data_2p2e_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 2p2e _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 ' 3' ' ' LEU . . . . . 0.733 ' N ' ' O ' ' A' ' 138' ' ' HOH . 3.1 mp . . . . . 0 N--CA 1.497 1.877 0 N-CA-C 112.629 0.603 . . . . 17.350000000000001 112.629 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.2 mtmm -131.85 147.97 52.52 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.927 -0.579 . . . . 32.93 111.736 -179.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 35.6 mt -135.48 134.14 52.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.526 -0.761 . . . . 16.300000000000001 111.822 179.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 54.3 m -107.23 126.38 52.34 Favored 'General case' 0 C--O 1.222 -0.379 0 N-CA-C 107.595 -1.261 . . . . 17.469999999999999 107.595 178.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 48.8 t -108.84 119.99 59.41 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 N-CA-C 109.883 -0.414 . . . . 17.98 109.883 179.766 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 63.8 p -62.06 166.86 4.33 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 110.395 -0.224 . . . . 19.309999999999999 110.395 -179.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -61.82 -46.22 90.44 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.238 0.458 . . . . 36.789999999999999 112.238 179.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -61.34 -36.37 79.97 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.345 0.498 . . . . 36.93 112.345 179.447 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.33 -40.23 64.62 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.992 0.425 . . . . 21.309999999999999 111.941 -179.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.7 -42.54 95.23 Favored 'General case' 0 C--O 1.218 -0.568 0 N-CA-C 108.463 -0.94 . . . . 21.780000000000001 108.463 179.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -56.84 -42.92 80.53 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.238 -0.437 . . . . 44.270000000000003 110.395 179.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LYS . . . . . . . . . . . . . 38.3 tttp -69.39 -16.06 63.43 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 112.018 0.377 . . . . 35.549999999999997 112.018 -179.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 42.3 mt -103.54 -3.74 24.87 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 116.227 -0.442 . . . . 24.57 110.997 -179.905 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -52.75 -47.0 67.72 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 114.433 1.272 . . . . 30.120000000000001 114.433 -178.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 43.4 mmm-85 -55.82 -20.43 15.19 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 113.379 0.881 . . . . 37.210000000000001 113.379 -179.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 59.6 m-85 -100.16 -46.16 5.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.673 -0.24 . . . . 22.84 111.246 179.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.0 p -62.09 -20.73 64.33 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 119.637 -0.825 . . . . 21.870000000000001 110.16 179.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -75.1 -12.6 60.35 Favored 'General case' 0 N--CA 1.462 0.164 0 N-CA-C 112.418 0.525 . . . . 24.030000000000001 112.418 179.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ASP . . . . . 0.414 ' O ' ' N ' ' A' ' 24' ' ' ALA . 57.0 t0 -86.82 98.36 11.14 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 121.092 -0.243 . . . . 25.460000000000001 110.566 178.931 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 34.2 m -46.33 -32.09 2.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.024 0.44 . . . . 29.690000000000001 111.583 179.355 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -88.51 9.41 23.9 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 115.544 -0.753 . . . . 34.07 111.91 -178.332 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ALA . . . . . 0.414 ' N ' ' O ' ' A' ' 21' ' ' ASP . . . -106.23 144.41 32.97 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 115.274 1.583 . . . . 27.300000000000001 115.274 -178.744 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 74.2 t -128.76 141.05 47.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-N 114.614 -1.176 . . . . 22.079999999999998 108.677 179.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 78.3 mt -102.18 139.75 37.38 Favored 'General case' 0 CA--C 1.515 -0.396 0 N-CA-C 112.742 0.645 . . . . 20.899999999999999 112.742 -179.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 44.1 mt -127.92 135.59 50.19 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 115.499 -0.773 . . . . 20.120000000000001 111.878 179.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 32.7 tp -100.19 94.9 6.46 Favored 'General case' 0 N--CA 1.449 -0.505 1 N-CA-C 99.845 -4.131 . . . . 21.73 99.845 175.765 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -89.24 142.69 27.43 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 115.953 1.834 . . . . 29.859999999999999 115.953 -177.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -105.53 106.02 16.33 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 100.799 -3.778 . . . . 27.579999999999998 100.799 176.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.7 t0 -69.23 85.29 0.38 Allowed 'General case' 0 CA--C 1.512 -0.515 0 CA-C-N 115.127 -0.942 . . . . 31.030000000000001 113.446 -177.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 22.4 p30 -130.6 6.75 4.79 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.122 0.487 . . . . 30.91 112.298 -178.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 87.02 -8.11 77.77 Favored Glycine 0 N--CA 1.446 -0.695 0 C-N-CA 119.609 -1.281 . . . . 32.780000000000001 113.429 179.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 38.9 t -85.83 133.58 29.26 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 120.237 -0.585 . . . . 32.130000000000003 110.373 179.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 111.68 148.18 10.92 Favored Glycine 0 C--N 1.331 0.252 0 C-N-CA 120.688 -0.768 . . . . 33.57 112.396 179.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.06 -34.05 74.27 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.738 0.304 . . . . 35.740000000000002 110.77 179.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.0 mp -65.43 -25.09 67.37 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 113.959 1.096 . . . . 38.420000000000002 113.959 -178.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.5 t -62.82 -27.72 69.51 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 118.651 -1.22 . . . . 43.009999999999998 108.623 177.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 8.1 mptt -74.8 -6.03 46.74 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 112.324 0.49 . . . . 50.140000000000001 112.324 -179.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 93.2 t -111.99 138.32 41.27 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 N-CA-C 106.651 -1.611 . . . . 46.590000000000003 106.651 178.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 60.13 171.23 0.56 Allowed Glycine 0 CA--C 1.522 0.5 0 N-CA-C 116.365 1.306 . . . . 46.210000000000001 116.365 179.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.9 t -47.6 152.49 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 C-N-CA 125.145 1.378 . . . . 46.979999999999997 114.283 -179.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -150.36 108.44 3.74 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 113.573 0.953 . . . . 52.780000000000001 113.573 -179.742 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' SER . . . . . 0.456 ' O ' ' N ' ' A' ' 46' ' ' ASN . 1.0 OUTLIER -97.7 86.37 3.79 Favored 'General case' 0 C--N 1.32 -0.685 1 N-CA-C 99.399 -4.297 . . . . 46.340000000000003 99.399 178.551 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 37.6 mt -65.75 47.21 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 114.738 1.385 . . . . 43.700000000000003 114.738 -177.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ASN . . . . . 0.456 ' N ' ' O ' ' A' ' 44' ' ' SER . 17.6 p-10 -98.33 25.21 6.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.403 0.621 . . . . 47.18 110.604 179.285 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' SER . . . . . . . . . . . . . 24.9 p 42.15 66.02 0.79 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.518 -0.764 . . . . 41.759999999999998 111.24 -179.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -129.91 162.21 29.11 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.947 -1.024 . . . . 