 . . . . 23.57 113.622 -177.385 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 17.4 tpp180 -64.26 -46.86 81.85 Favored 'General case' 0 C--O 1.206 -1.212 0 N-CA-C 105.501 -2.037 . . . . 63.340000000000003 105.501 -178.078 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -68.07 -54.8 15.62 Favored 'General case' 0 N--CA 1.415 -2.2 1 CA-C-O 111.298 -4.191 . . . . 31.649999999999999 108.523 -176.666 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 83' ' ' LEU . . . . . 0.61 ' O ' ' HB2' ' A' ' 87' ' ' ASP . 0.2 OUTLIER -53.22 -31.01 41.01 Favored 'General case' 0 C--N 1.286 -2.188 0 O-C-N 127.272 2.858 . . . . 18.84 111.822 176.691 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LYS . . . . . 0.731 ' HG3' ' O ' ' A' ' 80' ' ' ILE . 8.8 mttp -85.35 -30.04 24.0 Favored 'General case' 0 N--CA 1.429 -1.483 1 O-C-N 116.075 -4.141 . . . . 28.809999999999999 111.97 -178.266 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.82 -49.95 74.26 Favored 'General case' 0 C--N 1.305 -1.363 1 O-C-N 130.407 4.817 . . . . 47.270000000000003 106.225 170.257 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . 0.302 0.0 OUTLIER -66.58 -36.07 81.74 Favored 'General case' 0 N--CA 1.504 2.245 0 CA-C-O 126.279 2.942 . . . . 18.300000000000001 109.96 176.211 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ASP . . . . . 0.61 ' HB2' ' O ' ' A' ' 83' ' ' LEU . 4.4 t70 -60.94 -53.51 56.39 Favored 'General case' 0 N--CA 1.421 -1.903 0 CA-C-N 113.01 -1.905 . . . . 26.809999999999999 109.334 -175.988 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 55.3 ttp85 -52.12 -50.79 60.98 Favored 'General case' 0 C--N 1.284 -2.249 0 CA-C-O 126.428 3.013 . . . . 42.140000000000001 108.318 177.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . 0.314 56.3 m-20 -64.48 -43.48 94.04 Favored 'General case' 0 C--O 1.28 2.682 0 CA-C-O 113.021 -3.371 . . . . 30.93 111.137 -177.729 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 94.4 mt -64.76 -45.97 84.14 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 123.384 2.811 . . . . 20.129999999999999 108.554 178.578 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -67.73 -18.29 64.85 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-O 114.077 -2.868 . . . . 20.719999999999999 110.997 -177.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -78.56 -31.98 43.53 Favored Glycine 0 C--N 1.298 -1.564 1 O-C-N 130.037 4.585 . . . . 26.219999999999999 112.638 -177.642 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' LEU . . . . . 0.543 HD23 ' CE2' ' A' ' 45' ' ' PHE . 3.1 tp -90.01 -35.88 15.26 Favored 'General case' 0 C--N 1.308 -1.204 1 C-N-CA 132.235 4.214 . . . . 31.010000000000002 105.047 -176.55 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -60.16 -76.98 0.04 OUTLIER 'General case' 0 C--O 1.244 0.796 0 O-C-N 126.945 2.653 . . . . 38.799999999999997 104.316 176.543 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 75.94 31.89 54.52 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 104.924 -3.27 . . . . 48.479999999999997 104.924 177.78 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LEU . . . . . 0.609 HD22 ' H ' ' A' ' 98' ' ' SER . 0.0 OUTLIER -151.33 152.28 32.95 Favored 'General case' 0 C--O 1.257 1.499 1 N-CA-C 98.565 -4.605 . . . . 58.359999999999999 98.565 177.545 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . 0.311 17.8 m120 -129.15 -3.93 5.01 Favored 'General case' 0 C--N 1.303 -1.424 1 O-C-N 129.566 4.291 . . . . 66.650000000000006 106.804 -179.713 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' SER . . . . . 0.609 ' H ' HD22 ' A' ' 96' ' ' LEU . 60.4 p -75.75 107.01 7.63 Favored 'General case' 0 C--O 1.278 2.585 0 N-CA-C 117.011 2.226 . . . . 65.879999999999995 117.011 179.189 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 99' ' ' CYS . . . . . 0.467 ' SG ' ' O ' ' A' ' 98' ' ' SER 0.462 1.5 m -132.77 117.85 15.31 Favored Pre-proline 0 CA--C 1.492 -1.261 1 N-CA-C 122.95 4.426 . . . . 61.140000000000001 122.95 178.478 -92.537 114.659 154.212 100.668 2.026 104.242 -93.72 168.916 4 3 . 1 . 001 ecloud build full ' A' A ' 100' ' ' PRO . . . . . 0.652 ' O ' ' NZ ' ' A' ' 102' ' ' LYS . 0.5 OUTLIER -101.36 61.97 0.04 OUTLIER 'Trans proline' 0 C--O 1.26 1.58 1 C-N-CA 126.234 4.623 . . . . 62.479999999999997 113.841 -178.694 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 101' ' ' VAL . . . . . 0.489 HG13 HG22 ' A' ' 32' ' ' ILE 0.334 27.0 t -58.5 127.2 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.703 0 N-CA-C 103.324 -2.843 . . . . 59.859999999999999 103.324 178.543 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 102' ' ' LYS . . . . . 0.714 ' HB3' ' HZ2' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -125.3 -34.1 2.76 Favored 'General case' 0 C--O 1.247 0.924 0 N-CA-C 116.267 1.951 . . . . 