data_6jxq_residue ############################ # Computer software used # ############################ save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 6jxq _Structure_validation_residue.Date_analyzed 2019-05-10 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 ' 19' ' ' LYS . . . . . . . . . . . . . 44.3 tttp . . . . . 0 C--O 1.24 0.587 0 N-CA-C 108.774 -0.824 . . . . 76.15 108.774 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 67.5 t -105.39 111.86 36.48 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.247 0 N-CA-C 106.857 -1.534 . . . . 49.01 106.857 175.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -77.44 148.77 35.25 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-O 121.679 0.752 . . . . 50.79 109.868 -175.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -77.45 157.52 46.22 Favored Glycine 0 N--CA 1.438 -1.218 0 C-N-CA 120.053 -1.07 . . . . 42.56 111.853 156.534 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 65.4 ttp85 -56.32 -55.31 35.0 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 114.738 -0.731 . . . . 58.48 111.115 -175.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 77.0 m -69.56 -33.56 72.92 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 118.597 -1.241 . . . . 50.86 111.692 -179.747 -63.67 -61.143 -66.838 102.502 2.017 105.427 -59.568 -51.747 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 72.2 tt0 -59.04 -46.23 88.76 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 119.59 -0.844 . . . . 52.8 110.525 176.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 65.5 tp -67.38 -42.34 83.55 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 119.979 -0.688 . . . . 49.09 111.591 179.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -54.39 -43.77 71.7 Favored 'General case' 0 CA--C 1.519 -0.237 0 C-N-CA 119.537 -0.865 . . . . 45.39 110.446 177.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.44 -39.93 81.32 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 119.741 -0.784 . . . . 52.44 110.946 -176.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.96 -40.63 95.28 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.42 -0.512 . . . . 49.37 110.989 178.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 38.2 mtt -64.27 -44.15 92.61 Favored 'General case' 0 CA--C 1.51 -0.58 0 C-N-CA 119.97 -0.692 . . . . 43.9 111.217 177.827 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -57.8 -46.92 83.95 Favored 'General case' 0 C--O 1.238 0.457 0 O-C-N 121.934 -0.479 . . . . 97.16 111.32 176.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ARG . . . . . 0.513 ' NH1' ' O ' ' A' ' 302' ' ' HOH . 58.9 ttp85 -62.34 -32.8 73.63 Favored 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 119.454 -0.898 . . . . 77.52 111.291 -178.452 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 44.3 m80 -87.03 5.78 35.76 Favored 'General case' 0 C--N 1.327 -0.374 0 O-C-N 121.886 -0.509 . . . . 65.87 111.639 -179.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 93.44 22.92 25.48 Favored Glycine 0 C--O 1.245 0.792 0 N-CA-C 115.967 1.147 . . . . 60.18 115.967 165.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 24.1 mt -90.36 -18.37 25.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 118.331 1.066 . . . . 50.09 113.866 -176.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -62.74 121.19 12.8 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 119.64 1.109 . . . . 66.69 109.352 -179.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 72.3 m-20 58.72 22.74 10.33 Favored 'General case' 0 C--O 1.246 0.881 0 N-CA-C 114.216 1.191 . . . . 70.05 114.216 -174.008 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -67.24 121.05 14.82 Favored 'General case' 0 C--O 1.235 0.31 0 O-C-N 121.098 -1.001 . . . . 58.03 108.779 175.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 7.7 mmm180 54.63 28.95 10.66 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 123.41 0.684 . . . . 82.64 111.592 -173.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 91.34 1.43 71.98 Favored Glycine 0 C--O 1.241 0.56 0 N-CA-C 115.615 1.006 . . . . 43.86 115.615 173.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 83.1 m-85 -96.5 114.9 26.6 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 118.255 1.027 . . . . 41.86 109.944 -179.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 91.0 p -63.57 162.56 12.68 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 121.893 0.854 . . . . 50.93 110.359 -179.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 17.6 tp -57.77 -38.36 75.3 Favored 'General case' 0 C--O 1.243 0.738 0 CA-C-N 115.038 -0.983 . . . . 48.04 111.944 -174.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -59.78 -31.04 70.55 Favored Glycine 0 CA--C 1.522 0.479 0 C-N-CA 118.994 -1.574 . . . . 35.5 113.821 -177.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 64.2 m-80 -58.7 -46.45 87.26 Favored 'General case' 0 N--CA 1.468 0.43 0 O-C-N 121.249 -1.148 . . . . 45.69 111.54 174.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -66.3 -41.84 89.19 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 115.917 -0.583 . . . . 44.63 110.362 -176.608 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 81.8 t -64.89 -46.87 90.5 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.255 0 CA-C-O 120.916 0.388 . . . . 44.04 110.711 178.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 43.6 t -55.03 -45.54 75.21 Favored 'General case' 0 N--CA 1.442 -0.852 0 C-N-CA 120.376 -0.529 . . . . 34.68 110.699 176.508 -172.912 -91.981 -93.159 102.833 2.012 104.162 -75.726 -59.511 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -63.7 -42.78 97.91 Favored 'General case' 0 CA--C 1.513 -0.458 0 C-N-CA 120.075 -0.65 . . . . 39.29 110.703 -177.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.89 -38.11 87.9 Favored 'General case' 0 CA--C 1.517 -0.3 0 C-N-CA 119.237 -0.985 . . . . 39.58 110.664 -179.613 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 46.5 tptt -56.26 -48.33 76.78 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.996 0.903 . . . . 64.26 110.919 178.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -87.56 -20.63 26.18 Favored 'General case' 0 C--N 1.308 -1.208 0 C-N-CA 119.201 -1.0 . . . . 48.59 113.311 -172.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -77.8 -39.26 44.45 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 118.98 -1.088 . . . . 38.9 111.09 175.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 91.6 p -137.63 -0.86 2.11 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 114.734 1.383 . . . . 37.68 114.734 -168.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 50.76 39.24 21.57 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 122.01 0.909 . . . . 74.46 110.779 -170.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 68.83 20.53 7.99 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.046 -0.979 . . . . 45.38 112.636 171.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -102.93 116.54 32.74 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 109.902 -0.407 . . . . 42.19 109.902 -176.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 73.2 p -66.21 -20.24 66.07 Favored 'General case' 0 N--CA 1.444 -0.746 0 C-N-CA 118.664 -1.214 . . . . 43.55 110.813 -177.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -93.67 5.19 52.43 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.131 1.16 . . . . 43.11 114.131 -174.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.21 134.41 56.49 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 118.83 0.741 . . . . 42.63 111.221 -178.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 64.3 p -134.21 146.78 50.44 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.05 -0.977 . . . . 41.51 108.382 170.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -148.22 133.39 18.35 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 106.283 -1.747 . . . . 56.45 106.283 176.542 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -86.86 140.45 29.64 Favored 'General case' 0 C--N 1.318 -0.776 0 O-C-N 125.052 1.47 . . . . 76.66 109.447 -179.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -100.22 159.12 15.37 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 121.909 0.862 . . . . 53.11 109.664 176.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 80.4 p -58.66 -36.63 74.46 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 114.783 -1.099 . . . . 78.37 111.451 -179.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 56.1 p30 -73.79 11.17 0.91 Allowed 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 117.567 -1.653 . . . . 69.79 112.178 179.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.6 -10.4 59.55 Favored Glycine 0 C--O 1.245 0.782 0 CA-C-N 120.107 1.321 . . . . 54.95 115.518 -178.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 86.9 p -74.62 166.14 24.06 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 118.52 1.16 . . . . 47.63 109.93 172.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 89.0 m -132.57 141.7 48.83 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.613 -0.721 . . . . 43.61 109.572 179.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 68.3 m-20 -97.96 138.09 35.81 Favored 'General case' 0 C--O 1.244 0.811 0 O-C-N 123.973 0.796 . . . . 