35.909999999999997 110.226 179.033 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 48.5 m-85 -82.17 143.84 31.14 Favored 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 114.123 1.157 . . . . 24.100000000000001 114.123 -179.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 33.9 ptt180 -162.26 156.74 21.98 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.205 -1.035 . . . . 24.34 108.205 178.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 31.6 mm -98.06 128.01 49.91 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.507 0 CA-C-O 120.836 0.35 . . . . 25.829999999999998 111.942 179.242 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 3.9 mp -115.59 141.47 48.02 Favored 'General case' 0 CA--C 1.51 -0.585 0 N-CA-C 108.421 -0.955 . . . . 27.640000000000001 108.421 178.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 1.5 p -122.29 125.09 72.36 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.642 0 N-CA-C 106.224 -1.769 . . . . 26.100000000000001 106.224 176.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 35.3 m -125.78 -179.43 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 CA-C-N 114.036 -1.438 . . . . 27.890000000000001 108.33 -179.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 49.0 m -106.24 158.36 16.91 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 107.296 -1.372 . . . . 32.509999999999998 107.296 178.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -66.83 1.41 1.87 Allowed 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 113.089 0.774 . . . . 39.32 113.089 -178.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -97.93 -26.66 14.58 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.761 0.652 . . . . 47.009999999999998 112.761 179.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' MSE . . . . . . . . . . . . . 9.1 mtt -71.16 150.76 45.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.808 0.337 . . . . 54.490000000000002 110.484 -179.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -83.3 86.71 7.01 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 114.3 1.222 . . . . 44.969999999999999 114.3 -178.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 51.7 p90 -111.34 -15.67 13.54 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 108.317 -0.994 . . . . 33.899999999999999 108.317 -179.381 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 31.7 mmmt -59.67 -59.57 5.23 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 115.26 1.578 . . . . 41.799999999999997 115.26 -178.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 48.4 tttm -46.92 -43.7 19.18 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 113.347 0.869 . . . . 40.939999999999998 113.347 -178.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -85.71 -58.14 2.77 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 113.732 1.012 . . . . 32.539999999999999 113.732 -179.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -80.5 73.7 7.41 Favored 'General case' 0 CA--C 1.511 -0.548 0 N-CA-C 104.767 -2.309 . . . . 24.170000000000002 104.767 179.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 21.7 p-10 -87.5 -0.57 57.01 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 118.172 2.656 . . . . 30.100000000000001 118.172 -175.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -126.79 159.58 33.41 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 119.275 -0.97 . . . . 35.090000000000003 111.627 179.031 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' VAL . . . . . . . . . . . . . 18.0 t -120.45 150.57 23.2 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.821 0 N-CA-C 115.361 1.615 . . . . 27.890000000000001 115.361 -177.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 97.9 mt -120.24 126.8 75.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 N-CA-C 104.696 -2.335 . . . . 20.449999999999999 104.696 178.08 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 60.9 m-20 -81.7 144.21 31.32 Favored 'General case' 0 C--O 1.22 -0.496 0 N-CA-C 107.953 -1.129 . . . . 29.02 107.953 179.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -155.62 162.34 40.64 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.859 0.361 . . . . 16.350000000000001 110.389 179.574 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 15.1 p-10 -72.23 -4.87 31.97 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 114.607 1.336 . . . . 20.079999999999998 114.607 -179.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 22.7 pt -119.3 13.14 6.83 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.608 0 C-N-CA 118.502 -1.279 . . . . 16.969999999999999 111.051 177.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 123.09 -167.33 15.34 Favored Glycine 0 N--CA 1.449 -0.483 0 N-CA-C 110.412 -1.075 . . . . 20.84 110.412 -179.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 50.5 mttp -90.41 155.79 18.68 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 114.79 1.404 . . . . 35.469999999999999 114.79 -179.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -129.09 122.29 29.61 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 105.366 -2.087 . . . . 20.57 105.366 177.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 80.0 m-85 -97.84 149.78 21.99 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 108.537 -0.912 . . . . 27.440000000000001 108.537 179.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 26.9 p90 -153.3 158.22 41.28 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.213 0.53 . . . . 20.969999999999999 112.001 179.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 51.2 mtmt -71.15 124.13 23.74 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 107.214 -1.402 . . . . 19.760000000000002 107.214 179.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -37.56 -64.12 0.77 Allowed Glycine 0 N--CA 1.448 -0.505 0 N-CA-C 115.113 0.805 . . . . 20.870000000000001 115.113 -179.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' TYR . . . . . . . . . . . . . 47.0 p90 -46.99 -40.21 14.0 Favored 'General case' 0 C--O 1.22 -0.463 0 N-CA-C 117.221 2.304 . . . . 24.73 117.221 -178.441 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 23.6 p -61.63 -6.9 2.8 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 119.725 -0.79 . . . . 23.34 111.998 -178.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 85.7 tttt -55.98 -27.94 54.94 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.138 -0.69 . . . . 38.090000000000003 109.138 179.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' MSE . . . . . . . . . . . . . 24.4 ptm -68.81 -16.66 63.85 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 115.76 -0.655 . . . . 48.799999999999997 112.096 -178.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -100.29 2.11 42.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 32.43 112.038 -179.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' MSE . . . . . . . . . . . . . 54.6 mtt -106.29 -175.59 2.84 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 113.848 1.055 . . . . 38.880000000000003 113.848 -178.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -123.77 154.58 39.33 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 106.084 -1.821 . . . . 38.219999999999999 106.084 -179.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -67.39 -34.67 77.76 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.853 0.686 . . . . 38.560000000000002 112.853 -179.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 31.9 t30 -127.22 104.84 8.17 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 107.582 -1.266 . . . . 33.219999999999999 107.582 179.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' MSE . . . . . . . . . . . . . 58.8 mtm -113.12 173.89 6.17 Favored 'General case' 0 CA--C 1.502 -0.879 0 N-CA-C 113.476 0.917 . . . . 34.700000000000003 113.476 -178.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -143.61 141.38 30.6 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 115.478 -0.783 . . . . 36.32 112.87 -178.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ILE . . . . . . . . . . . . . 73.6 mt -117.44 119.12 60.8 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 N-CA-C 105.263 -2.125 . . . . 19.690000000000001 105.263 177.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 86.7 p -128.51 179.92 5.39 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.206 -1.035 . . . . 29.59 108.206 -179.962 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 58.8 tp -110.54 127.23 55.11 Favored 'General case' 0 C--N 1.331 -0.229 0 O-C-N 123.507 0.504 . . . . 29.260000000000002 111.23 -179.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -61.88 139.55 58.36 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-O 121.427 0.632 . . . . 34.329999999999998 111.154 179.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 53.3 p -81.98 -24.65 35.34 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.952 -1.022 . . . . 