data_6nmw_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 6nmw _Structure_validation_residue.Date_analyzed 2019-04-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 . . . . . 0 C--O 1.255 1.379 0 CA-C-O 118.38 -0.819 . . . . 65.78 110.033 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 52.3 mt-30 -59.76 127.92 34.37 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 126.02 1.728 . . . . 59.48 110.167 -178.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 95.72 -10.8 68.56 Favored Glycine 0 C--O 1.199 -2.07 0 CA-C-O 118.147 -1.363 . . . . 37.44 113.063 179.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 67.9 m-20 -62.08 145.91 51.88 Favored 'General case' 0 N--CA 1.483 1.207 0 CA-C-N 119.182 1.491 . . . . 32.77 109.931 -178.209 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 43.2 mm -92.92 130.54 41.85 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 N-CA-C 107.046 -1.464 . . . . 23.48 107.046 175.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 33.6 m -124.3 163.65 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 N-CA-C 108.033 -1.099 . . . . 16.78 108.033 179.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 7.6 p -126.45 138.39 54.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 N-CA-C 107.234 -1.395 . . . . 18.66 107.234 177.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.06 129.84 41.05 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 108.592 -0.892 . . . . 13.04 108.592 177.503 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 98.8 mt -84.4 -29.28 26.32 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.661 0.784 . . . . 22.18 109.96 176.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -142.41 158.27 61.03 Favored Pre-proline 0 N--CA 1.483 1.208 0 C-N-CA 126.194 1.798 . . . . 30.69 107.674 -178.483 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -76.07 163.05 33.6 Favored 'Trans proline' 0 N--CA 1.44 -1.656 0 N-CA-C 108.97 -1.204 . . . . 18.27 108.97 176.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 55.8 t80 -151.99 129.55 11.47 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 109.087 -0.709 . . . . 29.6 109.087 176.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 80.9 m-20 -100.67 111.85 24.15 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-O 116.956 -1.497 . . . . 26.47 107.661 176.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -59.13 137.85 50.0 Favored Glycine 0 C--O 1.196 -2.243 0 CA-C-O 117.86 -1.522 . . . . 27.36 110.727 178.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 8.4 mt -95.09 -17.0 7.2 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 CA-C-N 118.28 1.04 . . . . 48.95 109.959 179.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -127.0 158.75 67.84 Favored Pre-proline 0 N--CA 1.479 0.981 0 CA-C-O 118.543 -0.742 . . . . 28.41 110.789 -177.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_exo -57.79 -28.01 80.41 Favored 'Trans proline' 0 C--O 1.187 -2.034 0 C-N-CA 122.746 2.298 . . . . 26.0 115.066 178.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 48.9 p-10 -81.39 0.82 35.69 Favored 'General case' 0 N--CA 1.488 1.445 0 CA-C-O 117.705 -1.14 . . . . 16.52 111.35 -178.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -99.87 150.37 22.44 Favored 'General case' 0 N--CA 1.481 1.122 0 CA-C-N 119.009 0.822 . . . . 22.71 111.712 -178.092 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 8.5 mt -90.43 144.18 26.04 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 107.503 -1.295 . . . . 25.13 107.503 170.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 56.5 m -105.2 131.48 52.61 Favored 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 104.4 -2.444 . . . . 21.24 104.4 170.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 27.5 p90 -140.99 165.85 26.42 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 119.496 1.044 . . . . 15.89 109.804 -179.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm -107.8 159.93 16.12 Favored 'General case' 0 C--O 1.254 1.294 0 O-C-N 124.985 1.428 . . . . 28.41 108.689 178.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -61.98 130.25 44.7 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 107.876 -1.157 . . . . 28.52 107.876 173.