48.12 111.367 173.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -129.28 133.08 47.32 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 113.333 0.864 . . . . 42.09 113.333 -167.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 86.63 -170.22 41.94 Favored Glycine 0 N--CA 1.432 -1.629 0 CA-C-O 123.144 1.414 . . . . 36.49 112.55 163.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 8.0 tt -66.33 -25.25 35.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 CA-C-N 113.023 -1.588 . . . . 53.04 110.689 -168.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 52.8 mt -114.05 10.98 17.58 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.906 0.706 . . . . 45.17 112.906 176.043 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 44.1 mm-40 55.3 51.21 13.45 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-O 122.443 1.116 . . . . 40.18 110.096 165.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 62.1 mt -77.76 135.66 25.84 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.132 0 CA-C-N 114.132 -1.394 . . . . 46.45 109.615 178.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 48.4 t-20 -93.97 137.03 33.62 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.351 -0.841 . . . . 66.42 111.087 -164.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 78.9 p -77.16 -16.09 59.27 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.537 -0.756 . . . . 42.75 111.988 -174.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 15.4 tpp180 -56.8 -39.41 74.08 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 120.316 -0.554 . . . . 91.14 110.324 176.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -119.46 -32.09 4.43 Favored 'General case' 0 CA--C 1.516 -0.344 0 N-CA-C 116.062 1.875 . . . . 105.88 116.062 -171.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' TRP . . . . . 0.413 ' CE2' HG12 ' A' ' 116' ' ' ILE . 84.9 m95 -113.0 -23.6 9.96 Favored 'General case' 0 C--O 1.241 0.638 0 N-CA-C 114.481 1.289 . . . . 49.49 114.481 -156.162 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 28.2 p -147.77 163.3 37.16 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.438 -0.949 . . . . 41.92 108.438 -178.1 60.927 83.939 95.364 102.809 2.027 103.425 -62.457 -62.166 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -103.2 122.81 45.49 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.849 -0.614 . . . . 70.8 111.087 -179.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 58.8 p30 -115.64 9.99 15.41 Favored 'General case' 0 C--N 1.329 -0.293 0 O-C-N 123.366 0.416 . . . . 43.34 111.987 172.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 68.22 5.69 43.05 Favored Glycine 0 CA--C 1.501 -0.837 0 C-N-CA 120.738 -0.744 . . . . 47.73 114.831 175.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.5 ptt180 -140.26 20.85 2.42 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 118.415 1.108 . . . . 55.72 112.685 -177.076 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.0 m -121.01 83.18 37.44 Favored Pre-proline 0 CA--C 1.534 0.354 0 N-CA-C 105.718 -1.956 . . . . 71.41 105.718 -178.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -60.55 144.02 99.49 Favored 'Trans proline' 0 C--N 1.327 -0.585 0 CA-C-O 121.626 0.594 . . . . 100.8 111.827 -169.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 62.11 28.02 69.92 Favored Glycine 0 CA--C 1.505 -0.593 0 CA-C-N 115.204 -0.907 . . . . 87.71 112.898 -178.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 88.8 p -92.21 159.48 15.62 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 122.302 1.049 . . . . 76.21 109.859 176.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ARG . . . . . 0.455 ' NH2' ' O ' ' A' ' 305' ' ' HOH . 44.9 mtp180 -101.88 164.9 11.48 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 114.779 -1.1 . . . . 120.66 108.79 170.447 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 45.2 t-20 -130.06 69.16 1.44 Allowed 'General case' 0 C--N 1.308 -1.211 0 N-CA-C 105.727 -1.953 . . . . 54.54 105.727 -178.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 54.6 mt -71.95 -25.48 61.89 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 119.315 -0.954 . . . . 62.35 111.82 -169.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 86.3 m -88.72 -2.46 58.6 Favored 'General case' 0 C--O 1.242 0.667 0 C-N-CA 119.12 -1.032 . . . . 41.92 112.596 175.34 -67.203 171.599 81.212 103.101 2.044 104.29 52.069 -171.953 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 51.48 58.25 5.7 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.752 1.221 . . . . 84.14 111.651 176.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 7.9 pt -148.93 149.09 29.35 Favored Pre-proline 0 C--O 1.248 0.991 0 N-CA-C 107.684 -1.228 . . . . 60.5 107.684 -179.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -67.31 141.84 58.11 Favored 'Trans proline' 0 C--N 1.32 -0.969 0 N-CA-C 108.518 -1.378 . . . . 54.68 108.518 165.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 71.9 m -59.86 -29.29 68.21 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 119.367 -0.933 . . . . 41.15 111.731 -179.76 -62.166 -62.457 95.364 103.425 2.027 102.809 83.939 60.927 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 88.5 p -59.56 -26.44 65.39 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 119.811 -0.756 . . . . 48.08 112.168 178.341 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.53 -25.21 68.14 Favored 'General case' 0 C--O 1.236 0.342 0 O-C-N 121.773 -0.579 . . . . 53.88 111.543 177.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 90.1 mt -75.41 -5.29 44.19 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 114.025 1.12 . . . . 55.44 114.025 178.206 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 57.4 mt -100.98 1.54 39.78 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 118.971 0.805 . . . . 53.08 112.366 179.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 30.4 t -63.35 155.0 30.08 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 122.534 1.159 . . . . 56.82 111.336 -178.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 22.4 p -70.63 -19.15 62.85 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 119.522 -0.871 . . . . 62.23 111.237 172.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 43.2 t0 -85.98 117.15 24.65 Favored 'General case' 0 C--O 1.24 0.603 0 N-CA-C 107.355 -1.35 . . . . 63.46 107.355 171.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 44.0 pt -82.02 4.79 1.96 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.812 0 C-N-CA 119.571 -0.852 . . . . 51.99 112.333 -173.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 52.6 m -54.69 -48.47 72.39 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 119.142 -1.023 . . . . 58.21 111.681 -172.407 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -64.44 -41.94 96.28 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 118.57 -1.252 . . . . 46.47 111.116 -175.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 29.3 m -60.87 -40.82 94.42 Favored 'General case' 0 C--N 1.349 0.582 0 O-C-N 122.347 -0.221 . . . . 43.02 111.236 179.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 63.3 t -68.44 -44.54 83.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 O-C-N 122.156 -0.34 . . . . 50.33 110.922 -179.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -64.35 -41.14 96.91 Favored 'General case' 0 C--N 1.339 0.145 0 C-N-CA 118.341 -1.343 . . . . 62.62 111.206 -179.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 37.4 t -65.05 -42.75 93.96 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 119.947 -0.701 . . . . 43.79 111.633 174.631 -171.953 52.069 81.212 104.29 2.044 103.101 171.599 -67.203 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -56.24 -37.7 70.1 Favored 'General case' 0 C--O 1.243 0.711 0 O-C-N 121.643 -0.661 . . . . 39.87 111.877 176.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 88.7 mttt -61.52 -36.47 80.62 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 119.294 -0.962 . . . . 55.25 111.51 178.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 25.3 mtpt -71.46 -39.48 70.92 Favored 'General case' 0 C--O 1.241 0.615 0 C-N-CA 119.975 -0.69 . . . . 82.36 110.366 178.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' ILE . . . . . 0.413 HG12 ' CE2' ' A' ' 81' ' ' TRP . 94.6 mt -62.95 -48.42 88.1 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.442 0 CA-C-O 121.215 0.531 . . . . 41.65 109.875 -179.424 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 9.4 p -72.79 -15.96 17.71 Favored 'Isoleucine or valine' 0 C--O 1.242 0.71 0 C-N-CA 117.713 -1.595 . . . . 43.79 108.835 -170.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 71.5 m -87.89 -3.2 58.95 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 113.005 0.743 . . . . 55.47 113.005 -179.319 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ASP . . . . . 0.648 ' OD2' ' O ' ' A' ' 301' ' ' HOH . 5.0 p-10 -85.03 2.83 41.46 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 113.715 1.006 . . . . 60.09 113.715 -169.077 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 121.98 -30.92 5.12 Favored Glycine 0 C--N 1.336 0.541 0 CA-C-N 118.952 0.796 . . . . 62.59 114.517 172.