data_1csp_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 1csp _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.177 -2.734 0 N-CA-C 109.547 -0.538 . . . . 42.06 109.547 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . 0.25 73.2 mt -86.47 173.48 9.6 Favored 'General case' 0 N--CA 1.403 -2.796 0 C-N-CA 114.646 -2.821 . . . . 33.83 103.698 177.226 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . . . -131.6 128.6 39.5 Favored 'General case' 0 CA--C 1.498 -1.023 0 N-CA-C 103.241 -2.874 . . . . 31.87 103.241 -179.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -147.4 -163.61 10.7 Favored Glycine 0 C--N 1.304 -1.241 0 CA-C-O 123.488 1.605 . . . . 25.63 113.725 178.186 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.5 tttp -134.66 133.44 40.07 Favored 'General case' 0 N--CA 1.395 -3.22 0 N-CA-C 113.968 1.099 . . . . 59.48 113.968 -177.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 96.1 t -64.43 109.99 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.384 -3.755 0 N-CA-C 107.039 -1.467 . . . . 28.57 107.039 179.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.7 tttm -67.44 -42.86 82.45 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-O 122.553 1.168 . . . . 41.4 110.389 177.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 18.7 p-90 -170.68 145.5 2.5 Favored 'General case' 0 CA--C 1.452 -2.825 0 CA-C-N 113.287 -1.778 . . . . 35.55 108.612 -176.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -147.53 126.86 13.07 Favored 'General case' 0 CA--C 1.452 -2.816 0 CA-C-O 122.571 1.177 . . . . 41.2 108.079 178.25 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 38.3 t-20 -85.13 96.91 9.6 Favored 'General case' 0 N--CA 1.408 -2.532 0 N-CA-C 107.347 -1.353 . . . . 47.22 107.347 179.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.3 t -61.04 -20.5 62.61 Favored 'General case' 0 CA--C 1.566 1.579 0 N-CA-C 115.813 1.783 . . . . 49.2 115.813 -177.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -81.91 -47.25 12.99 Favored 'General case' 0 N--CA 1.413 -2.309 0 C-N-CA 116.239 -2.184 . . . . 59.19 113.457 177.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 14.4 mmtp -68.62 -31.71 71.07 Favored 'General case' 0 CA--C 1.573 1.844 0 C-N-CA 125.711 1.604 . . . . 60.0 114.436 179.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.93 26.11 27.52 Favored Glycine 0 C--N 1.291 -1.967 0 N-CA-C 117.721 1.849 . . . . 28.01 117.721 177.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 43.1 p90 -150.21 171.14 17.4 Favored 'General case' 0 C--O 1.198 -1.649 0 CA-C-N 119.586 1.693 . . . . 23.31 110.218 178.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 178.96 -160.7 26.48 Favored Glycine 0 N--CA 1.476 1.322 0 CA-C-O 115.97 -2.572 . . . . 18.35 111.63 177.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 34.8 m-85 -125.57 146.84 49.51 Favored 'General case' 0 C--O 1.171 -3.033 0 CA-C-N 119.386 1.593 . . . . 28.18 113.751 178.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . 11.7 mt -106.1 146.83 12.33 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.405 0 N-CA-C 107.356 -1.35 . . . . 24.95 107.356 177.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -107.92 133.34 52.4 Favored 'General case' 0 C--N 1.277 -2.557 0 N-CA-C 105.642 -1.985 . . . . 59.39 105.642 179.013 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -141.63 140.82 30.62 Favored 'Isoleucine or valine' 0 N--CA 1.401 -2.895 0 CA-C-O 115.033 -2.413 . . . . 50.6 104.624 178.97 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . . . -80.95 132.31 35.4 Favored 'General case' 0 C--N 1.283 -2.3 0 O-C-N 124.948 1.405 . . . . 60.0 112.212 -178.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 72.05 50.1 19.25 Favored Glycine 0 C--O 1.197 -2.2 0 CA-C-N 113.146 -1.843 . . . . 60.0 111.995 179.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . 0.286 20.1 mm-40 -171.99 175.52 3.79 Favored 'General case' 0 C--O 1.245 0.831 0 N-CA-C 101.762 -3.421 . . . . 