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 97.63 -13.31 64.18 Favored Glycine 0 C--O 1.203 -1.837 0 CA-C-O 118.713 -1.048 . . . . 14.34 112.616 179.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 56.2 tt0 -65.87 136.99 56.88 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-N 118.636 1.218 . . . . 13.57 109.303 179.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 42.9 mmtm -96.31 135.92 37.49 Favored 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 108.823 -0.806 . . . . 19.87 108.823 -179.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 49.6 mtm -135.21 150.31 50.07 Favored 'General case' 0 C--O 1.212 -0.905 0 N-CA-C 108.49 -0.93 . . . . 17.04 108.49 -178.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -101.15 125.04 47.74 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 106.354 -1.721 . . . . 33.46 106.354 175.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 96.6 t -77.09 124.74 36.05 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 N-CA-C 107.42 -1.326 . . . . 24.39 107.42 179.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 85.8 mt -95.81 -47.48 6.14 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 108.585 -0.894 . . . . 22.7 108.585 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -146.3 138.17 24.9 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-O 117.273 -1.346 . . . . 41.56 109.663 -177.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 78.8 mt-10 -98.8 131.24 45.08 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 105.811 -1.922 . . . . 33.04 105.811 174.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -136.5 47.86 2.16 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-O 117.236 -1.364 . . . . 33.89 109.252 -177.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 84.37 -121.38 5.53 Favored Glycine 0 N--CA 1.469 0.891 0 CA-C-O 116.705 -2.164 . . . . 31.29 111.892 179.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 22.1 tp10 -67.5 -36.6 81.4 Favored 'General case' 0 N--CA 1.482 1.125 0 CA-C-O 116.215 -1.85 . . . . 30.12 111.261 -177.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 59.0 m95 -107.87 136.15 48.08 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 119.742 -0.783 . . . . 23.43 110.49 -179.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' TRP . . . . . . . . . . . . . 52.8 m0 -115.06 146.41 41.31 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 118.587 -0.72 . . . . 23.52 110.184 178.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -84.54 131.54 34.62 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 105.845 -1.909 . . . . 21.2 105.845 172.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -141.93 169.41 17.65 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 123.956 0.785 . . . . 14.56 110.98 -176.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 80.5 tttt -125.52 126.78 45.39 Favored 'General case' 0 C--N 1.322 -0.603 0 O-C-N 124.642 1.214 . . . . 33.78 107.859 176.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 13.2 t -68.35 126.74 30.53 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 106.377 -1.712 . . . . 13.78 106.377 173.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 79.9 mt -74.54 -18.9 60.52 Favored 'General case' 0 N--CA 1.485 1.323 0 CA-C-O 118.038 -0.982 . . . . 23.32 109.109 176.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 33.0 tp -80.34 -52.33 7.82 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 123.679 0.612 . . . . 21.73 110.306 178.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 18.9 p -95.29 -19.31 20.1 Favored 'General case' 0 N--CA 1.484 1.273 0 CA-C-O 115.726 -2.083 . . . . 18.05 113.345 -174.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt 68.77 10.24 7.79 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 126.173 2.171 . . . . 33.59 109.59 -176.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 15.0 mttm -82.07 145.66 30.07 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 119.601 -0.839 . . . . 27.42 108.939 176.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 76.3 mt-10 -108.21 153.12 23.64 Favored 'General case' 0 N--CA 1.479 1.019 0 O-C-N 124.254 0.971 . . . . 25.9 109.657 179.583 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 174.49 176.74 43.1 Favored Glycine 0 C--N 1.312 -0.776 0 N-CA-C 110.032 -1.227 . . . . 