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 24.9 m120 -98.54 5.7 47.69 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 117.578 0.689 . . . . 74.18 112.806 -178.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 56.35 -140.87 42.13 Favored Glycine 0 N--CA 1.442 -0.909 0 N-CA-C 110.235 -1.146 . . . . 48.09 110.235 174.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' MET . . . . . . . . . . . . . 57.6 mtp -83.4 -0.91 52.01 Favored 'General case' 0 CA--C 1.51 -0.585 0 C-N-CA 118.43 -1.308 . . . . 44.15 112.388 -175.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 72.9 m-80 -62.89 -12.55 25.79 Favored 'General case' 0 C--O 1.232 0.158 0 C-N-CA 119.8 -0.76 . . . . 45.88 111.992 172.71 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -58.27 -26.76 63.34 Favored 'General case' 0 C--O 1.224 -0.271 0 C-N-CA 119.931 -0.707 . . . . 45.07 111.819 172.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 21.1 m-90 -99.32 113.27 25.49 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 107.808 -1.182 . . . . 43.66 107.808 -177.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' VAL . . . . . . . . . . . . . 48.9 t -62.52 -38.83 82.4 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 C-N-CA 119.36 -0.936 . . . . 56.95 110.477 -174.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.14 -36.92 85.6 Favored 'General case' 0 CA--C 1.517 -0.323 0 C-N-CA 119.997 -0.681 . . . . 46.46 110.888 -177.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 89.4 t90 -64.06 -46.71 83.14 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 119.202 -0.999 . . . . 44.59 110.852 177.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 26.8 ttp-105 -58.23 -39.83 80.12 Favored 'General case' 0 CA--C 1.515 -0.404 0 C-N-CA 120.462 -0.495 . . . . 70.92 110.502 178.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -93.34 -22.31 19.03 Favored 'General case' 0 CA--C 1.511 -0.528 0 N-CA-C 114.175 1.176 . . . . 46.54 114.175 -170.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 63.3 mtp180 -127.07 -9.13 5.94 Favored 'General case' 0 C--O 1.245 0.839 0 N-CA-C 113.874 1.065 . . . . 53.02 113.874 -170.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 86.4 m -122.91 -45.56 2.14 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 118.692 0.678 . . . . 36.44 112.309 -177.207 -59.511 -75.726 -93.159 104.162 2.012 102.833 -91.981 -172.912 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -52.64 127.36 22.7 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 109.691 -0.485 . . . . 45.61 109.691 -177.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 73.54 19.19 79.66 Favored Glycine 0 N--CA 1.45 -0.411 0 CA-C-N 115.536 -0.756 . . . . 51.68 114.938 175.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 15.1 p -112.52 174.65 5.78 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 107.542 -1.281 . . . . 54.03 107.542 172.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 50.3 t0 -79.29 89.1 4.92 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 106.705 -1.591 . . . . 70.83 106.705 176.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 16.6 m -76.32 -21.91 15.37 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 C-N-CA 119.619 -0.833 . . . . 54.27 111.654 -178.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 22.6 tm0? -55.19 -26.32 38.38 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.065 -0.654 . . . . 105.32 111.092 175.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -61.42 -21.54 64.2 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.064 -0.655 . . . . 59.14 111.179 -176.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -74.89 -20.1 59.86 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 113.672 0.99 . . . . 55.7 113.672 -175.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 39.3 pt -112.41 -0.78 9.51 Favored 'Isoleucine or valine' 0 C--O 1.242 0.704 0 CA-C-N 118.155 0.434 . . . . 62.61 111.985 176.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 29.4 ttm180 -50.9 132.12 26.79 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.342 0.592 . . . . 102.68 111.193 173.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 80.59 2.42 89.73 Favored Glycine 0 N--CA 1.445 -0.765 0 N-CA-C 115.8 1.08 . . . . 58.23 115.8 175.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 36.6 m -92.37 143.79 26.03 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 118.641 1.221 . . . . 61.59 109.247 177.194 -51.747 -59.568 -66.838 105.427 2.017 102.502 -61.143 -63.67 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 11.5 ttp180 -86.27 105.71 16.84 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 107.047 -1.464 . . . . 95.18 107.047 173.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' LEU . . . . . 0.758 ' HA ' ' O ' ' A' ' 311' ' ' HOH . 1.0 OUTLIER . . . . . 0 C--O 1.239 0.549 0 N-CA-C 108.715 -0.846 . . . . 89.54 108.715 -178.372 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . 0.648 ' O ' ' OD2' ' A' ' 119' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . 0.513 ' O ' ' NH1' ' A' ' 32' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' HOH . . . . . 0.455 ' O ' ' NH2' ' A' ' 91' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 311' ' ' HOH . . . . . 0.758 ' O ' ' HA ' ' A' ' 147' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 347' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 348' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 349' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 350' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 351' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 352' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 353' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 354' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 44.3 tttp . . . . . 0 C--O 1.24 0.587 0 N-CA-C 108.774 -0.824 . . . . 63.4 108.774 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 67.5 t -105.39 111.86 36.48 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.247 0 N-CA-C 106.857 -1.534 . . . . 42.06 106.857 175.417 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -77.44 148.77 35.25 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-O 121.679 0.752 . . . . 42.27 109.868 -175.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -77.45 157.52 46.22 Favored Glycine 0 N--CA 1.438 -1.218 0 C-N-CA 120.053 -1.07 . . . . 35.62 111.853 156.534 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 65.4 ttp85 -56.32 -55.31 35.0 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 114.738 -0.731 . . . . 48.67 111.115 -175.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 77.0 m -69.56 -33.56 72.92 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 118.597 -1.241 . . . . 42.32 111.692 -179.747 -63.67 -61.143 -66.838 102.502 2.017 105.427 -59.568 -51.747 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 72.2 tt0 -59.04 -46.23 88.76 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 119.59 -0.844 . . . . 50.18 110.525 176.199 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 65.5 tp -67.38 -42.34 83.55 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 119.979 -0.688 . . . . 40.85 111.591 179.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -54.39 -43.77 71.7 Favored 'General case' 0 CA--C 1.519 -0.237 0 C-N-CA 119.537 -0.865 . . . . 37.77 110.446 177.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.44 -39.93 81.32 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 119.741 -0.784 . . . . 43.64 110.946 -176.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.96 -40.63 95.28 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.42 -0.512 . . . . 41.09 110.989 178.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 38.2 mtt -64.27 -44.15 92.61 Favored 'General case' 0 CA--C 1.51 -0.58 0 C-N-CA 119.97 -0.692 . . . . 40.17 111.217 177.827 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -57.8 -46.92 83.95 Favored 'General case' 0 C--O 1.238 0.457 0 O-C-N 121.934 -0.479 . . . . 80.91 111.32 176.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ARG . . . . . 0.513 ' NH1' ' O ' ' A' ' 302' ' ' HOH . 58.9 ttp85 -62.34 -32.8 73.63 Favored 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 119.454 -0.898 . . . . 64.81 111.291 -178.452 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 44.3 m80 -87.03 5.78 35.76 Favored 'General case' 0 C--N 1.327 -0.374 0 O-C-N 121.886 -0.509 . . . . 54.84 111.639 -179.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 93.44 22.92 25.48 Favored Glycine 0 C--O 1.245 0.792 0 N-CA-C 115.967 1.147 . . . . 50.09 115.967 165.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 24.1 mt -90.36 -18.37 25.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 118.331 1.066 . . . . 42.29 113.866 -176.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -62.74 121.19 12.8 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 119.64 1.109 . . . . 66.69 109.352 -179.561 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 72.3 m-20 58.72 22.74 10.33 Favored 'General case' 0 C--O 1.246 0.881 0 N-CA-C 114.216 1.191 . . . . 66.84 114.216 -174.008 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -67.24 121.05 14.82 Favored 'General case' 0 C--O 1.235 0.31 0 O-C-N 121.098 -1.001 . . . . 