40.950000000000003 110.61 179.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -83.37 -45.46 13.7 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 115.428 1.64 . . . . 48.399999999999999 115.428 -179.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 12.9 p30 -122.38 -179.59 4.24 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 107.345 -1.354 . . . . 38.380000000000003 107.345 -178.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 95.1 p -92.72 15.58 14.2 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.739 0.644 . . . . 31.850000000000001 112.739 -178.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 50.5 mt -88.11 163.31 16.28 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 113.847 1.054 . . . . 31.129999999999999 113.847 -179.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 77.1 mt -90.69 167.08 12.78 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.616 -0.72 . . . . 24.719999999999999 109.398 178.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ARG . . . . . 0.414 ' NH1' ' OE2' ' A' ' 109' ' ' GLU . 33.5 ttm-85 -130.15 140.92 50.72 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.95 -0.759 . . . . 44.57 108.95 179.93 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 36.9 tp -119.01 112.4 19.53 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.612 -0.514 . . . . 24.07 109.612 178.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' THR . . . . . . . . . . . . . 77.8 p -123.87 156.55 36.02 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.548 -0.461 . . . . 24.359999999999999 111.735 179.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -123.32 150.23 16.87 Favored Glycine 0 CA--C 1.522 0.481 0 N-CA-C 111.462 -0.655 . . . . 30.27 111.462 179.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -59.77 -25.86 65.24 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 116.142 1.904 . . . . 39.920000000000002 116.142 -179.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -115.45 -15.74 11.47 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 114.04 1.126 . . . . 44.450000000000003 114.04 -177.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 33.6 m -108.08 -17.62 13.99 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 113.094 0.775 . . . . 37.219999999999999 113.094 -178.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . 80.25 -143.52 25.06 Favored Glycine 0 N--CA 1.448 -0.559 0 N-CA-C 106.723 -2.551 . . . . 35.469999999999999 106.723 -178.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' GLU . . . . . 0.414 ' OE2' ' NH1' ' A' ' 101' ' ' ARG . 26.7 mt-10 -64.67 120.6 12.72 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 117.149 0.475 . . . . 43.899999999999999 110.787 -179.991 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 72.9 mt -97.76 -34.15 11.01 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 106.571 -1.64 . . . . 31.800000000000001 106.571 178.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' MSE . . . . . . . . . . . . . 7.2 tpt -153.77 95.74 2.82 Favored Pre-proline 0 C--O 1.225 -0.236 0 CA-C-N 115.043 -0.98 . . . . 47.439999999999998 110.191 179.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -59.95 -27.18 84.34 Favored 'Trans proline' 0 N--CA 1.47 0.12 0 N-CA-C 117.054 1.905 . . . . 26.75 117.054 -179.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -130.79 86.97 2.43 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.171 -0.677 . . . . 20.829999999999998 109.171 179.447 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' LEU . . . . . . . . . . . . . 33.6 tp -85.32 112.3 20.68 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.743 -0.662 . . . . 19.829999999999998 111.86 -178.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 51.9 p -87.48 169.76 11.94 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 113.359 0.874 . . . . 21.300000000000001 113.359 -178.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 34.2 mt -126.97 128.43 70.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.186 -0.461 . . . . 21.93 110.903 179.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -117.74 124.05 47.52 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.426 0.528 . . . . 41.289999999999999 112.426 -179.833 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -95.5 103.65 15.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.047 -0.524 . . . . 25.170000000000002 110.032 179.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 19.6 m-30 -107.07 19.64 20.14 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 116.198 -0.456 . . . . 32.310000000000002 110.774 179.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' ARG . . . . . . . . . . . . . 87.4 mtm180 -70.15 141.92 52.58 Favored 'General case' 0 C--O 1.239 0.501 0 C-N-CA 120.301 -0.56 . . . . 34.229999999999997 110.33 179.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 36.6 mm-40 . . . . . 0 C--O 1.256 1.441 0 N-CA-C 107.307 -1.368 . . . . 55.090000000000003 107.307 178.726 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' HOH . . . . . 0.733 ' O ' ' N ' ' A' ' 3' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' LEU . . . . . 0.733 ' N ' ' O ' ' A' ' 138' ' ' HOH . 3.1 mp . . . . . 0 N--CA 1.497 1.877 0 N-CA-C 112.629 0.603 . . . . 17.35 112.629 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.2 mtmm -131.85 147.97 52.52 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.927 -0.579 . . . . 32.93 111.736 -179.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ILE . . . . . 0.405 HG13 HG21 ' A' ' 68' ' ' ILE . 35.6 mt -135.48 134.14 52.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.526 -0.761 . . . . 16.3 111.822 179.818 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 54.3 m -107.23 126.38 52.34 Favored 'General case' 0 C--O 1.222 -0.379 0 N-CA-C 107.595 -1.261 . . . . 17.47 107.595 178.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 48.8 t -108.84 119.99 59.41 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 N-CA-C 109.883 -0.414 . . . . 17.98 109.883 179.766 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 63.8 p -62.06 166.86 4.33 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 110.395 -0.224 . . . . 19.31 110.395 -179.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -61.82 -46.22 90.44 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.238 0.458 . . . . 36.79 112.238 179.567 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -61.34 -36.37 79.97 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.345 0.498 . . . . 36.93 112.345 179.447 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.33 -40.23 64.62 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.992 0.425 . . . . 21.31 111.941 -179.606 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.7 -42.54 95.23 Favored 'General case' 0 C--O 1.218 -0.568 0 N-CA-C 108.463 -0.94 . . . . 21.78 108.463 179.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -56.84 -42.92 80.53 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.238 -0.437 . . . . 44.27 110.395 179.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LYS . . . . . 0.475 ' O ' ' HG2' ' A' ' 14' ' ' LYS . 38.3 tttp -69.39 -16.06 63.43 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 112.018 0.377 . . . . 35.55 112.018 -179.73 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 42.3 mt -103.54 -3.74 24.87 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 116.227 -0.442 . . . . 24.57 110.997 -179.905 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -52.75 -47.0 67.72 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 114.433 1.272 . . . . 30.12 114.433 -178.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 43.4 mmm-85 -55.82 -20.43 15.19 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 113.379 0.881 . . . . 37.21 113.379 -179.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 59.6 m-85 -100.16 -46.16 5.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.673 -0.24 . . . . 22.84 111.246 179.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.0 p -62.09 -20.73 64.33 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 119.637 -0.825 . . . . 21.87 110.16 179.411 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -75.1 -12.6 60.35 Favored 'General case' 0 N--CA 1.462 0.164 0 N-CA-C 112.418 0.525 . . . . 24.03 112.418 179.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ASP . . . . . 0.486 ' HB3' ' CB ' ' A' ' 24' ' ' ALA . 57.0 t0 -86.82 98.36 11.14 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 121.092 -0.243 . . . . 25.46 110.566 178.931 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 34.2 m -46.33 -32.09 2.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.024 0.44 . . . . 