14.59 110.032 178.233 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -87.35 145.66 26.23 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.259 -0.645 . . . . 19.81 109.259 -179.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 38.9 pt -133.31 148.13 67.75 Favored Pre-proline 0 N--CA 1.483 1.181 0 O-C-N 124.153 0.908 . . . . 16.9 108.993 179.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -73.12 120.11 6.41 Favored 'Trans proline' 0 C--O 1.192 -1.805 0 N-CA-C 106.659 -2.093 . . . . 17.21 106.659 176.01 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 92.4 p -63.03 -24.1 67.76 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 123.698 0.799 . . . . 21.47 112.397 -174.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -75.65 -8.2 56.2 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-O 117.957 -1.021 . . . . 35.25 110.946 -179.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -94.4 -0.96 54.46 Favored 'General case' 0 N--CA 1.483 1.207 0 CA-C-O 117.08 -1.438 . . . . 24.56 111.23 -179.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 18.0 m -129.75 161.17 39.84 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.411 0 CA-C-N 119.218 0.917 . . . . 15.98 110.163 -176.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -133.99 148.68 51.15 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 106.949 -1.5 . . . . 21.53 106.949 175.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' LYS . . . . . . . . . . . . . 12.8 mmtt -62.89 141.6 58.62 Favored 'General case' 0 C--O 1.205 -1.274 0 N-CA-C 107.265 -1.383 . . . . 49.21 107.265 176.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 10.8 tp -65.63 -28.35 69.05 Favored 'General case' 0 CA--C 1.574 1.873 0 N-CA-C 105.087 -2.19 . . . . 29.03 105.087 170.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 46.4 t-20 -107.59 99.55 9.04 Favored 'General case' 0 N--CA 1.509 2.478 0 C-N-CA 128.445 2.698 . . . . 52.29 109.689 175.17 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 44.0 p -102.86 -12.9 17.22 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 119.467 -0.893 . . . . 48.53 111.384 -177.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 25.3 tp -75.79 -42.64 49.5 Favored 'General case' 0 N--CA 1.487 1.382 0 CA-C-O 116.975 -1.488 . . . . 49.6 111.976 -178.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 . . . . . 0 N--CA 1.489 1.502 0 C-N-CA 118.965 -1.094 . . . . 58.8 111.181 -175.481 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 . . . . . 0 C--O 1.255 1.379 0 CA-C-O 118.38 -0.819 . . . . 56.479999999999997 110.033 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 52.3 mt-30 -59.76 127.92 34.37 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 126.02 1.728 . . . . 49.979999999999997 110.167 -178.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 95.72 -10.8 68.56 Favored Glycine 0 C--O 1.199 -2.07 0 CA-C-O 118.147 -1.363 . . . . 31.170000000000002 113.063 179.056 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 67.9 m-20 -62.08 145.91 51.88 Favored 'General case' 0 N--CA 1.483 1.207 0 CA-C-N 119.182 1.491 . . . . 32.770000000000003 109.931 -178.209 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 43.2 mm -92.92 130.54 41.85 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 N-CA-C 107.046 -1.464 . . . . 19.539999999999999 107.046 175.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' VAL . . . . . 0.411 HG12 ' HD3' ' A' ' 120' ' ' LYS . 33.6 m -124.3 163.65 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 N-CA-C 108.033 -1.099 . . . . 13.960000000000001 108.033 179.214 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 7.6 p -126.45 138.39 54.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 N-CA-C 107.234 -1.395 . . . . 15.52 107.234 177.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.06 129.84 41.05 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 108.592 -0.892 . . . . 11.199999999999999 108.592 177.503 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 98.8 mt -84.4 -29.28 26.32 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.661 0.784 . . . . 18.460000000000001 109.96 176.016 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -142.41 158.27 61.03 Favored Pre-proline 0 N--CA 1.483 1.208 0 C-N-CA 126.194 1.798 . . . . 