48.3 108.779 175.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 7.7 mmm180 54.63 28.95 10.66 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 123.41 0.684 . . . . 74.59 111.592 -173.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 91.34 1.43 71.98 Favored Glycine 0 C--O 1.241 0.56 0 N-CA-C 115.615 1.006 . . . . 36.78 115.615 173.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 83.1 m-85 -96.5 114.9 26.6 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 118.255 1.027 . . . . 34.83 109.944 -179.706 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 91.0 p -63.57 162.56 12.68 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 121.893 0.854 . . . . 42.39 110.359 -179.386 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 17.6 tp -57.77 -38.36 75.3 Favored 'General case' 0 C--O 1.243 0.738 0 CA-C-N 115.038 -0.983 . . . . 39.98 111.944 -174.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -59.78 -31.04 70.55 Favored Glycine 0 CA--C 1.522 0.479 0 C-N-CA 118.994 -1.574 . . . . 32.67 113.821 -177.584 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 64.2 m-80 -58.7 -46.45 87.26 Favored 'General case' 0 N--CA 1.468 0.43 0 O-C-N 121.249 -1.148 . . . . 38.02 111.54 174.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -66.3 -41.84 89.19 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 115.917 -0.583 . . . . 37.13 110.362 -176.608 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 81.8 t -64.89 -46.87 90.5 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.255 0 CA-C-O 120.916 0.388 . . . . 36.64 110.711 178.016 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 43.6 t -55.03 -45.54 75.21 Favored 'General case' 0 N--CA 1.442 -0.852 0 C-N-CA 120.376 -0.529 . . . . 33.03 110.699 176.508 -172.912 -91.981 -93.159 102.833 2.012 104.162 -75.726 -59.511 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -63.7 -42.78 97.91 Favored 'General case' 0 CA--C 1.513 -0.458 0 C-N-CA 120.075 -0.65 . . . . 32.68 110.703 -177.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.89 -38.11 87.9 Favored 'General case' 0 CA--C 1.517 -0.3 0 C-N-CA 119.237 -0.985 . . . . 32.92 110.664 -179.613 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 46.5 tptt -56.26 -48.33 76.78 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.996 0.903 . . . . 53.49 110.919 178.379 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -87.56 -20.63 26.18 Favored 'General case' 0 C--N 1.308 -1.208 0 C-N-CA 119.201 -1.0 . . . . 40.44 113.311 -172.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -77.8 -39.26 44.45 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 118.98 -1.088 . . . . 38.9 111.09 175.366 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 91.6 p -137.63 -0.86 2.11 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 114.734 1.383 . . . . 33.61 114.734 -168.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 50.76 39.24 21.57 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 122.01 0.909 . . . . 61.99 110.779 -170.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 68.83 20.53 7.99 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.046 -0.979 . . . . 37.76 112.636 171.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -102.93 116.54 32.74 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 109.902 -0.407 . . . . 35.93 109.902 -176.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 73.2 p -66.21 -20.24 66.07 Favored 'General case' 0 N--CA 1.444 -0.746 0 C-N-CA 118.664 -1.214 . . . . 36.23 110.813 -177.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -93.67 5.19 52.43 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.131 1.16 . . . . 41.25 114.131 -174.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.21 134.41 56.49 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 118.83 0.741 . . . . 35.47 111.221 -178.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 64.3 p -134.21 146.78 50.44 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.05 -0.977 . . . . 37.32 108.382 170.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -148.22 133.39 18.35 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 106.283 -1.747 . . . . 48.0 106.283 176.542 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -86.86 140.45 29.64 Favored 'General case' 0 C--N 1.318 -0.776 0 O-C-N 125.052 1.47 . . . . 64.03 109.447 -179.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -100.22 159.12 15.37 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 121.909 0.862 . . . . 48.4 109.664 176.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 80.4 p -58.66 -36.63 74.46 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 114.783 -1.099 . . . . 65.25 111.451 -179.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 56.1 p30 -73.79 11.17 0.91 Allowed 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 117.567 -1.653 . . . . 58.53 112.178 179.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.6 -10.4 59.55 Favored Glycine 0 C--O 1.245 0.782 0 CA-C-N 120.107 1.321 . . . . 46.28 115.518 -178.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 86.9 p -74.62 166.14 24.06 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 118.52 1.16 . . . . 39.63 109.93 172.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 89.0 m -132.57 141.7 48.83 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.613 -0.721 . . . . 36.28 109.572 179.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 68.3 m-20 -97.96 138.09 35.81 Favored 'General case' 0 C--O 1.244 0.811 0 O-C-N 123.973 0.796 . . . . 48.12 111.367 173.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -129.28 133.08 47.32 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 113.333 0.864 . . . . 35.02 113.333 -167.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 86.63 -170.22 41.94 Favored Glycine 0 N--CA 1.432 -1.629 0 CA-C-O 123.144 1.414 . . . . 30.35 112.55 163.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 8.0 tt -66.33 -25.25 35.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 CA-C-N 113.023 -1.588 . . . . 44.14 110.689 -168.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 52.8 mt -114.05 10.98 17.58 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.906 0.706 . . . . 37.58 112.906 176.043 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 44.1 mm-40 55.3 51.21 13.45 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-O 122.443 1.116 . . . . 33.42 110.096 165.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ILE . . . . . 0.436 ' HB ' HD13 ' A' ' 101' ' ' LEU . 62.1 mt -77.76 135.66 25.84 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.132 0 CA-C-N 114.132 -1.394 . . . . 38.65 109.615 178.844 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 48.4 t-20 -93.97 137.03 33.62 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.351 -0.841 . . . . 55.3 111.087 -164.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 78.9 p -77.16 -16.09 59.27 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.537 -0.756 . . . . 41.28 111.988 -174.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 15.4 tpp180 -56.8 -39.41 74.08 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 120.316 -0.554 . . . . 84.14 110.324 176.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -119.46 -32.09 4.43 Favored 'General case' 0 CA--C 1.516 -0.344 0 N-CA-C 116.062 1.875 . . . . 88.18 116.062 -171.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' TRP . . . . . 0.406 ' CE2' HG12 ' A' ' 116' ' ' ILE . 84.9 m95 -113.0 -23.6 9.96 Favored 'General case' 0 C--O 1.241 0.638 0 N-CA-C 114.481 1.289 . . . . 41.18 114.481 -156.162 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 28.2 p -147.77 163.3 37.16 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.438 -0.949 . . . . 35.66 108.438 -178.1 60.927 83.939 95.364 102.809 2.027 103.425 -62.457 -62.166 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -103.2 122.81 45.49 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.849 -0.614 . . . . 58.94 111.087 -179.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 58.8 p30 -115.64 9.99 15.41 Favored 'General case' 0 C--N 1.329 -0.293 0 O-C-N 123.366 0.416 . . . . 38.96 111.987 172.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 68.22 5.69 43.05 Favored Glycine 0 CA--C 1.501 -0.837 0 C-N-CA 120.738 -0.744 . . . . 47.73 114.831 175.519 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.5 ptt180 -140.26 20.85 2.42 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 118.415 1.108 . . . . 50.96 112.685 -177.076 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.0 m -121.01 83.18 37.44 Favored Pre-proline 0 CA--C 1.534 0.354 0 N-CA-C 105.718 -1.956 . . . . 59.45 105.718 -178.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -60.55 144.02 99.49 Favored 'Trans proline' 0 C--N 1.327 -0.585 0 CA-C-O 121.626 0.594 . . . . 83.94 111.827 -169.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 62.11 28.02 69.92 Favored Glycine 0 CA--C 1.505 -0.593 0 CA-C-N 115.204 -0.907 . . . . 73.03 112.898 -178.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 88.8 p -92.21 159.48 15.62 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 122.302 1.049 . . . . 63.45 109.859 176.15 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ARG . . . . . 