55.590000000000003 116.267 -176.7 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 103' ' ' GLU . . . . . 0.664 ' OE2' ' HB2' ' A' ' 35' ' ' ALA . 1.1 mp0 -45.74 165.63 0.02 OUTLIER 'General case' 0 C--O 1.252 1.228 0 CA-C-O 123.307 1.527 . . . . 57.68 108.814 -179.941 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ALA . . . . . 0.415 ' O ' ' C ' ' A' ' 105' ' ' ASN . . . -118.88 -47.74 2.49 Favored 'General case' 0 C--O 1.256 1.436 0 CA-C-N 112.838 -1.983 . . . . 50.740000000000002 114.969 179.956 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ASN . . . . . 0.897 ' HB3' ' O ' ' A' ' 230' ' ' HOH 0.412 15.5 t30 -63.8 155.63 29.78 Favored 'General case' 0 N--CA 1.493 1.706 1 C-N-CA 108.585 -5.246 . . . . 54.719999999999999 104.45 -176.865 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 106' ' ' GLN . . . . . 0.409 ' HA ' ' O ' ' A' ' 29' ' ' VAL 0.322 14.6 mm-40 -101.07 154.48 18.69 Favored 'General case' 0 N--CA 1.417 -2.103 1 C-N-CA 133.372 4.669 . . . . 47.859999999999999 108.882 175.386 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 107' ' ' SER . . . . . 0.496 ' OG ' ' HB2' ' A' ' 31' ' ' ASP . 0.0 OUTLIER -140.74 145.01 35.86 Favored 'General case' 0 C--N 1.293 -1.862 0 CA-C-O 116.677 -1.63 . . . . 33.649999999999999 107.012 176.821 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 108' ' ' THR . . . . . 0.494 ' HA ' ' O ' ' A' ' 27' ' ' LEU 0.321 68.2 p -57.62 162.71 2.85 Favored 'General case' 0 N--CA 1.508 2.462 0 C-N-CA 115.6 -2.44 . . . . 25.960000000000001 106.857 179.557 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.6 tp -65.46 -40.38 93.12 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 115.779 -2.368 . . . . 19.93 107.897 -179.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -47.72 -39.13 16.83 Favored 'General case' 0 C--O 1.251 1.164 0 C-N-CA 125.596 1.558 . . . . 52.030000000000001 111.285 -178.239 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 56.2 m-20 -81.72 -35.37 29.84 Favored 'General case' 0 C--N 1.293 -1.853 0 CA-C-O 117.607 -1.187 . . . . 37.039999999999999 112.624 -179.663 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' PHE . . . . . 0.506 ' CE2' HG11 ' A' ' 51' ' ' VAL . 63.3 t80 -59.43 -50.66 73.08 Favored 'General case' 0 C--N 1.308 -1.223 0 C-N-CA 127.491 2.316 . . . . 26.239999999999998 107.258 177.39 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 61.1 mt -62.74 -42.32 99.62 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-O 115.371 -2.252 . . . . 23.870000000000001 111.227 175.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.54 -45.09 62.85 Favored 'General case' 0 N--CA 1.484 1.24 0 O-C-N 126.271 2.232 . . . . 51.719999999999999 111.91 -179.586 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 1.8 ttm180 -73.12 -42.28 63.07 Favored 'General case' 0 C--N 1.303 -1.416 1 C-N-CA 133.008 4.523 . . . . 48.579999999999998 112.009 179.188 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 116' ' ' LEU . . . . . 0.662 HD13 HD21 ' A' ' 14' ' ' LEU 0.257 0.0 OUTLIER -65.17 -31.61 72.88 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-O 127.127 3.346 . . . . 25.93 103.678 178.462 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . 0.313 72.9 tttt -62.21 -43.82 97.96 Favored 'General case' 0 N--CA 1.499 2.007 0 CA-C-N 111.03 -2.804 . . . . 34.68 107.362 -175.638 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . 0.254 3.2 m -69.04 -57.65 5.15 Favored 'General case' 0 C--O 1.206 -1.194 0 O-C-N 118.752 -2.468 . . . . 25.41 113.92 -177.602 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 36.1 mt -43.12 -45.05 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 N-CA-C 104.619 -2.363 . . . . 21.149999999999999 104.619 173.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' MET . . . . . 0.633 ' CE ' ' HE1' ' A' ' 45' ' ' PHE . 31.7 mmt -75.55 -26.1 57.71 Favored 'General case' 0 C--O 1.255 1.353 1 CA-C-O 110.29 -4.671 . . . . 28.350000000000001 109.34 -178.074 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 121' ' ' ARG . . . . . 0.46 ' O ' ' HB3' ' A' ' 124' ' ' TYR 0.457 0.0 OUTLIER -78.65 -24.43 45.2 Favored 'General case' 0 N--CA 1.509 2.475 1 CA-C-N 126.014 4.006 . . . . 49.729999999999997 111.447 -176.575 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 23.1 tp10 -68.71 -51.44 41.57 Favored 'General case' 0 C--O 1.262 1.738 1 C-N-CA 133.129 4.571 . . . . 41.850000000000001 108.429 172.753 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.0 -38.97 54.48 Favored 'General case' 0 N--CA 1.488 1.437 2 CA-C-N 127.559 4.708 . . . . 39.140000000000001 109.211 176.968 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 124' ' ' TYR . . . . . 0.46 ' HB3' ' O ' ' A' ' 121' ' ' ARG . 15.0 t80 -60.71 -57.78 11.25 Favored 'General case' 0 C--O 1.257 1.481 0 CA-C-N 113.481 -1.69 . . . . 24.120000000000001 112.823 177.514 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 125' ' ' SER . . . . . 