25.550000000000001 107.674 -178.483 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -76.07 163.05 33.6 Favored 'Trans proline' 0 N--CA 1.44 -1.656 0 N-CA-C 108.97 -1.204 . . . . 15.199999999999999 108.97 176.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 55.8 t80 -151.99 129.55 11.47 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 109.087 -0.709 . . . . 24.649999999999999 109.087 176.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 80.9 m-20 -100.67 111.85 24.15 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-O 116.956 -1.497 . . . . 26.469999999999999 107.661 176.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -59.13 137.85 50.0 Favored Glycine 0 C--O 1.196 -2.243 0 CA-C-O 117.86 -1.522 . . . . 26.030000000000001 110.727 178.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 8.4 mt -95.09 -17.0 7.2 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 CA-C-N 118.28 1.04 . . . . 40.770000000000003 109.959 179.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -127.0 158.75 67.84 Favored Pre-proline 0 N--CA 1.479 0.981 0 CA-C-O 118.543 -0.742 . . . . 23.649999999999999 110.789 -177.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_exo -57.79 -28.01 80.41 Favored 'Trans proline' 0 C--O 1.187 -2.034 0 C-N-CA 122.746 2.298 . . . . 21.640000000000001 115.066 178.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 48.9 p-10 -81.39 0.82 35.69 Favored 'General case' 0 N--CA 1.488 1.445 0 CA-C-O 117.705 -1.14 . . . . 14.84 111.35 -178.229 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -99.87 150.37 22.44 Favored 'General case' 0 N--CA 1.481 1.122 0 CA-C-N 119.009 0.822 . . . . 22.710000000000001 111.712 -178.092 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 8.5 mt -90.43 144.18 26.04 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 107.503 -1.295 . . . . 21.739999999999998 107.503 170.365 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 56.5 m -105.2 131.48 52.61 Favored 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 104.4 -2.444 . . . . 19.09 104.4 170.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 27.5 p90 -140.99 165.85 26.42 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 119.496 1.044 . . . . 13.220000000000001 109.804 -179.052 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm -107.8 159.93 16.12 Favored 'General case' 0 C--O 1.254 1.294 0 O-C-N 124.985 1.428 . . . . 23.649999999999999 108.689 178.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -61.98 130.25 44.7 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 107.876 -1.157 . . . . 23.739999999999998 107.876 173.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 97.63 -13.31 64.18 Favored Glycine 0 C--O 1.203 -1.837 0 CA-C-O 118.713 -1.048 . . . . 12.5 112.616 179.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 56.2 tt0 -65.87 136.99 56.88 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-N 118.636 1.218 . . . . 12.6 109.303 179.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 42.9 mmtm -96.31 135.92 37.49 Favored 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 108.823 -0.806 . . . . 16.530000000000001 108.823 -179.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 49.6 mtm -135.21 150.31 50.07 Favored 'General case' 0 C--O 1.212 -0.905 0 N-CA-C 108.49 -0.93 . . . . 14.18 108.49 -178.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -101.15 125.04 47.74 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 106.354 -1.721 . . . . 27.859999999999999 106.354 175.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 96.6 t -77.09 124.74 36.05 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 N-CA-C 107.42 -1.326 . . . . 20.300000000000001 107.42 179.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 85.8 mt -95.81 -47.48 6.14 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 108.585 -0.894 . . . . 19.890000000000001 108.585 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -146.3 138.17 24.9 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-O 117.273 -1.346 . . . . 41.560000000000002 109.663 -177.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 78.8 mt-10 -98.8 131.24 45.08 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 105.811 -1.922 . . . . 