29.69 111.583 179.355 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -88.51 9.41 23.9 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 115.544 -0.753 . . . . 34.07 111.91 -178.332 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ALA . . . . . 0.486 ' CB ' ' HB3' ' A' ' 21' ' ' ASP . . . -106.23 144.41 32.97 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 115.274 1.583 . . . . 27.3 115.274 -178.744 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 74.2 t -128.76 141.05 47.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-N 114.614 -1.176 . . . . 22.08 108.677 179.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 78.3 mt -102.18 139.75 37.38 Favored 'General case' 0 CA--C 1.515 -0.396 0 N-CA-C 112.742 0.645 . . . . 20.9 112.742 -179.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LEU . . . . . 0.521 ' CD2' ' HB2' ' A' ' 76' ' ' TYR . 44.1 mt -127.92 135.59 50.19 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 115.499 -0.773 . . . . 20.12 111.878 179.365 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 32.7 tp -100.19 94.9 6.46 Favored 'General case' 0 N--CA 1.449 -0.505 1 N-CA-C 99.845 -4.131 . . . . 21.73 99.845 175.765 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ASP . . . . . 0.502 ' HB2' HD22 ' A' ' 52' ' ' LEU . 21.8 t70 -89.24 142.69 27.43 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 115.953 1.834 . . . . 29.86 115.953 -177.294 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -105.53 106.02 16.33 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 100.799 -3.778 . . . . 27.58 100.799 176.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ASP . . . . . 0.417 ' O ' ' HA ' ' A' ' 47' ' ' SER . 28.7 t0 -69.23 85.29 0.38 Allowed 'General case' 0 CA--C 1.512 -0.515 0 CA-C-N 115.127 -0.942 . . . . 31.03 113.446 -177.15 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 22.4 p30 -130.6 6.75 4.79 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.122 0.487 . . . . 30.91 112.298 -178.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 87.02 -8.11 77.77 Favored Glycine 0 N--CA 1.446 -0.695 0 C-N-CA 119.609 -1.281 . . . . 32.78 113.429 179.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' VAL . . . . . 0.424 ' HB ' ' OH ' ' A' ' 80' ' ' TYR . 38.9 t -85.83 133.58 29.26 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 120.237 -0.585 . . . . 32.13 110.373 179.064 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 111.68 148.18 10.92 Favored Glycine 0 C--N 1.331 0.252 0 C-N-CA 120.688 -0.768 . . . . 33.57 112.396 179.594 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.06 -34.05 74.27 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.738 0.304 . . . . 35.74 110.77 179.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LEU . . . . . 0.435 HD12 ' N ' ' A' ' 37' ' ' LEU . 7.0 mp -65.43 -25.09 67.37 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 113.959 1.096 . . . . 38.42 113.959 -178.541 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.5 t -62.82 -27.72 69.51 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 118.651 -1.22 . . . . 43.01 108.623 177.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LYS . . . . . 0.622 ' HD2' ' N ' ' A' ' 39' ' ' LYS . 8.1 mptt -74.8 -6.03 46.74 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 112.324 0.49 . . . . 50.14 112.324 -179.373 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 93.2 t -111.99 138.32 41.27 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 N-CA-C 106.651 -1.611 . . . . 46.59 106.651 178.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 60.13 171.23 0.56 Allowed Glycine 0 CA--C 1.522 0.5 0 N-CA-C 116.365 1.306 . . . . 46.21 116.365 179.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.9 t -47.6 152.49 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 C-N-CA 125.145 1.378 . . . . 46.98 114.283 -179.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -150.36 108.44 3.74 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 113.573 0.953 . . . . 52.78 113.573 -179.742 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -97.7 86.37 3.79 Favored 'General case' 0 C--N 1.32 -0.685 1 N-CA-C 99.399 -4.297 . . . . 46.34 99.399 178.551 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 37.6 mt -65.75 47.21 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 114.738 1.385 . . . . 43.7 114.738 -177.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 17.6 p-10 -98.33 25.21 6.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.403 0.621 . . . . 47.18 110.604 179.285 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' SER . . . . . 0.417 ' HA ' ' O ' ' A' ' 31' ' ' ASP . 24.9 p 42.15 66.02 0.79 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.518 -0.764 . . . . 41.76 111.24 -179.838 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -129.91 162.21 29.11 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.947 -1.024 . . . . 35.91 110.226 179.033 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 48.5 m-85 -82.17 143.84 31.14 Favored 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 114.123 1.157 . . . . 24.1 114.123 -179.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 33.9 ptt180 -162.26 156.74 21.98 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.205 -1.035 . . . . 24.34 108.205 178.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 31.6 mm -98.06 128.01 49.91 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.507 0 CA-C-O 120.836 0.35 . . . . 25.83 111.942 179.242 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' LEU . . . . . 0.502 HD22 ' HB2' ' A' ' 29' ' ' ASP . 3.9 mp -115.59 141.47 48.02 Favored 'General case' 0 CA--C 1.51 -0.585 0 N-CA-C 108.421 -0.955 . . . . 27.64 108.421 178.854 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' VAL . . . . . 0.754 HG13 ' HA ' ' A' ' 118' ' ' ASP . 1.5 p -122.29 125.09 72.36 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.642 0 N-CA-C 106.224 -1.769 . . . . 26.1 106.224 176.952 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 35.3 m -125.78 -179.43 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 CA-C-N 114.036 -1.438 . . . . 27.89 108.33 -179.141 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' SER . . . . . 0.865 ' HB2' ' HE3' ' A' ' 58' ' ' MSE . 49.0 m -106.24 158.36 16.91 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 107.296 -1.372 . . . . 32.51 107.296 178.23 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -66.83 1.41 1.87 Allowed 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 113.089 0.774 . . . . 39.32 113.089 -178.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -97.93 -26.66 14.58 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.761 0.652 . . . . 47.01 112.761 179.378 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' MSE . . . . . 0.88 ' HE2' ' HG2' ' A' ' 121' ' ' GLU . 9.1 mtt -71.16 150.76 45.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.808 0.337 . . . . 54.49 110.484 -179.83 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -83.3 86.71 7.01 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 114.3 1.222 . . . . 44.97 114.3 -178.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' TYR . . . . . 0.426 ' HA ' HD11 ' A' ' 37' ' ' LEU . 51.7 p90 -111.34 -15.67 13.54 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 108.317 -0.994 . . . . 33.9 108.317 -179.381 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' LYS . . . . . 0.4 ' HD2' ' CE1' ' A' ' 60' ' ' TYR . 31.7 mmmt -59.67 -59.57 5.23 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 115.26 1.578 . . . . 41.8 115.26 -178.698 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 48.4 tttm -46.92 -43.7 19.18 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 113.347 0.869 . . . . 40.94 113.347 -178.279 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -85.71 -58.14 2.77 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 113.732 1.012 . . . . 32.54 113.732 -179.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -80.5 73.7 7.41 Favored 'General case' 0 CA--C 1.511 -0.548 0 N-CA-C 104.767 -2.309 . . . . 24.17 104.767 179.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 21.7 p-10 -87.5 -0.57 57.01 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 118.172 2.656 . . . . 30.1 118.172 -175.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -126.79 159.58 33.41 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 119.275 -0.97 . . . . 35.09 111.627 179.031 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' VAL . . . . . 0.502 HG12 ' N ' ' A' ' 68' ' ' ILE . 18.0 t -120.45 150.57 23.2 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.821 0 N-CA-C 115.361 1.615 . . . . 27.89 115.361 -177.588 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ILE . . . . . 