60.0 101.762 177.812 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 43.9 m-20 -98.99 -177.5 3.65 Favored 'General case' 0 C--O 1.187 -2.214 0 C-N-CA 115.404 -2.518 . . . . 60.0 105.165 177.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 79.5 m-20 -66.79 142.12 57.48 Favored 'General case' 0 N--CA 1.427 -1.6 0 O-C-N 119.378 -2.076 . . . . 43.99 105.811 178.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 57.3 t -102.04 122.17 53.95 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.959 0 CA-C-O 118.429 -0.795 . . . . 30.89 111.549 -179.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -61.69 141.57 57.76 Favored 'General case' 0 C--N 1.352 0.702 0 CA-C-N 122.299 2.318 . . . . 20.59 106.793 179.133 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 6.1 p -136.83 132.43 47.7 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.295 0 O-C-N 119.683 -1.885 . . . . 17.08 109.057 179.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' HIS . . . . . 0.471 ' ND1' ' OG ' ' A' ' 31' ' ' SER . 50.3 t-80 -115.38 152.41 32.9 Favored 'General case' 0 C--O 1.16 -3.612 0 O-C-N 126.543 2.402 . . . . 14.62 105.237 -178.29 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 13.2 p90 -56.78 -25.19 54.85 Favored 'General case' 0 CA--C 1.484 -1.582 0 N-CA-C 118.494 2.776 . . . . 27.67 118.494 -178.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' SER . . . . . 0.471 ' OG ' ' ND1' ' A' ' 29' ' ' HIS . 4.3 p -69.1 -8.85 49.09 Favored 'General case' 0 C--O 1.198 -1.622 0 O-C-N 125.68 1.862 . . . . 26.09 112.065 -179.361 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -88.79 -15.43 34.64 Favored 'General case' 0 C--O 1.282 2.803 0 CA-C-O 121.471 0.653 . . . . 20.63 110.361 -179.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 57.4 mt -71.3 124.69 28.23 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.423 0 N-CA-C 114.795 1.406 . . . . 27.06 114.795 -178.91 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 92.6 mm-40 -89.53 154.32 20.09 Favored 'General case' 0 C--O 1.271 2.232 0 C-N-CA 127.207 2.203 . . . . 47.43 106.096 179.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.38 -173.18 14.58 Favored Glycine 0 N--CA 1.416 -2.653 0 C-N-CA 125.963 1.744 . . . . 55.74 110.393 -179.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . . . -117.56 154.28 31.79 Favored 'General case' 0 N--CA 1.404 -2.753 0 N-CA-C 103.149 -2.908 . . . . 50.74 103.149 -177.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 101.24 -176.68 26.92 Favored Glycine 0 CA--C 1.477 -2.314 0 C-N-CA 117.76 -2.162 . . . . 41.59 114.775 -178.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -62.35 127.54 31.8 Favored 'General case' 0 C--N 1.296 -1.757 0 CA-C-N 117.922 0.861 . . . . 30.75 110.142 -179.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 36.1 mmtm -80.43 113.77 18.85 Favored 'General case' 0 C--O 1.195 -1.805 0 O-C-N 118.563 -2.586 . . . . 43.26 111.543 -179.409 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 10.9 t -160.45 171.03 19.77 Favored 'General case' 0 CA--C 1.501 -0.937 0 CA-C-O 116.206 -1.854 . . . . 24.19 106.262 178.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 18.8 mt -149.32 151.6 34.42 Favored 'General case' 0 CA--C 1.488 -1.409 0 N-CA-C 105.446 -2.057 . . . . 26.59 105.446 -178.102 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -102.81 149.64 24.29 Favored 'General case' 0 N--CA 1.413 -2.3 0 C-N-CA 125.68 1.592 . . . . 56.53 112.767 178.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 74.3 tt0 -63.43 140.45 58.87 Favored 'General case' 0 CA--C 1.582 2.176 0 N-CA-C 103.139 -2.911 . . . . 56.75 103.139 178.193 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 93.31 -24.16 26.53 Favored Glycine 0 C--N 1.31 -0.902 0 N-CA-C 116.288 1.275 . . . . 30.84 116.288 177.