33.039999999999999 105.811 174.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -136.5 47.86 2.16 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-O 117.236 -1.364 . . . . 28.43 109.252 -177.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 84.37 -121.38 5.53 Favored Glycine 0 N--CA 1.469 0.891 0 CA-C-O 116.705 -2.164 . . . . 27.420000000000002 111.892 179.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 22.1 tp10 -67.5 -36.6 81.4 Favored 'General case' 0 N--CA 1.482 1.125 0 CA-C-O 116.215 -1.85 . . . . 28.059999999999999 111.261 -177.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 59.0 m95 -107.87 136.15 48.08 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 119.742 -0.783 . . . . 19.5 110.49 -179.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' TRP . . . . . . . . . . . . . 52.8 m0 -115.06 146.41 41.31 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 118.587 -0.72 . . . . 19.579999999999998 110.184 178.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -84.54 131.54 34.62 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 105.845 -1.909 . . . . 17.640000000000001 105.845 172.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -141.93 169.41 17.65 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 123.956 0.785 . . . . 12.109999999999999 110.98 -176.53 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 80.5 tttt -125.52 126.78 45.39 Favored 'General case' 0 C--N 1.322 -0.603 0 O-C-N 124.642 1.214 . . . . 28.120000000000001 107.859 176.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 13.2 t -68.35 126.74 30.53 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 106.377 -1.712 . . . . 11.960000000000001 106.377 173.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 79.9 mt -74.54 -18.9 60.52 Favored 'General case' 0 N--CA 1.485 1.323 0 CA-C-O 118.038 -0.982 . . . . 19.41 109.109 176.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 33.0 tp -80.34 -52.33 7.82 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 123.679 0.612 . . . . 18.09 110.306 178.323 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 18.9 p -95.29 -19.31 20.1 Favored 'General case' 0 N--CA 1.484 1.273 0 CA-C-O 115.726 -2.083 . . . . 16.82 113.345 -174.101 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt 68.77 10.24 7.79 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 126.173 2.171 . . . . 27.960000000000001 109.59 -176.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 15.0 mttm -82.07 145.66 30.07 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 119.601 -0.839 . . . . 22.82 108.939 176.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 76.3 mt-10 -108.21 153.12 23.64 Favored 'General case' 0 N--CA 1.479 1.019 0 O-C-N 124.254 0.971 . . . . 25.899999999999999 109.657 179.583 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 174.49 176.74 43.1 Favored Glycine 0 C--N 1.312 -0.776 0 N-CA-C 110.032 -1.227 . . . . 12.26 110.032 178.233 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -87.35 145.66 26.23 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.259 -0.645 . . . . 16.489999999999998 109.259 -179.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 38.9 pt -133.31 148.13 67.75 Favored Pre-proline 0 N--CA 1.483 1.181 0 O-C-N 124.153 0.908 . . . . 14.06 108.993 179.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -73.12 120.11 6.41 Favored 'Trans proline' 0 C--O 1.192 -1.805 0 N-CA-C 106.659 -2.093 . . . . 14.32 106.659 176.01 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 92.4 p -63.03 -24.1 67.76 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 123.698 0.799 . . . . 17.870000000000001 112.397 -174.189 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -75.65 -8.2 56.2 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-O 117.957 -1.021 . . . . 30.050000000000001 110.946 -179.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -94.4 -0.96 54.46 Favored 'General case' 0 N--CA 1.483 1.207 0 CA-C-O 117.08 -1.438 . . . . 20.440000000000001 111.23 -179.096 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 18.0 m -129.75 161.17 39.84 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.411 0 CA-C-N 119.218 0.917 . . . . 