0.724 ' O ' ' HB3' ' A' ' 129' ' ' SER . 43.2 m -51.88 -44.49 63.74 Favored 'General case' 0 N--CA 1.486 1.354 0 O-C-N 117.397 -3.314 . . . . 35.93 110.595 175.526 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 126' ' ' LYS . . . . . 0.857 ' HD2' ' O ' ' A' ' 202' ' ' HOH . 33.3 mtpt -62.69 -12.16 21.83 Favored 'General case' 0 C--O 1.257 1.455 0 O-C-N 121.209 -0.932 . . . . 50.57 111.962 178.123 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 82.2 m -101.08 -5.14 26.13 Favored 'General case' 0 C--O 1.267 2.011 0 CA-C-O 118.231 -0.89 . . . . 35.920000000000002 113.264 -179.651 -70.781 -89.601 -81.902 101.983 2.021 109.936 -67.083 -48.987 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 3.6 p -136.6 -32.98 0.81 Allowed 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 118.061 2.615 . . . . 46.460000000000001 118.061 179.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' SER . . . . . 0.724 ' HB3' ' O ' ' A' ' 125' ' ' SER . 27.9 t . . . . . 0 C--O 1.303 3.894 2 C-N-CA 139.221 7.008 . . . . 57.579999999999998 123.797 -172.929 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . 0.857 ' O ' ' HD2' ' A' ' 126' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . 0.448 ' O ' ' CA ' ' A' ' 24' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 230' ' ' HOH . . . . . 0.897 ' O ' ' HB3' ' A' ' 105' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' HIS . . . . . 0.51 ' HB2' HD12 ' A' ' 93' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.504 2.271 0 N-CA-C 105.185 -2.154 . . . . 83.090000000000003 105.185 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.487 ' C ' ' O ' ' A' ' 1' ' ' HIS . 13.1 mtmt -4.55 -78.61 0.0 OUTLIER 'General case' 0 C--O 1.255 1.351 1 CA-C-O 111.36 -4.162 . . . . 66.120000000000005 111.194 179.192 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 25.3 m -102.48 28.88 5.61 Favored 'General case' 0 C--O 1.271 2.209 2 N-CA-C 126.4 5.704 . . . . 43.810000000000002 126.4 -176.513 -48.987 -67.083 -81.902 109.936 2.021 101.983 -89.601 -70.781 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -69.38 160.53 31.16 Favored 'General case' 0 C--N 1.285 -2.216 0 O-C-N 116.85 -3.656 . . . . 38.289999999999999 104.407 175.138 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . 0.278 1.5 pp -64.92 -10.27 8.98 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.193 0 O-C-N 125.285 1.616 . . . . 24.879999999999999 109.287 173.957 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 99.7 m -54.52 -34.3 61.48 Favored 'General case' 0 C--N 1.307 -1.263 0 O-C-N 126.255 2.222 . . . . 26.09 107.096 176.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 62.8 mt -61.52 -42.45 98.84 Favored 'General case' 0 C--N 1.323 -0.581 0 O-C-N 120.97 -1.081 . . . . 28.420000000000002 109.177 177.381 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 34.0 tp60 -65.03 -31.99 73.49 Favored 'General case' 0 N--CA 1.491 1.581 0 C-N-CA 115.533 -2.467 . . . . 26.23 109.726 -176.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 61.7 mm-40 -66.26 -44.69 82.93 Favored 'General case' 0 C--O 1.187 -2.225 0 C-N-CA 125.166 1.386 . . . . 29.539999999999999 110.33 -178.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 46.8 mt -62.49 -44.9 99.75 Favored 'Isoleucine or valine' 0 N--CA 1.425 -1.709 0 CA-C-O 117.238 -1.363 . . . . 18.32 108.926 175.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 83.6 mt -64.34 -51.44 68.23 Favored 'Isoleucine or valine' 0 C--O 1.263 1.81 0 O-C-N 128.743 3.777 . . . . 23.079999999999998 112.662 177.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . 0.271 0.2 OUTLIER -63.0 -19.48 64.38 Favored 'General case' 0 N--CA 1.475 0.782 0 C-N-CA 115.267 -2.573 . . . . 43.700000000000003 113.035 -177.439 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 31.3 m -89.01 -25.35 22.04 Favored 'General case' 0 C--N 1.303 -1.435 0 CA-C-N 120.588 1.54 . . . . 24.690000000000001 108.898 -177.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.662 HD21 HD13 ' A' ' 116' ' ' LEU 0.311 0.5 OUTLIER -72.36 -30.93 65.17 Favored 'General case' 0 N--CA 1.509 2.487 0 CA-C-O 124.648 2.166 . . . . 24.129999999999999 106.331 -177.458 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -78.73 -30.8 46.09 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 117.129 -3.482 . . . . 35.619999999999997 110.064 175.718 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' SER . . . . . 0.573 ' O ' ' HG2' ' A' ' 20' ' ' GLN . 14.6 m -67.2 -21.82 65.76 Favored 'General case' 0 C--N 1.305 -1.355 0 CA-C-O 125.852 2.739 . . . . 34.189999999999998 107.932 -178.705 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -87.23 -37.89 16.84 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 119.576 -1.952 . . . . 34.329999999999998 111.107 -173.226 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' THR . . . . . 