0.455 ' NH2' ' O ' ' A' ' 305' ' ' HOH . 44.9 mtp180 -101.88 164.9 11.48 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 114.779 -1.1 . . . . 105.67 108.79 170.447 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 45.2 t-20 -130.06 69.16 1.44 Allowed 'General case' 0 C--N 1.308 -1.211 0 N-CA-C 105.727 -1.953 . . . . 45.39 105.727 -178.633 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 54.6 mt -71.95 -25.48 61.89 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 119.315 -0.954 . . . . 51.9 111.82 -169.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 86.3 m -88.72 -2.46 58.6 Favored 'General case' 0 C--O 1.242 0.667 0 C-N-CA 119.12 -1.032 . . . . 41.64 112.596 175.34 -67.203 171.599 81.212 103.101 2.044 104.29 52.069 -171.953 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 51.48 58.25 5.7 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.752 1.221 . . . . 70.06 111.651 176.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 7.9 pt -148.93 149.09 29.35 Favored Pre-proline 0 C--O 1.248 0.991 0 N-CA-C 107.684 -1.228 . . . . 50.36 107.684 -179.072 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -67.31 141.84 58.11 Favored 'Trans proline' 0 C--N 1.32 -0.969 0 N-CA-C 108.518 -1.378 . . . . 45.51 108.518 165.014 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 71.9 m -59.86 -29.29 68.21 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 119.367 -0.933 . . . . 34.82 111.731 -179.76 -62.166 -62.457 95.364 103.425 2.027 102.809 83.939 60.927 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 88.5 p -59.56 -26.44 65.39 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 119.811 -0.756 . . . . 40.01 112.168 178.341 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.53 -25.21 68.14 Favored 'General case' 0 C--O 1.236 0.342 0 O-C-N 121.773 -0.579 . . . . 44.85 111.543 177.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' LEU . . . . . 0.436 HD13 ' HB ' ' A' ' 76' ' ' ILE . 90.1 mt -75.41 -5.29 44.19 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 114.025 1.12 . . . . 46.14 114.025 178.206 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 57.4 mt -100.98 1.54 39.78 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 118.971 0.805 . . . . 44.17 112.366 179.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 30.4 t -63.35 155.0 30.08 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 122.534 1.159 . . . . 47.3 111.336 -178.245 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 22.4 p -70.63 -19.15 62.85 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 119.522 -0.871 . . . . 51.8 111.237 172.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 43.2 t0 -85.98 117.15 24.65 Favored 'General case' 0 C--O 1.24 0.603 0 N-CA-C 107.355 -1.35 . . . . 63.46 107.355 171.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 44.0 pt -82.02 4.79 1.96 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.812 0 C-N-CA 119.571 -0.852 . . . . 43.27 112.333 -173.185 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 52.6 m -54.69 -48.47 72.39 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 119.142 -1.023 . . . . 48.45 111.681 -172.407 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -64.44 -41.94 96.28 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 118.57 -1.252 . . . . 38.91 111.116 -175.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 29.3 m -60.87 -40.82 94.42 Favored 'General case' 0 C--N 1.349 0.582 0 O-C-N 122.347 -0.221 . . . . 35.8 111.236 179.466 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 63.3 t -68.44 -44.54 83.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 O-C-N 122.156 -0.34 . . . . 41.88 110.922 -179.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -64.35 -41.14 96.91 Favored 'General case' 0 C--N 1.339 0.145 0 C-N-CA 118.341 -1.343 . . . . 52.13 111.206 -179.232 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 37.4 t -65.05 -42.75 93.96 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 119.947 -0.701 . . . . 36.44 111.633 174.631 -171.953 52.069 81.212 104.29 2.044 103.101 171.599 -67.203 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -56.24 -37.7 70.1 Favored 'General case' 0 C--O 1.243 0.711 0 O-C-N 121.643 -0.661 . . . . 33.17 111.877 176.141 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 88.7 mttt -61.52 -36.47 80.62 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 119.294 -0.962 . . . . 45.99 111.51 178.292 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 25.3 mtpt -71.46 -39.48 70.92 Favored 'General case' 0 C--O 1.241 0.615 0 C-N-CA 119.975 -0.69 . . . . 68.57 110.366 178.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' ILE . . . . . 0.406 HG12 ' CE2' ' A' ' 81' ' ' TRP . 94.6 mt -62.95 -48.42 88.1 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.442 0 CA-C-O 121.215 0.531 . . . . 38.55 109.875 -179.424 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 9.4 p -72.79 -15.96 17.71 Favored 'Isoleucine or valine' 0 C--O 1.242 0.71 0 C-N-CA 117.713 -1.595 . . . . 40.89 108.835 -170.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 71.5 m -87.89 -3.2 58.95 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 113.005 0.743 . . . . 51.03 113.005 -179.319 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ASP . . . . . 0.648 ' OD2' ' O ' ' A' ' 301' ' ' HOH . 5.0 p-10 -85.03 2.83 41.46 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 113.715 1.006 . . . . 58.6 113.715 -169.077 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 121.98 -30.92 5.12 Favored Glycine 0 C--N 1.336 0.541 0 CA-C-N 118.952 0.796 . . . . 54.16 114.517 172.129 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 24.9 m120 -98.54 5.7 47.69 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 117.578 0.689 . . . . 74.18 112.806 -178.289 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 56.35 -140.87 42.13 Favored Glycine 0 N--CA 1.442 -0.909 0 N-CA-C 110.235 -1.146 . . . . 40.01 110.235 174.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' MET . . . . . . . . . . . . . 57.6 mtp -83.4 -0.91 52.01 Favored 'General case' 0 CA--C 1.51 -0.585 0 C-N-CA 118.43 -1.308 . . . . 36.73 112.388 -175.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 72.9 m-80 -62.89 -12.55 25.79 Favored 'General case' 0 C--O 1.232 0.158 0 C-N-CA 119.8 -0.76 . . . . 38.18 111.992 172.71 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -58.27 -26.76 63.34 Favored 'General case' 0 C--O 1.224 -0.271 0 C-N-CA 119.931 -0.707 . . . . 39.22 111.819 172.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 21.1 m-90 -99.32 113.27 25.49 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 107.808 -1.182 . . . . 36.64 107.808 -177.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 328' ' ' HOH . 48.9 t -62.52 -38.83 82.4 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 C-N-CA 119.36 -0.936 . . . . 47.4 110.477 -174.882 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.14 -36.92 85.6 Favored 'General case' 0 CA--C 1.517 -0.323 0 C-N-CA 119.997 -0.681 . . . . 38.66 110.888 -177.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 89.4 t90 -64.06 -46.71 83.14 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 119.202 -0.999 . . . . 37.1 110.852 177.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 26.8 ttp-105 -58.23 -39.83 80.12 Favored 'General case' 0 CA--C 1.515 -0.404 0 C-N-CA 120.462 -0.495 . . . . 59.04 110.502 178.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -93.34 -22.31 19.03 Favored 'General case' 0 CA--C 1.511 -0.528 0 N-CA-C 114.175 1.176 . . . . 38.72 114.175 -170.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 63.3 mtp180 -127.07 -9.13 5.94 Favored 'General case' 0 C--O 1.245 0.839 0 N-CA-C 113.874 1.065 . . . . 44.13 113.874 -170.584 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 86.4 m -122.91 -45.56 2.14 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 118.692 0.678 . . . . 36.02 112.309 -177.207 -59.511 -75.726 -93.159 104.162 2.012 102.833 -91.981 -172.912 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -52.64 127.36 22.7 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 109.691 -0.485 . . . . 37.95 109.691 -177.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 73.54 19.19 79.66 Favored Glycine 0 N--CA 1.45 -0.411 0 CA-C-N 115.536 -0.756 . . . . 48.96 114.938 175.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 15.1 p -112.52 174.65 5.78 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 107.542 -1.281 . . . . 44.97 107.542 172.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 50.3 t0 -79.29 89.1 4.92 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 106.705 -1.591 . . . . 65.81 106.705 176.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 16.6 m -76.32 -21.91 15.37 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 C-N-CA 119.619 -0.833 . . . . 45.17 111.654 -178.293 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 22.6 tm0? -55.19 -26.32 38.38 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.065 -0.654 . . . . 87.71 111.092 175.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -61.42 -21.54 64.2 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.064 -0.655 . . . . 49.23 111.179 -176.