14.83 110.163 -176.418 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -133.99 148.68 51.15 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 106.949 -1.5 . . . . 17.920000000000002 106.949 175.474 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' LYS . . . . . 0.411 ' HD3' HG12 ' A' ' 68' ' ' VAL . 12.8 mmtt -62.89 141.6 58.62 Favored 'General case' 0 C--O 1.205 -1.274 0 N-CA-C 107.265 -1.383 . . . . 40.979999999999997 107.265 176.051 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 10.8 tp -65.63 -28.35 69.05 Favored 'General case' 0 CA--C 1.574 1.873 0 N-CA-C 105.087 -2.19 . . . . 29.030000000000001 105.087 170.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 46.4 t-20 -107.59 99.55 9.04 Favored 'General case' 0 N--CA 1.509 2.478 0 C-N-CA 128.445 2.698 . . . . 44.210000000000001 109.689 175.17 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 44.0 p -102.86 -12.9 17.22 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 119.467 -0.893 . . . . 40.420000000000002 111.384 -177.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 25.3 tp -75.79 -42.64 49.5 Favored 'General case' 0 N--CA 1.487 1.382 0 CA-C-O 116.975 -1.488 . . . . 43.670000000000002 111.976 -178.105 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 . . . . . 0 N--CA 1.489 1.502 0 C-N-CA 118.965 -1.094 . . . . 53.659999999999997 111.181 -175.481 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 . . . . . 0 C--O 1.255 1.379 0 CA-C-O 118.38 -0.819 . . . . 56.48 110.033 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 52.3 mt-30 -59.76 127.92 34.37 Favored 'General case' 0 N--CA 1.487 1.394 0 C-N-CA 126.02 1.728 . . . . 49.98 110.167 -178.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . 95.72 -10.8 68.56 Favored Glycine 0 C--O 1.199 -2.07 0 CA-C-O 118.147 -1.363 . . . . 31.17 113.063 179.056 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 67.9 m-20 -62.08 145.91 51.88 Favored 'General case' 0 N--CA 1.483 1.207 0 CA-C-N 119.182 1.491 . . . . 32.77 109.931 -178.209 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 43.2 mm -92.92 130.54 41.85 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.158 0 N-CA-C 107.046 -1.464 . . . . 19.54 107.046 175.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.411 HG12 ' HD3' ' A' ' 120' ' ' LYS . 33.6 m -124.3 163.65 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.154 0 N-CA-C 108.033 -1.099 . . . . 13.96 108.033 179.214 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 7.6 p -126.45 138.39 54.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.001 0 N-CA-C 107.234 -1.395 . . . . 15.52 107.234 177.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.06 129.84 41.05 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 108.592 -0.892 . . . . 11.2 108.592 177.503 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 98.8 mt -84.4 -29.28 26.32 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.661 0.784 . . . . 18.46 109.96 176.016 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -142.41 158.27 61.03 Favored Pre-proline 0 N--CA 1.483 1.208 0 C-N-CA 126.194 1.798 . . . . 25.55 107.674 -178.483 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -76.07 163.05 33.6 Favored 'Trans proline' 0 N--CA 1.44 -1.656 0 N-CA-C 108.97 -1.204 . . . . 15.2 108.97 176.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 55.8 t80 -151.99 129.55 11.47 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 109.087 -0.709 . . . . 24.65 109.087 176.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 80.9 m-20 -100.67 111.85 24.15 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-O 116.956 -1.497 . . . . 26.47 107.661 176.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -59.13 137.85 50.0 Favored Glycine 0 C--O 1.196 -2.243 0 CA-C-O 117.86 -1.522 . . . . 26.03 110.727 178.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 8.4 mt -95.09 -17.0 7.2 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.376 0 CA-C-N 118.28 1.04 . . . . 40.77 109.959 179.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 98.5 m-70 -127.0 158.75 67.84 Favored Pre-proline 0 N--CA 1.479 0.981 0 CA-C-O 118.543 -0.742 . . . . 23.65 110.789 -177.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 69.0 Cg_exo -57.79 -28.01 80.41 Favored 'Trans proline' 0 C--O 1.187 -2.034 0 C-N-CA 122.746 2.298 . . . . 