0.502 ' N ' HG12 ' A' ' 67' ' ' VAL . 97.9 mt -120.24 126.8 75.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 N-CA-C 104.696 -2.335 . . . . 20.45 104.696 178.08 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 60.9 m-20 -81.7 144.21 31.32 Favored 'General case' 0 C--O 1.22 -0.496 0 N-CA-C 107.953 -1.129 . . . . 29.02 107.953 179.058 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -155.62 162.34 40.64 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.859 0.361 . . . . 16.35 110.389 179.574 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 15.1 p-10 -72.23 -4.87 31.97 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 114.607 1.336 . . . . 20.08 114.607 -179.85 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 22.7 pt -119.3 13.14 6.83 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.608 0 C-N-CA 118.502 -1.279 . . . . 16.97 111.051 177.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 123.09 -167.33 15.34 Favored Glycine 0 N--CA 1.449 -0.483 0 N-CA-C 110.412 -1.075 . . . . 20.84 110.412 -179.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 50.5 mttp -90.41 155.79 18.68 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 114.79 1.404 . . . . 35.47 114.79 -179.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' PHE . . . . . 0.464 ' HB2' ' HB ' ' A' ' 68' ' ' ILE . 14.8 m-85 -129.09 122.29 29.61 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 105.366 -2.087 . . . . 20.57 105.366 177.913 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' TYR . . . . . 0.521 ' HB2' ' CD2' ' A' ' 27' ' ' LEU . 80.0 m-85 -97.84 149.78 21.99 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 108.537 -0.912 . . . . 27.44 108.537 179.21 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 26.9 p90 -153.3 158.22 41.28 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.213 0.53 . . . . 20.97 112.001 179.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 51.2 mtmt -71.15 124.13 23.74 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 107.214 -1.402 . . . . 19.76 107.214 179.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -37.56 -64.12 0.77 Allowed Glycine 0 N--CA 1.448 -0.505 0 N-CA-C 115.113 0.805 . . . . 20.87 115.113 -179.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' TYR . . . . . 0.424 ' OH ' ' HB ' ' A' ' 34' ' ' VAL . 47.0 p90 -46.99 -40.21 14.0 Favored 'General case' 0 C--O 1.22 -0.463 0 N-CA-C 117.221 2.304 . . . . 24.73 117.221 -178.441 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 23.6 p -61.63 -6.9 2.8 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 119.725 -0.79 . . . . 23.34 111.998 -178.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 85.7 tttt -55.98 -27.94 54.94 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.138 -0.69 . . . . 38.09 109.138 179.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' MSE . . . . . . . . . . . . . 24.4 ptm -68.81 -16.66 63.85 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 115.76 -0.655 . . . . 48.8 112.096 -178.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -100.29 2.11 42.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 32.43 112.038 -179.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' MSE . . . . . . . . . . . . . 54.6 mtt -106.29 -175.59 2.84 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 113.848 1.055 . . . . 38.88 113.848 -178.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -123.77 154.58 39.33 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 106.084 -1.821 . . . . 38.22 106.084 -179.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -67.39 -34.67 77.76 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.853 0.686 . . . . 38.56 112.853 -179.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 31.9 t30 -127.22 104.84 8.17 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 107.582 -1.266 . . . . 33.22 107.582 179.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' MSE . . . . . . . . . . . . . 58.8 mtm -113.12 173.89 6.17 Favored 'General case' 0 CA--C 1.502 -0.879 0 N-CA-C 113.476 0.917 . . . . 34.7 113.476 -178.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -143.61 141.38 30.6 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 115.478 -0.783 . . . . 36.32 112.87 -178.656 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ILE . . . . . 0.411 ' HA ' ' O ' ' A' ' 101' ' ' ARG . 73.6 mt -117.44 119.12 60.8 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 N-CA-C 105.263 -2.125 . . . . 19.69 105.263 177.682 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 86.7 p -128.51 179.92 5.39 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.206 -1.035 . . . . 29.59 108.206 -179.962 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 58.8 tp -110.54 127.23 55.11 Favored 'General case' 0 C--N 1.331 -0.229 0 O-C-N 123.507 0.504 . . . . 29.26 111.23 -179.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -61.88 139.55 58.36 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-O 121.427 0.632 . . . . 34.33 111.154 179.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 53.3 p -81.98 -24.65 35.34 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.952 -1.022 . . . . 40.95 110.61 179.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -83.37 -45.46 13.7 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 115.428 1.64 . . . . 48.4 115.428 -179.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ASN . . . . . 0.415 ' OD1' ' HB2' ' A' ' 99' ' ' LEU . 12.9 p30 -122.38 -179.59 4.24 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 107.345 -1.354 . . . . 38.38 107.345 -178.671 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 95.1 p -92.72 15.58 14.2 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.739 0.644 . . . . 31.85 112.739 -178.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' LEU . . . . . 0.492 HD13 ' HB1' ' A' ' 113' ' ' ALA . 50.5 mt -88.11 163.31 16.28 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 113.847 1.054 . . . . 31.13 113.847 -179.304 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 77.1 mt -90.69 167.08 12.78 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.616 -0.72 . . . . 24.72 109.398 178.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ARG . . . . . 0.414 ' NH1' ' OE2' ' A' ' 109' ' ' GLU . 33.5 ttm-85 -130.15 140.92 50.72 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.95 -0.759 . . . . 44.57 108.95 179.93 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' LEU . . . . . 0.469 ' HB3' ' HB3' ' A' ' 111' ' ' MSE . 36.9 tp -119.01 112.4 19.53 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.612 -0.514 . . . . 24.07 109.612 178.995 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' THR . . . . . 0.529 HG22 ' HA ' ' A' ' 109' ' ' GLU . 77.8 p -123.87 156.55 36.02 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.548 -0.461 . . . . 24.36 111.735 179.39 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -123.32 150.23 16.87 Favored Glycine 0 CA--C 1.522 0.481 0 N-CA-C 111.462 -0.655 . . . . 30.27 111.462 179.314 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -59.77 -25.86 65.24 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 116.142 1.904 . . . . 39.92 116.142 -179.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -115.45 -15.74 11.47 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 114.04 1.126 . . . . 44.45 114.04 -177.411 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 33.6 m -108.08 -17.62 13.99 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 113.094 0.775 . . . . 37.22 113.094 -178.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . 80.25 -143.52 25.06 Favored Glycine 0 N--CA 1.448 -0.559 0 N-CA-C 106.723 -2.551 . . . . 35.47 106.723 -178.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' GLU . . . . . 0.529 ' HA ' HG22 ' A' ' 103' ' ' THR . 26.7 mt-10 -64.67 120.6 12.72 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 117.149 0.475 . . . . 43.9 110.787 -179.991 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 72.9 mt -97.76 -34.15 11.01 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 106.571 -1.64 . . . . 31.8 106.571 178.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' MSE . . . . . 0.58 ' HE3' ' O ' ' A' ' 113' ' ' ALA . 7.2 tpt -153.77 95.74 2.82 Favored Pre-proline 0 C--O 1.225 -0.236 0 CA-C-N 115.043 -0.98 . . . . 47.44 110.191 179.955 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -59.95 -27.18 84.34 Favored 'Trans proline' 0 N--CA 1.47 0.12 0 N-CA-C 117.054 1.905 . . . . 26.75 117.054 -179.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ALA . . . . . 0.58 ' O ' ' HE3' ' A' ' 111' ' ' MSE . . . -130.79 86.97 2.43 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.171 -0.677 . . . . 