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -74.89 -20.1 59.86 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 113.672 0.99 . . . . 46.36 113.672 -175.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 39.3 pt -112.41 -0.78 9.51 Favored 'Isoleucine or valine' 0 C--O 1.242 0.704 0 CA-C-N 118.155 0.434 . . . . 52.12 111.985 176.475 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 29.4 ttm180 -50.9 132.12 26.79 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.342 0.592 . . . . 85.51 111.193 173.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 80.59 2.42 89.73 Favored Glycine 0 N--CA 1.445 -0.765 0 N-CA-C 115.8 1.08 . . . . 51.17 115.8 175.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 36.6 m -92.37 143.79 26.03 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 118.641 1.221 . . . . 51.26 109.247 177.194 -51.747 -59.568 -66.838 105.427 2.017 102.502 -61.143 -63.67 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 11.5 ttp180 -86.27 105.71 16.84 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 107.047 -1.464 . . . . 87.22 107.047 173.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' LEU . . . . . 0.764 ' HA ' ' O ' ' A' ' 311' ' ' HOH . 1.0 OUTLIER . . . . . 0 C--O 1.239 0.549 0 N-CA-C 108.715 -0.846 . . . . 82.99 108.715 -178.372 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 201' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . 0.648 ' O ' ' OD2' ' A' ' 119' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . 0.513 ' O ' ' NH1' ' A' ' 32' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 305' ' ' HOH . . . . . 0.455 ' O ' ' NH2' ' A' ' 91' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 311' ' ' HOH . . . . . 0.764 ' O ' ' HA ' ' A' ' 147' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 328' ' ' HOH . . . . . 0.466 ' O ' HG23 ' A' ' 127' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 347' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 348' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 349' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 350' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 351' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 352' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 353' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 354' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 44.3 tttp . . . . . 0 C--O 1.24 0.587 0 N-CA-C 108.774 -0.824 . . . . 63.4 108.774 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 67.5 t -105.39 111.86 36.48 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.247 0 N-CA-C 106.857 -1.534 . . . . 42.06 106.857 175.417 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -77.44 148.77 35.25 Favored 'General case' 0 CA--C 1.515 -0.392 0 CA-C-O 121.679 0.752 . . . . 42.27 109.868 -175.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . -77.45 157.52 46.22 Favored Glycine 0 N--CA 1.438 -1.218 0 C-N-CA 120.053 -1.07 . . . . 35.62 111.853 156.534 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 65.4 ttp85 -56.32 -55.31 35.0 Favored 'General case' 0 CA--C 1.515 -0.367 0 CA-C-N 114.738 -0.731 . . . . 48.67 111.115 -175.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 77.0 m -69.56 -33.56 72.92 Favored 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 118.597 -1.241 . . . . 42.32 111.692 -179.747 -63.67 -61.143 -66.838 102.502 2.017 105.427 -59.568 -51.747 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 72.2 tt0 -59.04 -46.23 88.76 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 119.59 -0.844 . . . . 50.18 110.525 176.199 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 65.5 tp -67.38 -42.34 83.55 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 119.979 -0.688 . . . . 40.85 111.591 179.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -54.39 -43.77 71.7 Favored 'General case' 0 CA--C 1.519 -0.237 0 C-N-CA 119.537 -0.865 . . . . 37.77 110.446 177.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -68.44 -39.93 81.32 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 119.741 -0.784 . . . . 43.64 110.946 -176.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.96 -40.63 95.28 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.42 -0.512 . . . . 41.09 110.989 178.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 38.2 mtt -64.27 -44.15 92.61 Favored 'General case' 0 CA--C 1.51 -0.58 0 C-N-CA 119.97 -0.692 . . . . 40.17 111.217 177.827 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -57.8 -46.92 83.95 Favored 'General case' 0 C--O 1.238 0.457 0 O-C-N 121.934 -0.479 . . . . 80.91 111.32 176.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.513 ' NH1' ' O ' ' A' ' 302' ' ' HOH . 58.9 ttp85 -62.34 -32.8 73.63 Favored 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 119.454 -0.898 . . . . 64.81 111.291 -178.452 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 44.3 m80 -87.03 5.78 35.76 Favored 'General case' 0 C--N 1.327 -0.374 0 O-C-N 121.886 -0.509 . . . . 54.84 111.639 -179.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 93.44 22.92 25.48 Favored Glycine 0 C--O 1.245 0.792 0 N-CA-C 115.967 1.147 . . . . 50.09 115.967 165.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 24.1 mt -90.36 -18.37 25.64 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 118.331 1.066 . . . . 42.29 113.866 -176.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 46.1 t0 -62.74 121.19 12.8 Favored 'General case' 0 C--N 1.327 -0.404 0 CA-C-N 119.64 1.109 . . . . 66.69 109.352 -179.561 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 72.3 m-20 58.72 22.74 10.33 Favored 'General case' 0 C--O 1.246 0.881 0 N-CA-C 114.216 1.191 . . . . 66.84 114.216 -174.008 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' TYR . . . . . . . . . . . . . 64.2 t80 -67.24 121.05 14.82 Favored 'General case' 0 C--O 1.235 0.31 0 O-C-N 121.098 -1.001 . . . . 48.3 108.779 175.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 7.7 mmm180 54.63 28.95 10.66 Favored 'General case' 0 C--N 1.332 -0.177 0 C-N-CA 123.41 0.684 . . . . 74.59 111.592 -173.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 91.34 1.43 71.98 Favored Glycine 0 C--O 1.241 0.56 0 N-CA-C 115.615 1.006 . . . . 36.78 115.615 173.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 83.1 m-85 -96.5 114.9 26.6 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 118.255 1.027 . . . . 34.83 109.944 -179.706 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' SER . . . . . . . . . . . . . 91.0 p -63.57 162.56 12.68 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 121.893 0.854 . . . . 42.39 110.359 -179.386 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 17.6 tp -57.77 -38.36 75.3 Favored 'General case' 0 C--O 1.243 0.738 0 CA-C-N 115.038 -0.983 . . . . 39.98 111.944 -174.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . -59.78 -31.04 70.55 Favored Glycine 0 CA--C 1.522 0.479 0 C-N-CA 118.994 -1.574 . . . . 32.67 113.821 -177.584 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 64.2 m-80 -58.7 -46.45 87.26 Favored 'General case' 0 N--CA 1.468 0.43 0 O-C-N 121.249 -1.148 . . . . 38.02 111.54 174.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -66.3 -41.84 89.19 Favored 'General case' 0 CA--C 1.515 -0.373 0 CA-C-N 115.917 -0.583 . . . . 37.13 110.362 -176.608 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 81.8 t -64.89 -46.87 90.5 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.255 0 CA-C-O 120.916 0.388 . . . . 36.64 110.711 178.016 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' CYS . . . . . . . . . . . . . 43.6 t -55.03 -45.54 75.21 Favored 'General case' 0 N--CA 1.442 -0.852 0 C-N-CA 120.376 -0.529 . . . . 33.03 110.699 176.508 -172.912 -91.981 -93.159 102.833 2.012 104.162 -75.726 -59.511 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -63.7 -42.78 97.91 Favored 'General case' 0 CA--C 1.513 -0.458 0 C-N-CA 120.075 -0.65 . . . . 32.68 110.703 -177.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.89 -38.11 87.9 Favored 'General case' 0 CA--C 1.517 -0.3 0 C-N-CA 119.237 -0.985 . . . . 32.92 110.664 -179.613 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 46.5 tptt -56.26 -48.33 76.78 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-O 121.996 0.903 . . . . 53.49 110.919 178.379 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 32.1 m-85 -87.56 -20.63 26.18 Favored 'General case' 0 C--N 1.308 -1.208 0 C-N-CA 119.201 -1.0 . . . . 40.44 113.311 -172.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 62.1 mm-40 -77.8 -39.26 44.45 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 118.98 -1.088 . . . . 38.9 111.09 175.366 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' SER . . . . . . . . . . . . . 91.6 p -137.63 -0.86 2.11 Favored 'General case' 0 C--N 1.322 -0.602 0 N-CA-C 114.734 1.383 . . . . 33.61 114.734 -168.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.7 t-20 50.76 39.24 21.57 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 122.01 0.909 . . . . 61.99 110.779 -170.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 23.5 m-85 68.83 20.53 7.99 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-N 115.046 -0.979 . . . . 37.76 112.636 171.