21.64 115.066 178.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 48.9 p-10 -81.39 0.82 35.69 Favored 'General case' 0 N--CA 1.488 1.445 0 CA-C-O 117.705 -1.14 . . . . 14.84 111.35 -178.229 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -99.87 150.37 22.44 Favored 'General case' 0 N--CA 1.481 1.122 0 CA-C-N 119.009 0.822 . . . . 22.71 111.712 -178.092 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 8.5 mt -90.43 144.18 26.04 Favored 'General case' 0 N--CA 1.481 1.101 0 N-CA-C 107.503 -1.295 . . . . 21.74 107.503 170.365 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 56.5 m -105.2 131.48 52.61 Favored 'General case' 0 C--N 1.313 -0.987 0 N-CA-C 104.4 -2.444 . . . . 19.09 104.4 170.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 27.5 p90 -140.99 165.85 26.42 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 119.496 1.044 . . . . 13.22 109.804 -179.052 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 47.4 mmtm -107.8 159.93 16.12 Favored 'General case' 0 C--O 1.254 1.294 0 O-C-N 124.985 1.428 . . . . 23.65 108.689 178.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -61.98 130.25 44.7 Favored 'General case' 0 C--N 1.307 -1.256 0 N-CA-C 107.876 -1.157 . . . . 23.74 107.876 173.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 97.63 -13.31 64.18 Favored Glycine 0 C--O 1.203 -1.837 0 CA-C-O 118.713 -1.048 . . . . 12.5 112.616 179.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 56.2 tt0 -65.87 136.99 56.88 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-N 118.636 1.218 . . . . 12.6 109.303 179.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 42.9 mmtm -96.31 135.92 37.49 Favored 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 108.823 -0.806 . . . . 16.53 108.823 -179.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 49.6 mtm -135.21 150.31 50.07 Favored 'General case' 0 C--O 1.212 -0.905 0 N-CA-C 108.49 -0.93 . . . . 14.18 108.49 -178.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -101.15 125.04 47.74 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 106.354 -1.721 . . . . 27.86 106.354 175.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 96.6 t -77.09 124.74 36.05 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 N-CA-C 107.42 -1.326 . . . . 20.3 107.42 179.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 85.8 mt -95.81 -47.48 6.14 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 108.585 -0.894 . . . . 19.89 108.585 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 54.6 mt-10 -146.3 138.17 24.9 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-O 117.273 -1.346 . . . . 41.56 109.663 -177.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 78.8 mt-10 -98.8 131.24 45.08 Favored 'General case' 0 N--CA 1.475 0.779 0 N-CA-C 105.811 -1.922 . . . . 33.04 105.811 174.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 95.6 m-70 -136.5 47.86 2.16 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-O 117.236 -1.364 . . . . 28.43 109.252 -177.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' GLY . . . . . . . . . . . . . . . 84.37 -121.38 5.53 Favored Glycine 0 N--CA 1.469 0.891 0 CA-C-O 116.705 -2.164 . . . . 27.42 111.892 179.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 22.1 tp10 -67.5 -36.6 81.4 Favored 'General case' 0 N--CA 1.482 1.125 0 CA-C-O 116.215 -1.85 . . . . 28.06 111.261 -177.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' TRP . . . . . . . . . . . . . 59.0 m95 -107.87 136.15 48.08 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 119.742 -0.783 . . . . 19.5 110.49 -179.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' TRP . . . . . . . . . . . . . 52.8 m0 -115.06 146.41 41.31 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-O 118.587 -0.72 . . . . 19.58 110.184 178.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -84.54 131.54 34.62 Favored 'General case' 0 N--CA 1.476 0.83 0 N-CA-C 105.845 -1.909 . . . . 17.64 105.845 172.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -141.93 169.41 17.65 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 123.956 0.785 . . . . 12.11 110.98 -176.53 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 80.5 tttt -125.52 126.78 45.39 Favored 'General case' 0 C--N 1.322 -0.603 0 O-C-N 124.642 1.214 . . . . 