0.581 HG23 ' O ' ' A' ' 14' ' ' LEU . 28.6 p -82.2 -8.53 59.65 Favored 'General case' 0 CA--C 1.499 -0.99 0 CA-C-N 113.972 -1.467 . . . . 42.509999999999998 108.792 -176.845 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -84.94 -65.18 1.04 Allowed 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 101.706 -3.442 . . . . 64.540000000000006 101.706 179.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.865 ' O ' ' HG3' ' A' ' 20' ' ' GLN . 3.8 pt20 -72.77 113.98 10.41 Favored 'General case' 0 C--N 1.307 -1.27 0 O-C-N 126.225 2.203 . . . . 67.349999999999994 115.877 -175.412 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 18.3 mmtm -93.13 165.48 12.81 Favored 'General case' 0 C--O 1.25 1.116 3 O-C-N 130.498 4.874 . . . . 66.239999999999995 98.359 175.777 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.3 m -168.06 172.31 8.89 Favored 'General case' 0 C--N 1.284 -2.243 1 O-C-N 131.924 5.765 . . . . 54.710000000000001 106.681 -174.641 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -57.31 -38.72 74.47 Favored 'General case' 0 C--N 1.301 -1.5 0 CA-C-O 125.461 2.553 . . . . 52.25 116.585 -176.485 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.448 ' CA ' ' O ' ' A' ' 216' ' ' HOH . 0.1 OUTLIER -87.92 -18.91 28.11 Favored 'General case' 0 C--O 1.267 2.0 1 C-N-CA 132.391 4.276 . . . . 42.969999999999999 118.701 -171.506 -131.396 75.047 87.787 107.205 2.042 98.857 -142.116 -60.232 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 71.6 p -73.31 10.56 0.96 Allowed 'General case' 0 C--O 1.243 0.711 0 CA-C-N 113.5 -1.682 . . . . 35.859999999999999 113.04 -177.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 19.6 mm-40 -117.36 -5.82 11.27 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 126.777 2.548 . . . . 58.549999999999997 105.266 178.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.494 ' O ' ' HA ' ' A' ' 108' ' ' THR . 11.8 mt -67.5 172.52 4.94 Favored 'General case' 0 N--CA 1.512 2.646 0 N-CA-C 101.798 -3.408 . . . . 33.640000000000001 101.798 175.957 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' THR . . . . . 0.404 ' HB ' ' HB3' ' A' ' 106' ' ' GLN . 62.0 p -117.12 156.36 27.75 Favored 'General case' 0 C--N 1.317 -0.82 0 N-CA-C 115.045 1.498 . . . . 29.489999999999998 115.045 -178.771 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.483 HG21 ' CD2' ' A' ' 112' ' ' PHE . 20.1 m -124.7 151.87 30.45 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.691 1 C-N-CA 133.036 4.535 . . . . 25.699999999999999 107.297 177.592 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 30.7 m -65.9 119.36 11.17 Favored 'General case' 0 C--N 1.315 -0.898 0 N-CA-C 104.572 -2.381 . . . . 32.32 104.572 173.191 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.496 ' HB2' ' OG ' ' A' ' 107' ' ' SER . 44.6 t0 -68.17 81.37 0.23 Allowed 'General case' 0 C--N 1.3 -1.561 1 CA-C-O 111.672 -4.014 . . . . 33.030000000000001 107.11 -178.942 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.489 HG22 HG13 ' A' ' 101' ' ' VAL . 3.6 pt -65.7 -9.09 7.31 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.82 0 O-C-N 128.119 3.387 . . . . 34.509999999999998 111.93 178.932 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -97.98 35.29 1.75 Allowed 'General case' 0 C--O 1.277 2.535 0 O-C-N 119.515 -1.991 . . . . 46.82 110.675 177.509 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -117.25 19.89 13.93 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 126.963 2.105 . . . . 50.479999999999997 108.524 -179.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.664 ' HB2' ' OE2' ' A' ' 103' ' ' GLU . . . -97.72 175.09 6.31 Favored 'General case' 0 C--O 1.257 1.461 0 CA-C-O 124.027 1.87 . . . . 56.68 106.753 176.469 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 1.4 p -133.21 -39.89 0.92 Allowed 'General case' 0 C--N 1.305 -1.364 1 C-N-CA 134.488 5.115 . . . . 67.510000000000005 107.636 176.212 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.715 ' HG2' ' N ' ' A' ' 38' ' ' ASN . 0.0 OUTLIER -28.99 -51.75 0.1 Allowed 'General case' 0 C--O 1.25 1.106 1 C-N-CA 135.284 5.433 . . . . 81.709999999999994 116.671 174.89 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ASN . . . . . 0.715 ' N ' ' HG2' ' A' ' 37' ' ' LYS 0.273 1.0 OUTLIER 59.16 124.13 0.01 OUTLIER 'General case' 0 C--N 1.305 -1.333 2 N-CA-C 123.567 4.655 . . . . 76.900000000000006 123.567 174.232 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' THR . . . . . 0.671 ' O ' ' HB ' ' A' ' 40' ' ' THR . 0.8 OUTLIER -94.72 -52.26 4.36 Favored 'General case' 0 N--CA 1.393 -3.319 2 C-N-CA 150.017 11.327 . . . . 68.680000000000007 131.334 -167.483 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' THR . . . . . 0.671 ' HB ' ' O ' ' A' ' 39' ' ' THR . 1.3 t 107.93 135.45 0.0 OUTLIER 'General case' 0 C--N 1.312 -1.032 0 CA-C-N 124.141 3.155 . . . . 