20.83 109.171 179.447 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 114' ' ' LEU . . . . . 0.442 HD22 ' HB2' ' A' ' 102' ' ' LEU . 33.6 tp -85.32 112.3 20.68 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.743 -0.662 . . . . 19.83 111.86 -178.706 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 51.9 p -87.48 169.76 11.94 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 113.359 0.874 . . . . 21.3 113.359 -178.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 34.2 mt -126.97 128.43 70.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.186 -0.461 . . . . 21.93 110.903 179.485 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 2.1 mt-30 -117.74 124.05 47.52 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.426 0.528 . . . . 41.29 112.426 -179.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' ASP . . . . . 0.754 ' HA ' HG13 ' A' ' 53' ' ' VAL . 60.0 t0 -95.5 103.65 15.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.047 -0.524 . . . . 25.17 110.032 179.444 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 19.6 m-30 -107.07 19.64 20.14 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 116.198 -0.456 . . . . 32.31 110.774 179.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' ARG . . . . . 0.706 ' HA ' ' HE1' ' A' ' 58' ' ' MSE . 87.4 mtm180 -70.15 141.92 52.58 Favored 'General case' 0 C--O 1.239 0.501 0 C-N-CA 120.301 -0.56 . . . . 34.23 110.33 179.343 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 121' ' ' GLU . . . . . 0.88 ' HG2' ' HE2' ' A' ' 58' ' ' MSE . 36.6 mm-40 . . . . . 0 C--O 1.256 1.441 0 N-CA-C 107.307 -1.368 . . . . 55.09 107.307 178.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 138' ' ' HOH . . . . . 0.733 ' O ' ' N ' ' A' ' 3' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 155' ' ' HOH . . . . . 0.463 ' O ' ' HB3' ' A' ' 121' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.733 ' N ' ' O ' ' A' ' 138' ' ' HOH . 3.1 mp . . . . . 0 N--CA 1.497 1.877 0 N-CA-C 112.629 0.603 . . . . 17.350000000000001 112.629 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 37.2 mtmm -131.85 147.97 52.52 Favored 'General case' 0 C--N 1.323 -0.563 0 CA-C-N 115.927 -0.579 . . . . 32.93 111.736 -179.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.405 HG13 HG21 ' A' ' 68' ' ' ILE . 35.6 mt -135.48 134.14 52.09 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.419 0 CA-C-N 115.526 -0.761 . . . . 16.300000000000001 111.822 179.818 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 54.3 m -107.23 126.38 52.34 Favored 'General case' 0 C--O 1.222 -0.379 0 N-CA-C 107.595 -1.261 . . . . 17.469999999999999 107.595 178.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 48.8 t -108.84 119.99 59.41 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 N-CA-C 109.883 -0.414 . . . . 17.98 109.883 179.766 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 63.8 p -62.06 166.86 4.33 Favored 'General case' 0 N--CA 1.466 0.356 0 N-CA-C 110.395 -0.224 . . . . 19.309999999999999 110.395 -179.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -61.82 -46.22 90.44 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.238 0.458 . . . . 36.789999999999999 112.238 179.567 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 70.1 m-20 -61.34 -36.37 79.97 Favored 'General case' 0 C--N 1.326 -0.42 0 N-CA-C 112.345 0.498 . . . . 36.93 112.345 179.447 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -73.33 -40.23 64.62 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-O 120.992 0.425 . . . . 21.309999999999999 111.941 -179.606 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.7 -42.54 95.23 Favored 'General case' 0 C--O 1.218 -0.568 0 N-CA-C 108.463 -0.94 . . . . 21.780000000000001 108.463 179.798 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 27.9 tptp -56.84 -42.92 80.53 Favored 'General case' 0 C--N 1.323 -0.544 0 CA-C-N 116.238 -0.437 . . . . 44.270000000000003 110.395 179.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.475 ' HG2' ' O ' ' A' ' 14' ' ' LYS . 38.3 tttp -69.39 -16.06 63.43 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 112.018 0.377 . . . . 35.549999999999997 112.018 -179.73 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 42.3 mt -103.54 -3.74 24.87 Favored 'General case' 0 CA--C 1.511 -0.531 0 CA-C-N 116.227 -0.442 . . . . 24.57 110.997 -179.905 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -52.75 -47.0 67.72 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 114.433 1.272 . . . . 30.120000000000001 114.433 -178.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 43.4 mmm-85 -55.82 -20.43 15.19 Favored 'General case' 0 C--N 1.331 -0.23 0 N-CA-C 113.379 0.881 . . . . 37.210000000000001 113.379 -179.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 59.6 m-85 -100.16 -46.16 5.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.673 -0.24 . . . . 22.84 111.246 179.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.0 p -62.09 -20.73 64.33 Favored 'General case' 0 C--N 1.33 -0.28 0 C-N-CA 119.637 -0.825 . . . . 21.870000000000001 110.16 179.411 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 72.3 m-20 -75.1 -12.6 60.35 Favored 'General case' 0 N--CA 1.462 0.164 0 N-CA-C 112.418 0.525 . . . . 24.030000000000001 112.418 179.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.486 ' HB3' ' CB ' ' A' ' 24' ' ' ALA . 57.0 t0 -86.82 98.36 11.14 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 121.092 -0.243 . . . . 25.460000000000001 110.566 178.931 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 34.2 m -46.33 -32.09 2.96 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 121.024 0.44 . . . . 29.690000000000001 111.583 179.355 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.3 t-20 -88.51 9.41 23.9 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-N 115.544 -0.753 . . . . 34.07 111.91 -178.332 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.486 ' CB ' ' HB3' ' A' ' 21' ' ' ASP . . . -106.23 144.41 32.97 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 115.274 1.583 . . . . 27.300000000000001 115.274 -178.744 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 74.2 t -128.76 141.05 47.61 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.298 0 CA-C-N 114.614 -1.176 . . . . 22.079999999999998 108.677 179.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 78.3 mt -102.18 139.75 37.38 Favored 'General case' 0 CA--C 1.515 -0.396 0 N-CA-C 112.742 0.645 . . . . 20.899999999999999 112.742 -179.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.521 ' CD2' ' HB2' ' A' ' 76' ' ' TYR . 44.1 mt -127.92 135.59 50.19 Favored 'General case' 0 N--CA 1.442 -0.837 0 CA-C-N 115.499 -0.773 . . . . 20.120000000000001 111.878 179.365 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 32.7 tp -100.19 94.9 6.46 Favored 'General case' 0 N--CA 1.449 -0.505 1 N-CA-C 99.845 -4.131 . . . . 21.73 99.845 175.765 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.502 ' HB2' HD22 ' A' ' 52' ' ' LEU . 21.8 t70 -89.24 142.69 27.43 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 115.953 1.834 . . . . 29.859999999999999 115.953 -177.294 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 24.8 t80 -105.53 106.02 16.33 Favored 'General case' 0 N--CA 1.45 -0.471 0 N-CA-C 100.799 -3.778 . . . . 27.579999999999998 100.799 176.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.417 ' O ' ' HA ' ' A' ' 47' ' ' SER . 28.7 t0 -69.23 85.29 0.38 Allowed 'General case' 0 CA--C 1.512 -0.515 0 CA-C-N 115.127 -0.942 . . . . 31.030000000000001 113.446 -177.15 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 22.4 p30 -130.6 6.75 4.79 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.122 0.487 . . . . 30.91 112.298 -178.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 87.02 -8.11 77.77 Favored Glycine 0 N--CA 1.446 -0.695 0 C-N-CA 119.609 -1.281 . . . . 32.780000000000001 113.429 179.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' VAL . . . . . 0.424 ' HB ' ' OH ' ' A' ' 80' ' ' TYR . 38.9 t -85.83 133.58 29.26 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.713 0 C-N-CA 120.237 -0.585 . . . . 32.130000000000003 110.373 179.064 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 111.68 148.18 10.92 Favored Glycine 0 C--N 1.331 0.252 0 C-N-CA 120.688 -0.768 . . . . 33.57 112.396 179.594 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -61.06 -34.05 74.27 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-O 120.738 0.304 . . . . 35.740000000000002 110.77 179.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.435 ' N ' HD12 ' A' ' 37' ' ' LEU . 7.0 mp -65.43 -25.09 67.37 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 113.959 1.096 . . . . 38.420000000000002 113.959 -178.541 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' SER . . . . . . . . . . . . . 