28.12 107.859 176.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 13.2 t -68.35 126.74 30.53 Favored 'General case' 0 C--N 1.316 -0.86 0 N-CA-C 106.377 -1.712 . . . . 11.96 106.377 173.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' LEU . . . . . . . . . . . . . 79.9 mt -74.54 -18.9 60.52 Favored 'General case' 0 N--CA 1.485 1.323 0 CA-C-O 118.038 -0.982 . . . . 19.41 109.109 176.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' LEU . . . . . . . . . . . . . 33.0 tp -80.34 -52.33 7.82 Favored 'General case' 0 N--CA 1.483 1.192 0 O-C-N 123.679 0.612 . . . . 18.09 110.306 178.323 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 18.9 p -95.29 -19.31 20.1 Favored 'General case' 0 N--CA 1.484 1.273 0 CA-C-O 115.726 -2.083 . . . . 16.82 113.345 -174.101 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 70.3 mmtt 68.77 10.24 7.79 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 126.173 2.171 . . . . 27.96 109.59 -176.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 15.0 mttm -82.07 145.66 30.07 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 119.601 -0.839 . . . . 22.82 108.939 176.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 76.3 mt-10 -108.21 153.12 23.64 Favored 'General case' 0 N--CA 1.479 1.019 0 O-C-N 124.254 0.971 . . . . 25.9 109.657 179.583 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 174.49 176.74 43.1 Favored Glycine 0 C--N 1.312 -0.776 0 N-CA-C 110.032 -1.227 . . . . 12.26 110.032 178.233 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 56.4 m-85 -87.35 145.66 26.23 Favored 'General case' 0 C--N 1.32 -0.717 0 N-CA-C 109.259 -0.645 . . . . 16.49 109.259 -179.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 38.9 pt -133.31 148.13 67.75 Favored Pre-proline 0 N--CA 1.483 1.181 0 O-C-N 124.153 0.908 . . . . 14.06 108.993 179.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' PRO . . . . . . . . . . . . . 28.3 Cg_endo -73.12 120.11 6.41 Favored 'Trans proline' 0 C--O 1.192 -1.805 0 N-CA-C 106.659 -2.093 . . . . 14.32 106.659 176.01 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' SER . . . . . . . . . . . . . 92.4 p -63.03 -24.1 67.76 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 123.698 0.799 . . . . 17.87 112.397 -174.189 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -75.65 -8.2 56.2 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-O 117.957 -1.021 . . . . 30.05 110.946 -179.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -94.4 -0.96 54.46 Favored 'General case' 0 N--CA 1.483 1.207 0 CA-C-O 117.08 -1.438 . . . . 20.44 111.23 -179.096 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 18.0 m -129.75 161.17 39.84 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.411 0 CA-C-N 119.218 0.917 . . . . 14.83 110.163 -176.418 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -133.99 148.68 51.15 Favored 'General case' 0 C--N 1.32 -0.694 0 N-CA-C 106.949 -1.5 . . . . 17.92 106.949 175.474 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' LYS . . . . . 0.411 ' HD3' HG12 ' A' ' 68' ' ' VAL . 12.8 mmtt -62.89 141.6 58.62 Favored 'General case' 0 C--O 1.205 -1.274 0 N-CA-C 107.265 -1.383 . . . . 40.98 107.265 176.051 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' LEU . . . . . . . . . . . . . 10.8 tp -65.63 -28.35 69.05 Favored 'General case' 0 CA--C 1.574 1.873 0 N-CA-C 105.087 -2.19 . . . . 29.03 105.087 170.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 46.4 t-20 -107.59 99.55 9.04 Favored 'General case' 0 N--CA 1.509 2.478 0 C-N-CA 128.445 2.698 . . . . 44.21 109.689 175.17 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' THR . . . . . . . . . . . . . 44.0 p -102.86 -12.9 17.22 Favored 'General case' 0 N--CA 1.491 1.616 0 C-N-CA 119.467 -0.893 . . . . 40.42 111.384 -177.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' LEU . . . . . . . . . . . . . 25.3 tp -75.79 -42.64 49.5 Favored 'General case' 0 N--CA 1.487 1.382 0 CA-C-O 116.975 -1.488 . . . . 43.67 111.976 -178.105 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 . . . . . 0 N--CA 1.489 1.502 0 C-N-CA 118.965 -1.094 . . . . 53.66 111.181 -175.481 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_