57.359999999999999 106.161 -177.321 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -42.39 -41.57 2.91 Favored 'General case' 0 C--N 1.286 -2.161 0 C-N-CA 128.259 2.624 . . . . 61.530000000000001 116.846 -177.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.405 ' HD3' ' HB2' ' A' ' 96' ' ' LEU . 0.0 OUTLIER -63.03 -45.12 93.82 Favored 'General case' 0 C--N 1.289 -2.054 1 C-N-CA 133.037 4.535 . . . . 53.329999999999998 110.846 178.796 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.814 ' O ' ' HG3' ' A' ' 47' ' ' ARG . 23.3 mt-10 -86.95 -18.63 30.3 Favored 'General case' 0 CA--C 1.494 -1.183 0 O-C-N 120.192 -1.567 . . . . 56.200000000000003 109.405 179.882 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 1.1 m -62.87 -44.75 95.29 Favored 'General case' 0 C--N 1.291 -1.963 0 C-N-CA 113.806 -3.158 . . . . 33.560000000000002 103.593 177.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' PHE . . . . . 0.633 ' HE1' ' CE ' ' A' ' 120' ' ' MET 0.308 17.9 m-30 -66.36 -38.5 87.71 Favored 'General case' 0 C--O 1.259 1.565 1 O-C-N 130.962 5.164 . . . . 32.969999999999999 111.581 -175.731 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 12.4 t -66.5 -38.61 87.64 Favored 'General case' 0 C--O 1.25 1.109 0 CA-C-O 126.903 3.239 . . . . 32.920000000000002 113.392 177.047 168.916 -93.72 154.212 104.242 2.026 100.668 114.659 -92.537 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.814 ' HG3' ' O ' ' A' ' 43' ' ' GLU . 9.0 mtm180 -69.3 -40.93 77.41 Favored 'General case' 0 C--O 1.243 0.731 0 CA-C-N 112.171 -2.286 . . . . 55.890000000000001 108.059 -177.463 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -71.51 -42.15 68.34 Favored 'General case' 0 C--N 1.291 -1.965 0 CA-C-O 122.543 1.163 . . . . 21.969999999999999 109.939 177.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -58.39 -45.65 87.92 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 105.53 -2.026 . . . . 19.949999999999999 105.53 177.411 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . 0.294 24.4 m -61.07 -57.23 13.43 Favored 'General case' 0 C--N 1.305 -1.328 0 N-CA-C 108.787 -0.82 . . . . 21.489999999999998 108.787 178.334 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.506 HG11 ' CE2' ' A' ' 112' ' ' PHE 0.363 0.9 OUTLIER -48.76 -43.15 13.86 Favored 'Isoleucine or valine' 0 C--O 1.296 3.509 0 O-C-N 117.193 -3.442 . . . . 23.609999999999999 112.657 -179.883 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -72.34 -33.69 67.5 Favored 'General case' 0 C--N 1.272 -2.776 0 O-C-N 118.856 -2.403 . . . . 21.690000000000001 116.942 174.739 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.23 -38.42 85.2 Favored 'General case' 0 N--CA 1.482 1.15 1 CA-C-O 129.935 4.684 . . . . 48.990000000000002 103.282 178.719 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLN . . . . . 0.627 ' O ' ' ND1' ' A' ' 58' ' ' HIS . 1.6 mt-30 -56.24 -55.71 29.94 Favored 'General case' 0 C--O 1.206 -1.186 1 O-C-N 113.08 -6.013 . . . . 49.289999999999999 110.522 -177.204 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 39.2 t80 -56.82 -70.6 0.12 Allowed 'General case' 0 C--N 1.3 -1.564 1 CA-C-N 108.172 -4.104 . . . . 23.969999999999999 113.779 -175.902 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 7.4 p90 -53.41 -35.25 60.21 Favored 'General case' 0 C--O 1.251 1.172 0 C-N-CA 113.994 -3.082 . . . . 29.18 109.73 -178.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . 0.379 88.4 p -65.24 -43.44 91.39 Favored 'General case' 0 C--N 1.307 -1.275 0 CA-C-O 117.09 -1.433 . . . . 38.479999999999997 108.962 -176.185 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' HIS . . . . . 0.627 ' ND1' ' O ' ' A' ' 54' ' ' GLN . 45.4 m80 -73.54 -15.91 61.28 Favored 'General case' 0 C--N 1.299 -1.618 0 CA-C-O 116.664 -1.636 . . . . 50.219999999999999 113.545 175.451 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 90.2 m-70 -128.34 9.11 6.08 Favored 'General case' 0 C--O 1.259 1.585 0 N-CA-C 117.066 2.247 . . . . 27.609999999999999 117.066 -177.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLU . . . . . 1.178 ' O ' ' HD3' ' A' ' 61' ' ' LYS . 4.6 tt0 -56.48 -38.18 71.37 Favored 'General case' 0 N--CA 1.501 2.114 0 CA-C-O 122.324 1.059 . . . . 42.159999999999997 109.613 177.801 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' LYS . . . . . 1.178 ' HD3' ' O ' ' A' ' 60' ' ' GLU . 6.5 mmtt -130.76 53.82 1.94 Allowed 'General case' 0 C--N 1.314 -0.956 0 C-N-CA 119.146 -1.021 . . . . 51.130000000000003 112.479 -178.033 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.669 ' OD2' ' NH1' ' A' ' 64' ' ' ARG . 64.5 t0 -96.31 126.2 41.35 Favored 'General case' 0 C--N 1.3 -1.577 0 N-CA-C 106.624 -1.621 . . . . 26.670000000000002 106.624 -175.572 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 28.3 m -52.56 -36.0 54.94 Favored 'General case' 0 C--N 1.285 -2.228 0 CA-C-O 112.878 -3.439 . . . . 