20.5 t -62.82 -27.72 69.51 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 118.651 -1.22 . . . . 43.009999999999998 108.623 177.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.622 ' N ' ' HD2' ' A' ' 39' ' ' LYS . 8.1 mptt -74.8 -6.03 46.74 Favored 'General case' 0 C--O 1.242 0.68 0 N-CA-C 112.324 0.49 . . . . 50.140000000000001 112.324 -179.373 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 93.2 t -111.99 138.32 41.27 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 N-CA-C 106.651 -1.611 . . . . 46.590000000000003 106.651 178.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 60.13 171.23 0.56 Allowed Glycine 0 CA--C 1.522 0.5 0 N-CA-C 116.365 1.306 . . . . 46.210000000000001 116.365 179.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.9 t -47.6 152.49 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 C-N-CA 125.145 1.378 . . . . 46.979999999999997 114.283 -179.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -150.36 108.44 3.74 Favored 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 113.573 0.953 . . . . 52.780000000000001 113.573 -179.742 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -97.7 86.37 3.79 Favored 'General case' 0 C--N 1.32 -0.685 1 N-CA-C 99.399 -4.297 . . . . 46.340000000000003 99.399 178.551 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 37.6 mt -65.75 47.21 0.03 OUTLIER 'General case' 0 C--N 1.325 -0.472 0 N-CA-C 114.738 1.385 . . . . 43.700000000000003 114.738 -177.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ASN . . . . . . . . . . . . . 17.6 p-10 -98.33 25.21 6.46 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.403 0.621 . . . . 47.18 110.604 179.285 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' SER . . . . . 0.417 ' HA ' ' O ' ' A' ' 31' ' ' ASP . 24.9 p 42.15 66.02 0.79 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.518 -0.764 . . . . 41.759999999999998 111.24 -179.838 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -129.91 162.21 29.11 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.947 -1.024 . . . . 35.909999999999997 110.226 179.033 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 48.5 m-85 -82.17 143.84 31.14 Favored 'General case' 0 CA--C 1.506 -0.714 0 N-CA-C 114.123 1.157 . . . . 24.100000000000001 114.123 -179.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 33.9 ptt180 -162.26 156.74 21.98 Favored 'General case' 0 C--N 1.322 -0.611 0 N-CA-C 108.205 -1.035 . . . . 24.34 108.205 178.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 31.6 mm -98.06 128.01 49.91 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.507 0 CA-C-O 120.836 0.35 . . . . 25.829999999999998 111.942 179.242 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.502 HD22 ' HB2' ' A' ' 29' ' ' ASP . 3.9 mp -115.59 141.47 48.02 Favored 'General case' 0 CA--C 1.51 -0.585 0 N-CA-C 108.421 -0.955 . . . . 27.640000000000001 108.421 178.854 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.754 HG13 ' HA ' ' A' ' 118' ' ' ASP . 1.5 p -122.29 125.09 72.36 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.642 0 N-CA-C 106.224 -1.769 . . . . 26.100000000000001 106.224 176.952 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 35.3 m -125.78 -179.43 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.649 0 CA-C-N 114.036 -1.438 . . . . 27.890000000000001 108.33 -179.141 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' SER . . . . . 0.865 ' HB2' ' HE3' ' A' ' 58' ' ' MSE . 49.0 m -106.24 158.36 16.91 Favored 'General case' 0 CA--C 1.52 -0.21 0 N-CA-C 107.296 -1.372 . . . . 32.509999999999998 107.296 178.23 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -66.83 1.41 1.87 Allowed 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 113.089 0.774 . . . . 39.32 113.089 -178.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.1 p-10 -97.93 -26.66 14.58 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 112.761 0.652 . . . . 47.009999999999998 112.761 179.378 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' MSE . . . . . 0.88 ' HE2' ' HG2' ' A' ' 121' ' ' GLU . 9.1 mtt -71.16 150.76 45.07 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-O 120.808 0.337 . . . . 54.490000000000002 110.484 -179.83 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -83.3 86.71 7.01 Favored 'General case' 0 C--N 1.326 -0.454 0 N-CA-C 114.3 1.222 . . . . 44.969999999999999 114.3 -178.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' TYR . . . . . 0.426 ' HA ' HD11 ' A' ' 37' ' ' LEU . 51.7 p90 -111.34 -15.67 13.54 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 108.317 -0.994 . . . . 33.899999999999999 108.317 -179.381 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' LYS . . . . . 0.4 ' HD2' ' CE1' ' A' ' 60' ' ' TYR . 31.7 mmmt -59.67 -59.57 5.23 Favored 'General case' 0 C--N 1.321 -0.668 0 N-CA-C 115.26 1.578 . . . . 41.799999999999997 115.26 -178.698 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 48.4 tttm -46.92 -43.7 19.18 Favored 'General case' 0 C--N 1.326 -0.45 0 N-CA-C 113.347 0.869 . . . . 40.939999999999998 113.347 -178.279 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 60.5 m-20 -85.71 -58.14 2.77 Favored 'General case' 0 C--O 1.222 -0.376 0 N-CA-C 113.732 1.012 . . . . 32.539999999999999 113.732 -179.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 96.5 m-85 -80.5 73.7 7.41 Favored 'General case' 0 CA--C 1.511 -0.548 0 N-CA-C 104.767 -2.309 . . . . 24.170000000000002 104.767 179.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 21.7 p-10 -87.5 -0.57 57.01 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 118.172 2.656 . . . . 30.100000000000001 118.172 -175.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 31.5 mt-10 -126.79 159.58 33.41 Favored 'General case' 0 C--N 1.323 -0.551 0 C-N-CA 119.275 -0.97 . . . . 35.090000000000003 111.627 179.031 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' VAL . . . . . 0.502 HG12 ' N ' ' A' ' 68' ' ' ILE . 18.0 t -120.45 150.57 23.2 Favored 'Isoleucine or valine' 0 CA--C 1.504 -0.821 0 N-CA-C 115.361 1.615 . . . . 27.890000000000001 115.361 -177.588 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.502 ' N ' HG12 ' A' ' 67' ' ' VAL . 97.9 mt -120.24 126.8 75.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.493 0 N-CA-C 104.696 -2.335 . . . . 20.449999999999999 104.696 178.08 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 60.9 m-20 -81.7 144.21 31.32 Favored 'General case' 0 C--O 1.22 -0.496 0 N-CA-C 107.953 -1.129 . . . . 29.02 107.953 179.058 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -155.62 162.34 40.64 Favored 'General case' 0 C--N 1.324 -0.507 0 CA-C-O 120.859 0.361 . . . . 16.350000000000001 110.389 179.574 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 15.1 p-10 -72.23 -4.87 31.97 Favored 'General case' 0 N--CA 1.448 -0.568 0 N-CA-C 114.607 1.336 . . . . 20.079999999999998 114.607 -179.85 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 22.7 pt -119.3 13.14 6.83 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.608 0 C-N-CA 118.502 -1.279 . . . . 16.969999999999999 111.051 177.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . 123.09 -167.33 15.34 Favored Glycine 0 N--CA 1.449 -0.483 0 N-CA-C 110.412 -1.075 . . . . 20.84 110.412 -179.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 50.5 mttp -90.41 155.79 18.68 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 114.79 1.404 . . . . 35.469999999999999 114.79 -179.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' PHE . . . . . 0.464 ' HB2' ' HB ' ' A' ' 68' ' ' ILE . 14.8 m-85 -129.09 122.29 29.61 Favored 'General case' 0 CA--C 1.513 -0.464 0 N-CA-C 105.366 -2.087 . . . . 20.57 105.366 177.913 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.521 ' HB2' ' CD2' ' A' ' 27' ' ' LEU . 80.0 m-85 -97.84 149.78 21.99 Favored 'General case' 0 CA--C 1.51 -0.572 0 N-CA-C 108.537 -0.912 . . . . 27.440000000000001 108.537 179.21 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' TYR . . . . . . . . . . . . . 26.9 p90 -153.3 158.22 41.28 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-O 121.213 0.53 . . . . 20.969999999999999 112.001 179.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 51.2 mtmt -71.15 124.13 23.74 Favored 'General case' 0 N--CA 1.449 -0.511 0 N-CA-C 107.214 -1.402 . . . . 19.760000000000002 107.214 179.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . -37.56 -64.12 0.77 Allowed Glycine 0 N--CA 1.448 -0.505 0 N-CA-C 115.113 0.805 . . . . 20.870000000000001 115.113 -179.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' TYR . . . . . 0.424 ' OH ' ' HB ' ' A' ' 34' ' ' VAL . 47.0 p90 -46.99 -40.21 14.0 Favored 'General case' 0 C--O 1.22 -0.463 0 N-CA-C 117.221 2.304 . . . . 