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 52.5 t-20 -102.93 116.54 32.74 Favored 'General case' 0 C--N 1.317 -0.841 0 N-CA-C 109.902 -0.407 . . . . 35.93 109.902 -176.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 73.2 p -66.21 -20.24 66.07 Favored 'General case' 0 N--CA 1.444 -0.746 0 C-N-CA 118.664 -1.214 . . . . 36.23 110.813 -177.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 31.8 mt-30 -93.67 5.19 52.43 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 114.131 1.16 . . . . 41.25 114.131 -174.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -62.21 134.41 56.49 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-N 118.83 0.741 . . . . 35.47 111.221 -178.469 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 64.3 p -134.21 146.78 50.44 Favored 'General case' 0 C--N 1.326 -0.45 0 CA-C-N 115.05 -0.977 . . . . 37.32 108.382 170.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 68.8 m-80 -148.22 133.39 18.35 Favored 'General case' 0 CA--C 1.512 -0.515 0 N-CA-C 106.283 -1.747 . . . . 48.0 106.283 176.542 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ARG . . . . . . . . . . . . . 5.2 tpt180 -86.86 140.45 29.64 Favored 'General case' 0 C--N 1.318 -0.776 0 O-C-N 125.052 1.47 . . . . 64.03 109.447 -179.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 79.3 m-20 -100.22 159.12 15.37 Favored 'General case' 0 C--N 1.312 -1.026 0 CA-C-O 121.909 0.862 . . . . 48.4 109.664 176.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 80.4 p -58.66 -36.63 74.46 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 114.783 -1.099 . . . . 65.25 111.451 -179.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 56.1 p30 -73.79 11.17 0.91 Allowed 'General case' 0 C--N 1.322 -0.62 0 C-N-CA 117.567 -1.653 . . . . 58.53 112.178 179.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 83.6 -10.4 59.55 Favored Glycine 0 C--O 1.245 0.782 0 CA-C-N 120.107 1.321 . . . . 46.28 115.518 -178.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 86.9 p -74.62 166.14 24.06 Favored 'General case' 0 N--CA 1.445 -0.703 0 CA-C-N 118.52 1.16 . . . . 39.63 109.93 172.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 89.0 m -132.57 141.7 48.83 Favored 'General case' 0 C--N 1.318 -0.794 0 CA-C-N 115.613 -0.721 . . . . 36.28 109.572 179.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 68.3 m-20 -97.96 138.09 35.81 Favored 'General case' 0 C--O 1.244 0.811 0 O-C-N 123.973 0.796 . . . . 48.12 111.367 173.981 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -129.28 133.08 47.32 Favored 'General case' 0 CA--C 1.513 -0.447 0 N-CA-C 113.333 0.864 . . . . 35.02 113.333 -167.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 86.63 -170.22 41.94 Favored Glycine 0 N--CA 1.432 -1.629 0 CA-C-O 123.144 1.414 . . . . 30.35 112.55 163.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 8.0 tt -66.33 -25.25 35.0 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.417 0 CA-C-N 113.023 -1.588 . . . . 44.14 110.689 -168.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 52.8 mt -114.05 10.98 17.58 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 112.906 0.706 . . . . 37.58 112.906 176.043 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 44.1 mm-40 55.3 51.21 13.45 Favored 'General case' 0 N--CA 1.474 0.77 0 CA-C-O 122.443 1.116 . . . . 33.42 110.096 165.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.436 ' HB ' HD13 ' A' ' 101' ' ' LEU . 62.1 mt -77.76 135.66 25.84 Favored 'Isoleucine or valine' 0 C--N 1.31 -1.132 0 CA-C-N 114.132 -1.394 . . . . 38.65 109.615 178.844 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 48.4 t-20 -93.97 137.03 33.62 Favored 'General case' 0 N--CA 1.466 0.371 0 CA-C-N 115.351 -0.841 . . . . 55.3 111.087 -164.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' SER . . . . . . . . . . . . . 78.9 p -77.16 -16.09 59.27 Favored 'General case' 0 N--CA 1.451 -0.424 0 CA-C-N 115.537 -0.756 . . . . 41.28 111.988 -174.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ARG . . . . . . . . . . . . . 15.4 tpp180 -56.8 -39.41 74.08 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 120.316 -0.554 . . . . 84.14 110.324 176.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -119.46 -32.09 4.43 Favored 'General case' 0 CA--C 1.516 -0.344 0 N-CA-C 116.062 1.875 . . . . 88.18 116.062 -171.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' TRP . . . . . 0.406 ' CE2' HG12 ' A' ' 116' ' ' ILE . 84.9 m95 -113.0 -23.6 9.96 Favored 'General case' 0 C--O 1.241 0.638 0 N-CA-C 114.481 1.289 . . . . 41.18 114.481 -156.162 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' CYS . . . . . . . . . . . . . 28.2 p -147.77 163.3 37.16 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 108.438 -0.949 . . . . 35.66 108.438 -178.1 60.927 83.939 95.364 102.809 2.027 103.425 -62.457 -62.166 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ASN . . . . . . . . . . . . . 40.4 t30 -103.2 122.81 45.49 Favored 'General case' 0 C--N 1.324 -0.542 0 CA-C-N 115.849 -0.614 . . . . 58.94 111.087 -179.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 58.8 p30 -115.64 9.99 15.41 Favored 'General case' 0 C--N 1.329 -0.293 0 O-C-N 123.366 0.416 . . . . 38.96 111.987 172.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 68.22 5.69 43.05 Favored Glycine 0 CA--C 1.501 -0.837 0 C-N-CA 120.738 -0.744 . . . . 47.73 114.831 175.519 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 11.5 ptt180 -140.26 20.85 2.42 Favored 'General case' 0 C--N 1.317 -0.82 0 CA-C-N 118.415 1.108 . . . . 50.96 112.685 -177.076 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 25.0 m -121.01 83.18 37.44 Favored Pre-proline 0 CA--C 1.534 0.354 0 N-CA-C 105.718 -1.956 . . . . 59.45 105.718 -178.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -60.55 144.02 99.49 Favored 'Trans proline' 0 C--N 1.327 -0.585 0 CA-C-O 121.626 0.594 . . . . 83.94 111.827 -169.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 62.11 28.02 69.92 Favored Glycine 0 CA--C 1.505 -0.593 0 CA-C-N 115.204 -0.907 . . . . 73.03 112.898 -178.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 88.8 p -92.21 159.48 15.62 Favored 'General case' 0 N--CA 1.445 -0.692 0 CA-C-O 122.302 1.049 . . . . 63.45 109.859 176.15 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ARG . . . . . 0.455 ' NH2' ' O ' ' A' ' 305' ' ' HOH . 44.9 mtp180 -101.88 164.9 11.48 Favored 'General case' 0 C--N 1.316 -0.876 0 CA-C-N 114.779 -1.1 . . . . 105.67 108.79 170.447 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 45.2 t-20 -130.06 69.16 1.44 Allowed 'General case' 0 C--N 1.308 -1.211 0 N-CA-C 105.727 -1.953 . . . . 45.39 105.727 -178.633 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 54.6 mt -71.95 -25.48 61.89 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 119.315 -0.954 . . . . 51.9 111.82 -169.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 86.3 m -88.72 -2.46 58.6 Favored 'General case' 0 C--O 1.242 0.667 0 C-N-CA 119.12 -1.032 . . . . 41.64 112.596 175.34 -67.203 171.599 81.212 103.101 2.044 104.29 52.069 -171.953 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 51.48 58.25 5.7 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.752 1.221 . . . . 70.06 111.651 176.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ILE . . . . . . . . . . . . . 7.9 pt -148.93 149.09 29.35 Favored Pre-proline 0 C--O 1.248 0.991 0 N-CA-C 107.684 -1.228 . . . . 50.36 107.684 -179.072 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -67.31 141.84 58.11 Favored 'Trans proline' 0 C--N 1.32 -0.969 0 N-CA-C 108.518 -1.378 . . . . 45.51 108.518 165.014 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 71.9 m -59.86 -29.29 68.21 Favored 'General case' 0 C--N 1.322 -0.591 0 C-N-CA 119.367 -0.933 . . . . 34.82 111.731 -179.76 -62.166 -62.457 95.364 103.425 2.027 102.809 83.939 60.927 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' SER . . . . . . . . . . . . . 88.5 p -59.56 -26.44 65.39 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 119.811 -0.756 . . . . 40.01 112.168 178.341 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ALA . . . . . . . . . . . . . . . -63.53 -25.21 68.14 Favored 'General case' 0 C--O 1.236 0.342 0 O-C-N 121.773 -0.579 . . . . 44.85 111.543 177.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' LEU . . . . . 0.436 HD13 ' HB ' ' A' ' 76' ' ' ILE . 90.1 mt -75.41 -5.29 44.19 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 114.025 1.12 . . . . 46.14 114.025 178.206 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 57.4 mt -100.98 1.54 39.78 Favored 'General case' 0 C--N 1.321 -0.658 0 CA-C-N 118.971 0.805 . . . . 44.17 112.366 179.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 30.4 t -63.35 155.0 30.08 Favored 'General case' 0 C--N 1.323 -0.58 0 CA-C-O 122.534 1.159 . . . . 47.3 111.336 -178.245 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 22.4 p -70.63 -19.15 62.85 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 119.522 -0.871 . . . . 51.8 111.237 172.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 43.2 t0 -85.98 117.15 24.65 Favored 'General case' 0 C--O 1.24 0.603 0 N-CA-C 107.355 -1.35 . . . . 63.46 107.355 171.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 44.0 pt -82.02 4.79 1.96 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.812 0 C-N-CA 119.571 -0.852 . . . . 