32.43 106.86 -178.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ARG . . . . . 0.669 ' NH1' ' OD2' ' A' ' 62' ' ' ASP 0.337 0.0 OUTLIER -68.41 -15.03 63.41 Favored 'General case' 0 C--N 1.294 -1.823 0 CA-C-O 115.379 -2.248 . . . . 30.59 111.499 -175.146 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 81.4 m -109.05 -31.35 7.65 Favored 'General case' 0 CA--C 1.463 -2.371 1 N-CA-C 122.351 4.204 . . . . 32.119999999999997 122.351 -174.868 -60.232 -142.116 87.787 98.857 2.042 107.205 75.047 -131.396 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.798 HD21 ' HD2' ' A' ' 61' ' ' LYS . 59.1 mt -47.25 -35.13 7.3 Favored 'General case' 0 CA--C 1.49 -1.33 0 CA-C-O 116.148 -1.882 . . . . 20.5 115.757 -177.861 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLY . . . . . 0.72 ' HA3' ' HB3' ' A' ' 72' ' ' GLN . . . 86.99 156.13 28.84 Favored Glycine 0 CA--C 1.548 2.133 0 N-CA-C 105.791 -2.924 . . . . 22.859999999999999 105.791 -179.307 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -92.01 -56.99 2.87 Favored 'General case' 0 C--N 1.272 -2.766 1 C-N-CA 140.36 7.464 . . . . 21.780000000000001 112.412 177.424 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 57.6 p -76.99 168.27 20.38 Favored 'General case' 0 CA--C 1.553 1.069 0 O-C-N 127.431 2.957 . . . . 24.16 107.586 -179.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -83.6 -15.38 49.27 Favored 'General case' 0 C--O 1.254 1.337 0 O-C-N 126.145 2.153 . . . . 32.140000000000001 107.549 175.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.749 ' HG2' ' N ' ' A' ' 72' ' ' GLN . 0.8 OUTLIER -70.4 -45.8 65.23 Favored 'General case' 0 C--O 1.19 -2.042 0 N-CA-C 104.229 -2.508 . . . . 44.729999999999997 104.229 173.889 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.749 ' N ' ' HG2' ' A' ' 71' ' ' GLN . 37.9 mt-30 -66.09 -39.84 90.3 Favored 'General case' 0 N--CA 1.439 -0.999 0 CA-C-N 113.111 -1.859 . . . . 36.509999999999998 114.34 -175.765 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -68.49 -40.93 80.72 Favored 'General case' 0 C--N 1.299 -1.609 0 CA-C-O 123.609 1.671 . . . . 25.460000000000001 110.302 -179.167 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 36.6 t-80 -60.6 -47.37 86.51 Favored 'General case' 0 N--CA 1.437 -1.096 0 C-N-CA 127.254 2.222 . . . . 52.530000000000001 111.774 -179.993 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.406 ' HG3' ' O ' ' A' ' 71' ' ' GLN . 53.1 mtm180 -65.31 -38.12 89.2 Favored 'General case' 0 C--O 1.274 2.35 0 N-CA-C 106.966 -1.494 . . . . 54.509999999999998 106.966 179.277 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' HIS . . . . . 0.975 ' HE1' ' O ' ' A' ' 60' ' ' GLU . 28.5 t-80 -63.95 -47.35 80.77 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-O 116.283 -1.818 . . . . 23.210000000000001 112.242 -178.571 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 6.6 mtmt -58.73 -40.42 83.71 Favored 'General case' 0 C--N 1.28 -2.439 0 O-C-N 127.334 2.896 . . . . 42.210000000000001 108.37 178.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -66.58 -47.54 72.43 Favored 'General case' 0 C--N 1.31 -1.13 0 C-N-CA 126.496 1.918 . . . . 51.240000000000002 111.262 179.166 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.551 HD23 ' NE2' ' A' ' 20' ' ' GLN . 1.3 tm? -52.68 -44.45 66.25 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 126.449 2.343 . . . . 22.16 109.633 179.376 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.731 ' O ' ' HG3' ' A' ' 84' ' ' LYS . 4.2 mm -74.99 -33.67 30.14 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.761 0 C-N-CA 125.391 1.477 . . . . 23.57 113.622 -177.385 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 17.4 tpp180 -64.26 -46.86 81.85 Favored 'General case' 0 C--O 1.206 -1.212 0 N-CA-C 105.501 -2.037 . . . . 63.340000000000003 105.501 -178.078 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 12.4 m-85 -68.07 -54.8 15.62 Favored 'General case' 0 N--CA 1.415 -2.2 1 CA-C-O 111.298 -4.191 . . . . 31.649999999999999 108.523 -176.666 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.61 ' O ' ' HB2' ' A' ' 87' ' ' ASP . 0.2 OUTLIER -53.22 -31.01 41.01 Favored 'General case' 0 C--N 1.286 -2.188 0 O-C-N 127.272 2.858 . . . . 18.84 111.822 176.691 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.731 ' HG3' ' O ' ' A' ' 80' ' ' ILE . 8.8 mttp -85.35 -30.04 24.0 Favored 'General case' 0 N--CA 1.429 -1.483 1 O-C-N 116.075 -4.141 . . . . 28.809999999999999 111.97 -178.266 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.82 -49.95 74.26 Favored 'General case' 0 C--N 1.305 -1.363 1 O-C-N 130.407 4.817 . . . . 47.270000000000003 106.225 170.257 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . 0.302 0.0 OUTLIER -66.58 -36.07 81.74 Favored 'General case' 0 N--CA 1.504 2.245 0 CA-C-O 126.279 2.942 . . . . 