24.73 117.221 -178.441 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 23.6 p -61.63 -6.9 2.8 Favored 'General case' 0 C--N 1.324 -0.538 0 C-N-CA 119.725 -0.79 . . . . 23.34 111.998 -178.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 85.7 tttt -55.98 -27.94 54.94 Favored 'General case' 0 C--N 1.324 -0.54 0 N-CA-C 109.138 -0.69 . . . . 38.090000000000003 109.138 179.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' MSE . . . . . . . . . . . . . 24.4 ptm -68.81 -16.66 63.85 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 115.76 -0.655 . . . . 48.799999999999997 112.096 -178.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -100.29 2.11 42.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.205 -0.452 . . . . 32.43 112.038 -179.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' MSE . . . . . . . . . . . . . 54.6 mtt -106.29 -175.59 2.84 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 113.848 1.055 . . . . 38.880000000000003 113.848 -178.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 1.4 t70 -123.77 154.58 39.33 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 106.084 -1.821 . . . . 38.219999999999999 106.084 -179.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -67.39 -34.67 77.76 Favored 'General case' 0 C--N 1.327 -0.406 0 N-CA-C 112.853 0.686 . . . . 38.560000000000002 112.853 -179.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 31.9 t30 -127.22 104.84 8.17 Favored 'General case' 0 N--CA 1.442 -0.827 0 N-CA-C 107.582 -1.266 . . . . 33.219999999999999 107.582 179.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' MSE . . . . . . . . . . . . . 58.8 mtm -113.12 173.89 6.17 Favored 'General case' 0 CA--C 1.502 -0.879 0 N-CA-C 113.476 0.917 . . . . 34.700000000000003 113.476 -178.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -143.61 141.38 30.6 Favored 'General case' 0 N--CA 1.443 -0.81 0 CA-C-N 115.478 -0.783 . . . . 36.32 112.87 -178.656 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ILE . . . . . 0.411 ' HA ' ' O ' ' A' ' 101' ' ' ARG . 73.6 mt -117.44 119.12 60.8 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 N-CA-C 105.263 -2.125 . . . . 19.690000000000001 105.263 177.682 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 86.7 p -128.51 179.92 5.39 Favored 'General case' 0 C--N 1.323 -0.57 0 N-CA-C 108.206 -1.035 . . . . 29.59 108.206 -179.962 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 58.8 tp -110.54 127.23 55.11 Favored 'General case' 0 C--N 1.331 -0.229 0 O-C-N 123.507 0.504 . . . . 29.260000000000002 111.23 -179.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ASN . . . . . . . . . . . . . 81.2 m-20 -61.88 139.55 58.36 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-O 121.427 0.632 . . . . 34.329999999999998 111.154 179.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 53.3 p -81.98 -24.65 35.34 Favored 'General case' 0 C--N 1.326 -0.437 0 CA-C-N 114.952 -1.022 . . . . 40.950000000000003 110.61 179.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ASN . . . . . . . . . . . . . 82.7 m-20 -83.37 -45.46 13.7 Favored 'General case' 0 N--CA 1.467 0.41 0 N-CA-C 115.428 1.64 . . . . 48.399999999999999 115.428 -179.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ASN . . . . . 0.415 ' OD1' ' HB2' ' A' ' 99' ' ' LEU . 12.9 p30 -122.38 -179.59 4.24 Favored 'General case' 0 C--N 1.325 -0.464 0 N-CA-C 107.345 -1.354 . . . . 38.380000000000003 107.345 -178.671 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 95.1 p -92.72 15.58 14.2 Favored 'General case' 0 C--N 1.326 -0.427 0 N-CA-C 112.739 0.644 . . . . 31.850000000000001 112.739 -178.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.492 HD13 ' HB1' ' A' ' 113' ' ' ALA . 50.5 mt -88.11 163.31 16.28 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 113.847 1.054 . . . . 31.129999999999999 113.847 -179.304 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 77.1 mt -90.69 167.08 12.78 Favored 'General case' 0 N--CA 1.446 -0.655 0 CA-C-N 115.616 -0.72 . . . . 24.719999999999999 109.398 178.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.414 ' NH1' ' OE2' ' A' ' 109' ' ' GLU . 33.5 ttm-85 -130.15 140.92 50.72 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 108.95 -0.759 . . . . 44.57 108.95 179.93 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' LEU . . . . . 0.469 ' HB3' ' HB3' ' A' ' 111' ' ' MSE . 36.9 tp -119.01 112.4 19.53 Favored 'General case' 0 C--N 1.323 -0.544 0 N-CA-C 109.612 -0.514 . . . . 24.07 109.612 178.995 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' THR . . . . . 0.529 HG22 ' HA ' ' A' ' 109' ' ' GLU . 77.8 p -123.87 156.55 36.02 Favored 'General case' 0 C--N 1.328 -0.331 0 C-N-CA 120.548 -0.461 . . . . 24.359999999999999 111.735 179.39 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . -123.32 150.23 16.87 Favored Glycine 0 CA--C 1.522 0.481 0 N-CA-C 111.462 -0.655 . . . . 30.27 111.462 179.314 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 78.3 m-20 -59.77 -25.86 65.24 Favored 'General case' 0 N--CA 1.467 0.399 0 N-CA-C 116.142 1.904 . . . . 39.920000000000002 116.142 -179.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -115.45 -15.74 11.47 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 114.04 1.126 . . . . 44.450000000000003 114.04 -177.411 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 33.6 m -108.08 -17.62 13.99 Favored 'General case' 0 C--N 1.329 -0.311 0 N-CA-C 113.094 0.775 . . . . 37.219999999999999 113.094 -178.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' GLY . . . . . . . . . . . . . . . 80.25 -143.52 25.06 Favored Glycine 0 N--CA 1.448 -0.559 0 N-CA-C 106.723 -2.551 . . . . 35.469999999999999 106.723 -178.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.529 ' HA ' HG22 ' A' ' 103' ' ' THR . 26.7 mt-10 -64.67 120.6 12.72 Favored 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 117.149 0.475 . . . . 43.899999999999999 110.787 -179.991 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 72.9 mt -97.76 -34.15 11.01 Favored 'General case' 0 CA--C 1.513 -0.443 0 N-CA-C 106.571 -1.64 . . . . 31.800000000000001 106.571 178.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' MSE . . . . . 0.58 ' HE3' ' O ' ' A' ' 113' ' ' ALA . 7.2 tpt -153.77 95.74 2.82 Favored Pre-proline 0 C--O 1.225 -0.236 0 CA-C-N 115.043 -0.98 . . . . 47.439999999999998 110.191 179.955 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -59.95 -27.18 84.34 Favored 'Trans proline' 0 N--CA 1.47 0.12 0 N-CA-C 117.054 1.905 . . . . 26.75 117.054 -179.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ALA . . . . . 0.58 ' O ' ' HE3' ' A' ' 111' ' ' MSE . . . -130.79 86.97 2.43 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 109.171 -0.677 . . . . 20.829999999999998 109.171 179.447 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' LEU . . . . . 0.442 HD22 ' HB2' ' A' ' 102' ' ' LEU . 33.6 tp -85.32 112.3 20.68 Favored 'General case' 0 C--N 1.323 -0.561 0 CA-C-N 115.743 -0.662 . . . . 19.829999999999998 111.86 -178.706 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 51.9 p -87.48 169.76 11.94 Favored 'General case' 0 CA--C 1.512 -0.49 0 N-CA-C 113.359 0.874 . . . . 21.300000000000001 113.359 -178.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' ILE . . . . . . . . . . . . . 34.2 mt -126.97 128.43 70.69 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 CA-C-N 116.186 -0.461 . . . . 21.93 110.903 179.485 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' GLN . . . . . 0.401 HE21 ' HB3' ' A' ' 117' ' ' GLN . 0.0 OUTLIER -117.74 124.05 47.52 Favored 'General case' 0 C--N 1.323 -0.547 0 N-CA-C 112.426 0.528 . . . . 41.289999999999999 112.426 -179.833 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' ASP . . . . . 0.754 ' HA ' HG13 ' A' ' 53' ' ' VAL . 60.0 t0 -95.5 103.65 15.52 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.047 -0.524 . . . . 25.170000000000002 110.032 179.444 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 19.6 m-30 -107.07 19.64 20.14 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 116.198 -0.456 . . . . 32.310000000000002 110.774 179.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' ARG . . . . . 0.706 ' HA ' ' HE1' ' A' ' 58' ' ' MSE . 87.4 mtm180 -70.15 141.92 52.58 Favored 'General case' 0 C--O 1.239 0.501 0 C-N-CA 120.301 -0.56 . . . . 34.229999999999997 110.33 179.343 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' GLU . . . . . 0.88 ' HG2' ' HE2' ' A' ' 58' ' ' MSE . 36.6 mm-40 . . . . . 0 C--O 1.256 1.441 0 N-CA-C 107.307 -1.368 . . . . 55.090000000000003 107.307 178.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' HOH . . . . . 0.733 ' O ' ' N ' ' A' ' 3' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' HOH . . . . . 0.463 ' O ' ' HB3' ' A' ' 121' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_