43.27 112.333 -173.185 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 52.6 m -54.69 -48.47 72.39 Favored 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 119.142 -1.023 . . . . 48.45 111.681 -172.407 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -64.44 -41.94 96.28 Favored 'General case' 0 C--O 1.234 0.289 0 C-N-CA 118.57 -1.252 . . . . 38.91 111.116 -175.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' SER . . . . . . . . . . . . . 29.3 m -60.87 -40.82 94.42 Favored 'General case' 0 C--N 1.349 0.582 0 O-C-N 122.347 -0.221 . . . . 35.8 111.236 179.466 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 63.3 t -68.44 -44.54 83.22 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 O-C-N 122.156 -0.34 . . . . 41.88 110.922 -179.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 97.8 m-20 -64.35 -41.14 96.91 Favored 'General case' 0 C--N 1.339 0.145 0 C-N-CA 118.341 -1.343 . . . . 52.13 111.206 -179.232 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' CYS . . . . . . . . . . . . . 37.4 t -65.05 -42.75 93.96 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 119.947 -0.701 . . . . 36.44 111.633 174.631 -171.953 52.069 81.212 104.29 2.044 103.101 171.599 -67.203 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ALA . . . . . . . . . . . . . . . -56.24 -37.7 70.1 Favored 'General case' 0 C--O 1.243 0.711 0 O-C-N 121.643 -0.661 . . . . 33.17 111.877 176.141 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 88.7 mttt -61.52 -36.47 80.62 Favored 'General case' 0 C--N 1.325 -0.477 0 C-N-CA 119.294 -0.962 . . . . 45.99 111.51 178.292 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 25.3 mtpt -71.46 -39.48 70.92 Favored 'General case' 0 C--O 1.241 0.615 0 C-N-CA 119.975 -0.69 . . . . 68.57 110.366 178.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' ILE . . . . . 0.406 HG12 ' CE2' ' A' ' 81' ' ' TRP . 94.6 mt -62.95 -48.42 88.1 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.442 0 CA-C-O 121.215 0.531 . . . . 38.55 109.875 -179.424 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' VAL . . . . . . . . . . . . . 9.4 p -72.79 -15.96 17.71 Favored 'Isoleucine or valine' 0 C--O 1.242 0.71 0 C-N-CA 117.713 -1.595 . . . . 40.89 108.835 -170.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' SER . . . . . . . . . . . . . 71.5 m -87.89 -3.2 58.95 Favored 'General case' 0 C--O 1.234 0.238 0 N-CA-C 113.005 0.743 . . . . 51.03 113.005 -179.319 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ASP . . . . . 0.648 ' OD2' ' O ' ' A' ' 301' ' ' HOH . 5.0 p-10 -85.03 2.83 41.46 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 113.715 1.006 . . . . 58.6 113.715 -169.077 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' GLY . . . . . . . . . . . . . . . 121.98 -30.92 5.12 Favored Glycine 0 C--N 1.336 0.541 0 CA-C-N 118.952 0.796 . . . . 54.16 114.517 172.129 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' ASN . . . . . . . . . . . . . 24.9 m120 -98.54 5.7 47.69 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 117.578 0.689 . . . . 74.18 112.806 -178.289 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 56.35 -140.87 42.13 Favored Glycine 0 N--CA 1.442 -0.909 0 N-CA-C 110.235 -1.146 . . . . 40.01 110.235 174.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' MET . . . . . . . . . . . . . 57.6 mtp -83.4 -0.91 52.01 Favored 'General case' 0 CA--C 1.51 -0.585 0 C-N-CA 118.43 -1.308 . . . . 36.73 112.388 -175.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 72.9 m-80 -62.89 -12.55 25.79 Favored 'General case' 0 C--O 1.232 0.158 0 C-N-CA 119.8 -0.76 . . . . 38.18 111.992 172.71 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -58.27 -26.76 63.34 Favored 'General case' 0 C--O 1.224 -0.271 0 C-N-CA 119.931 -0.707 . . . . 39.22 111.819 172.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' TRP . . . . . . . . . . . . . 21.1 m-90 -99.32 113.27 25.49 Favored 'General case' 0 C--N 1.332 -0.173 0 N-CA-C 107.808 -1.182 . . . . 36.64 107.808 -177.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' VAL . . . . . 0.466 HG23 ' O ' ' A' ' 328' ' ' HOH . 48.9 t -62.52 -38.83 82.4 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.189 0 C-N-CA 119.36 -0.936 . . . . 47.4 110.477 -174.882 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -64.14 -36.92 85.6 Favored 'General case' 0 CA--C 1.517 -0.323 0 C-N-CA 119.997 -0.681 . . . . 38.66 110.888 -177.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' TRP . . . . . . . . . . . . . 89.4 t90 -64.06 -46.71 83.14 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 119.202 -0.999 . . . . 37.1 110.852 177.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ARG . . . . . . . . . . . . . 26.8 ttp-105 -58.23 -39.83 80.12 Favored 'General case' 0 CA--C 1.515 -0.404 0 C-N-CA 120.462 -0.495 . . . . 59.04 110.502 178.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' ASN . . . . . . . . . . . . . 89.0 m-20 -93.34 -22.31 19.03 Favored 'General case' 0 CA--C 1.511 -0.528 0 N-CA-C 114.175 1.176 . . . . 38.72 114.175 -170.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 63.3 mtp180 -127.07 -9.13 5.94 Favored 'General case' 0 C--O 1.245 0.839 0 N-CA-C 113.874 1.065 . . . . 44.13 113.874 -170.584 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 86.4 m -122.91 -45.56 2.14 Favored 'General case' 0 CA--C 1.515 -0.371 0 CA-C-N 118.692 0.678 . . . . 36.02 112.309 -177.207 -59.511 -75.726 -93.159 104.162 2.012 102.833 -91.981 -172.912 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -52.64 127.36 22.7 Favored 'General case' 0 C--N 1.318 -0.799 0 N-CA-C 109.691 -0.485 . . . . 37.95 109.691 -177.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' GLY . . . . . . . . . . . . . . . 73.54 19.19 79.66 Favored Glycine 0 N--CA 1.45 -0.411 0 CA-C-N 115.536 -0.756 . . . . 48.96 114.938 175.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 15.1 p -112.52 174.65 5.78 Favored 'General case' 0 C--N 1.321 -0.672 0 N-CA-C 107.542 -1.281 . . . . 44.97 107.542 172.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' ASP . . . . . . . . . . . . . 50.3 t0 -79.29 89.1 4.92 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 106.705 -1.591 . . . . 65.81 106.705 176.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' VAL . . . . . . . . . . . . . 16.6 m -76.32 -21.91 15.37 Favored 'Isoleucine or valine' 0 C--O 1.234 0.263 0 C-N-CA 119.619 -0.833 . . . . 45.17 111.654 -178.293 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' GLN . . . . . . . . . . . . . 22.6 tm0? -55.19 -26.32 38.38 Favored 'General case' 0 C--N 1.331 -0.211 0 C-N-CA 120.065 -0.654 . . . . 87.71 111.092 175.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -61.42 -21.54 64.2 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.064 -0.655 . . . . 49.23 111.179 -176.981 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 94.2 m95 -74.89 -20.1 59.86 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 113.672 0.99 . . . . 46.36 113.672 -175.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 39.3 pt -112.41 -0.78 9.51 Favored 'Isoleucine or valine' 0 C--O 1.242 0.704 0 CA-C-N 118.155 0.434 . . . . 52.12 111.985 176.475 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' ARG . . . . . . . . . . . . . 29.4 ttm180 -50.9 132.12 26.79 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 121.342 0.592 . . . . 85.51 111.193 173.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 80.59 2.42 89.73 Favored Glycine 0 N--CA 1.445 -0.765 0 N-CA-C 115.8 1.08 . . . . 51.17 115.8 175.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' CYS . . . . . . . . . . . . . 36.6 m -92.37 143.79 26.03 Favored 'General case' 0 CA--C 1.519 -0.217 0 CA-C-N 118.641 1.221 . . . . 51.26 109.247 177.194 -51.747 -59.568 -66.838 105.427 2.017 102.502 -61.143 -63.67 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 11.5 ttp180 -86.27 105.71 16.84 Favored 'General case' 0 C--N 1.32 -0.716 0 N-CA-C 107.047 -1.464 . . . . 87.22 107.047 173.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' LEU . . . . . 0.764 ' HA ' ' O ' ' A' ' 311' ' ' HOH . 1.0 OUTLIER . . . . . 0 C--O 1.239 0.549 0 N-CA-C 108.715 -0.846 . . . . 82.99 108.715 -178.372 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . 0.648 ' O ' ' OD2' ' A' ' 119' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . 0.513 ' O ' ' NH1' ' A' ' 32' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' HOH . . . . . 0.455 ' O ' ' NH2' ' A' ' 91' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 311' ' ' HOH . . . . . 0.764 ' O ' ' HA ' ' A' ' 147' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 328' ' ' HOH . . . . . 0.466 ' O ' HG23 ' A' ' 127' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 347' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 348' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 349' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 350' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 351' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 352' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 353' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 354' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_