18.300000000000001 109.96 176.211 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.61 ' HB2' ' O ' ' A' ' 83' ' ' LEU . 4.4 t70 -60.94 -53.51 56.39 Favored 'General case' 0 N--CA 1.421 -1.903 0 CA-C-N 113.01 -1.905 . . . . 26.809999999999999 109.334 -175.988 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 55.3 ttp85 -52.12 -50.79 60.98 Favored 'General case' 0 C--N 1.284 -2.249 0 CA-C-O 126.428 3.013 . . . . 42.140000000000001 108.318 177.807 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . 0.314 56.3 m-20 -64.48 -43.48 94.04 Favored 'General case' 0 C--O 1.28 2.682 0 CA-C-O 113.021 -3.371 . . . . 30.93 111.137 -177.729 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 94.4 mt -64.76 -45.97 84.14 Favored 'General case' 0 C--N 1.31 -1.111 0 CA-C-N 123.384 2.811 . . . . 20.129999999999999 108.554 178.578 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -67.73 -18.29 64.85 Favored 'General case' 0 C--N 1.315 -0.9 0 CA-C-O 114.077 -2.868 . . . . 20.719999999999999 110.997 -177.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -78.56 -31.98 43.53 Favored Glycine 0 C--N 1.298 -1.564 1 O-C-N 130.037 4.585 . . . . 26.219999999999999 112.638 -177.642 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.543 HD23 ' CE2' ' A' ' 45' ' ' PHE . 3.1 tp -90.01 -35.88 15.26 Favored 'General case' 0 C--N 1.308 -1.204 1 C-N-CA 132.235 4.214 . . . . 31.010000000000002 105.047 -176.55 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -60.16 -76.98 0.04 OUTLIER 'General case' 0 C--O 1.244 0.796 0 O-C-N 126.945 2.653 . . . . 38.799999999999997 104.316 176.543 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 75.94 31.89 54.52 Favored Glycine 0 N--CA 1.49 2.29 0 N-CA-C 104.924 -3.27 . . . . 48.479999999999997 104.924 177.78 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LEU . . . . . 0.609 HD22 ' H ' ' A' ' 98' ' ' SER . 0.0 OUTLIER -151.33 152.28 32.95 Favored 'General case' 0 C--O 1.257 1.499 1 N-CA-C 98.565 -4.605 . . . . 58.359999999999999 98.565 177.545 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . 0.311 17.8 m120 -129.15 -3.93 5.01 Favored 'General case' 0 C--N 1.303 -1.424 1 O-C-N 129.566 4.291 . . . . 66.650000000000006 106.804 -179.713 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' SER . . . . . 0.609 ' H ' HD22 ' A' ' 96' ' ' LEU . 60.4 p -75.75 107.01 7.63 Favored 'General case' 0 C--O 1.278 2.585 0 N-CA-C 117.011 2.226 . . . . 65.879999999999995 117.011 179.189 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' CYS . . . . . 0.467 ' SG ' ' O ' ' A' ' 98' ' ' SER 0.462 1.5 m -132.77 117.85 15.31 Favored Pre-proline 0 CA--C 1.492 -1.261 1 N-CA-C 122.95 4.426 . . . . 61.140000000000001 122.95 178.478 -92.537 114.659 154.212 100.668 2.026 104.242 -93.72 168.916 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' PRO . . . . . 0.652 ' O ' ' NZ ' ' A' ' 102' ' ' LYS . 0.5 OUTLIER -101.36 61.97 0.04 OUTLIER 'Trans proline' 0 C--O 1.26 1.58 1 C-N-CA 126.234 4.623 . . . . 62.479999999999997 113.841 -178.694 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.489 HG13 HG22 ' A' ' 32' ' ' ILE 0.334 27.0 t -58.5 127.2 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.703 0 N-CA-C 103.324 -2.843 . . . . 59.859999999999999 103.324 178.543 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' LYS . . . . . 0.714 ' HB3' ' HZ2' ' A' ' 102' ' ' LYS . 0.0 OUTLIER -125.3 -34.1 2.76 Favored 'General case' 0 C--O 1.247 0.924 0 N-CA-C 116.267 1.951 . . . . 55.590000000000003 116.267 -176.7 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.664 ' OE2' ' HB2' ' A' ' 35' ' ' ALA . 1.1 mp0 -45.74 165.63 0.02 OUTLIER 'General case' 0 C--O 1.252 1.228 0 CA-C-O 123.307 1.527 . . . . 57.68 108.814 -179.941 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ALA . . . . . 0.415 ' O ' ' C ' ' A' ' 105' ' ' ASN . . . -118.88 -47.74 2.49 Favored 'General case' 0 C--O 1.256 1.436 0 CA-C-N 112.838 -1.983 . . . . 50.740000000000002 114.969 179.956 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ASN . . . . . 0.897 ' HB3' ' O ' ' A' ' 230' ' ' HOH 0.412 15.5 t30 -63.8 155.63 29.78 Favored 'General case' 0 N--CA 1.493 1.706 1 C-N-CA 108.585 -5.246 . . . . 54.719999999999999 104.45 -176.865 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.409 ' HA ' ' O ' ' A' ' 29' ' ' VAL 0.322 14.6 mm-40 -101.07 154.48 18.69 Favored 'General case' 0 N--CA 1.417 -2.103 1 C-N-CA 133.372 4.669 . . . . 47.859999999999999 108.882 175.386 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' SER . . . . . 0.496 ' OG ' ' HB2' ' A' ' 31' ' ' ASP . 0.0 OUTLIER -140.74 145.01 35.86 Favored 'General case' 0 C--N 1.293 -1.862 0 CA-C-O 116.677 -1.63 . . . . 33.649999999999999 107.012 176.821 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' THR . . . . . 0.494 ' HA ' ' O ' ' A' ' 27' ' ' LEU 0.321 68.2 p -57.62 162.71 2.85 Favored 'General case' 0 N--CA 1.508 2.462 0 C-N-CA 115.6 -2.44 . . . . 25.960000000000001 106.857 179.557 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 4.6 tp -65.46 -40.38 93.12 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 115.779 -2.368 . . . . 19.93 107.897 -179.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -47.72 -39.13 16.83 Favored 'General case' 0 C--O 1.251 1.164 0 C-N-CA 125.596 1.558 . . . . 52.030000000000001 111.285 -178.239 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 56.2 m-20 -81.72 -35.37 29.84 Favored 'General case' 0 C--N 1.293 -1.853 0 CA-C-O 117.607 -1.187 . . . . 37.039999999999999 112.624 -179.663 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' PHE . . . . . 0.506 ' CE2' HG11 ' A' ' 51' ' ' VAL . 63.3 t80 -59.43 -50.66 73.08 Favored 'General case' 0 C--N 1.308 -1.223 0 C-N-CA 127.491 2.316 . . . . 26.239999999999998 107.258 177.39 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 61.1 mt -62.74 -42.32 99.62 Favored 'General case' 0 C--N 1.306 -1.294 0 CA-C-O 115.371 -2.252 . . . . 23.870000000000001 111.227 175.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -51.54 -45.09 62.85 Favored 'General case' 0 N--CA 1.484 1.24 0 O-C-N 126.271 2.232 . . . . 51.719999999999999 111.91 -179.586 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' ARG . . . . . . . . . . . . . 1.8 ttm180 -73.12 -42.28 63.07 Favored 'General case' 0 C--N 1.303 -1.416 1 C-N-CA 133.008 4.523 . . . . 48.579999999999998 112.009 179.188 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.662 HD13 HD21 ' A' ' 14' ' ' LEU 0.257 0.0 OUTLIER -65.17 -31.61 72.88 Favored 'General case' 0 C--N 1.306 -1.321 0 CA-C-O 127.127 3.346 . . . . 25.93 103.678 178.462 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . 0.313 72.9 tttt -62.21 -43.82 97.96 Favored 'General case' 0 N--CA 1.499 2.007 0 CA-C-N 111.03 -2.804 . . . . 34.68 107.362 -175.638 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . 0.254 3.2 m -69.04 -57.65 5.15 Favored 'General case' 0 C--O 1.206 -1.194 0 O-C-N 118.752 -2.468 . . . . 25.41 113.92 -177.602 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 36.1 mt -43.12 -45.05 1.36 Allowed 'Isoleucine or valine' 0 C--N 1.314 -0.946 0 N-CA-C 104.619 -2.363 . . . . 21.149999999999999 104.619 173.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' MET . . . . . 0.633 ' CE ' ' HE1' ' A' ' 45' ' ' PHE . 31.7 mmt -75.55 -26.1 57.71 Favored 'General case' 0 C--O 1.255 1.353 1 CA-C-O 110.29 -4.671 . . . . 28.350000000000001 109.34 -178.074 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.46 ' O ' ' HB3' ' A' ' 124' ' ' TYR 0.457 0.0 OUTLIER -78.65 -24.43 45.2 Favored 'General case' 0 N--CA 1.509 2.475 1 CA-C-N 126.014 4.006 . . . . 49.729999999999997 111.447 -176.575 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 23.1 tp10 -68.71 -51.44 41.57 Favored 'General case' 0 C--O 1.262 1.738 1 C-N-CA 133.129 4.571 . . . . 41.850000000000001 108.429 172.753 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -51.0 -38.97 54.48 Favored 'General case' 0 N--CA 1.488 1.437 2 CA-C-N 127.559 4.708 . . . . 39.140000000000001 109.211 176.968 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' TYR . . . . . 0.46 ' HB3' ' O ' ' A' ' 121' ' ' ARG . 15.0 t80 -60.71 -57.78 11.25 Favored 'General case' 0 C--O 1.257 1.481 0 CA-C-N 113.481 -1.69 . . . . 24.120000000000001 112.823 177.514 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' SER . . . . . 0.724 ' O ' ' HB3' ' A' ' 129' ' ' SER . 43.2 m -51.88 -44.49 63.74 Favored 'General case' 0 N--CA 1.486 1.354 0 O-C-N 117.397 -3.314 . . . . 35.93 110.595 175.526 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.857 ' HD2' ' O ' ' A' ' 202' ' ' HOH . 33.3 mtpt -62.69 -12.16 21.83 Favored 'General case' 0 C--O 1.257 1.455 0 O-C-N 121.209 -0.932 . . . . 50.57 111.962 178.123 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 82.2 m -101.08 -5.14 26.13 Favored 'General case' 0 C--O 1.267 2.011 0 CA-C-O 118.231 -0.89 . . . . 35.920000000000002 113.264 -179.651 -70.781 -89.601 -81.902 101.983 2.021 109.936 -67.083 -48.987 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 3.6 p -136.6 -32.98 0.81 Allowed 'General case' 0 C--N 1.304 -1.378 0 N-CA-C 118.061 2.615 . . . . 46.460000000000001 118.061 179.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' SER . . . . . 0.724 ' HB3' ' O ' ' A' ' 125' ' ' SER . 27.9 t . . . . . 0 C--O 1.303 3.894 2 C-N-CA 139.221 7.008 . . . . 57.579999999999998 123.797 -172.929 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . 0.857 ' O ' ' HD2' ' A' ' 126' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . 0.448 ' O ' ' CA ' ' A' ' 24' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 230' ' ' HOH . . . . . 0.897 ' O ' ' HB3' ' A' ' 105' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_