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -62.41 142.6 57.78 Favored 'General case' 0 C--N 1.256 -3.484 0 N-CA-C 113.222 0.823 . . . . 43.97 113.222 -179.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -92.26 138.42 31.54 Favored 'General case' 0 N--CA 1.404 -2.77 0 C-N-CA 124.382 1.073 . . . . 29.03 108.711 176.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 2.8 m -142.23 151.82 18.35 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.152 0 N-CA-C 113.884 1.068 . . . . 31.49 113.884 179.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 19.9 m -108.53 132.13 54.15 Favored 'General case' 0 N--CA 1.424 -1.757 0 N-CA-C 105.008 -2.219 . . . . 34.16 105.008 176.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 6.9 p90 -154.93 175.17 14.13 Favored 'General case' 0 C--O 1.291 3.246 0 N-CA-C 112.748 0.647 . . . . 26.89 112.748 -179.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 70.5 mt-10 -121.21 155.7 34.02 Favored 'General case' 0 CA--C 1.439 -3.301 0 N-CA-C 106.035 -1.839 . . . . 33.41 106.035 175.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 73.8 mt -107.05 123.32 62.1 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.941 0 N-CA-C 103.05 -2.944 . . . . 25.96 103.05 176.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 62.8 t -116.18 128.05 73.6 Favored 'Isoleucine or valine' 0 C--O 1.186 -2.283 0 N-CA-C 104.959 -2.237 . . . . 24.66 104.959 -179.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -124.95 121.31 34.09 Favored 'General case' 1 C--O 1.152 -4.073 0 CA-C-O 124.967 2.318 . . . . 33.93 110.762 -176.753 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -116.05 -144.05 8.0 Favored Glycine 0 C--O 1.204 -1.739 0 CA-C-N 112.765 -2.016 . . . . 32.65 109.586 176.124 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ASN . . . . . 0.472 ' OD1' ' N ' ' A' ' 55' ' ' ASN . 3.8 p-10 -86.65 -8.4 57.48 Favored 'General case' 0 N--CA 1.407 -2.578 0 C-N-CA 116.791 -1.964 . . . . 42.38 113.729 -179.104 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -85.64 -2.85 58.6 Favored 'General case' 0 N--CA 1.412 -2.342 0 O-C-N 125.265 1.603 . . . . 32.67 112.665 176.186 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.12 176.12 29.05 Favored Glycine 0 CA--C 1.559 2.807 0 O-C-N 118.155 -2.841 . . . . 17.13 109.567 -177.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -74.66 138.68 24.25 Favored 'Trans proline' 0 C--O 1.205 -1.138 0 C-N-CA 122.862 2.375 . . . . 22.17 115.575 178.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 22.5 pt20 -146.63 161.31 40.81 Favored 'General case' 0 CA--C 1.476 -1.896 0 CA-C-O 117.016 -1.469 . . . . 27.21 107.374 176.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -78.22 149.43 33.66 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 121.603 2.001 . . . . 19.16 112.072 -178.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -141.73 153.43 44.61 Favored 'General case' 0 N--CA 1.398 -3.072 0 C-N-CA 117.757 -1.577 . . . . 15.43 107.157 177.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 55.58 47.24 21.24 Favored 'General case' 0 C--N 1.297 -1.682 0 N-CA-C 117.624 2.453 . . . . 43.87 117.624 -177.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 43.6 t -71.13 118.96 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.522 0 O-C-N 118.471 -2.643 . . . . 27.83 110.781 -179.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -117.56 137.84 52.31 Favored 'General case' 0 N--CA 1.412 -2.358 0 N-CA-C 106.847 -1.538 . . . . 33.46 106.847 178.379 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' LYS . . . . . 0.434 ' N ' ' O ' ' A' ' 111' ' ' HOH . 12.7 mttm -79.89 102.19 9.0 Favored 'General case' 0 N--CA 1.426 -1.646 0 CA-C-O 124.628 2.156 . . . . 50.47 108.823 -178.463 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . . . -90.29 -169.03 2.27 Favored 'General case' 0 C--N 1.381 1.964 0 N-CA-C 103.261 -2.866 . . . . 60.0 103.261 177.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.273 2.307 0 O-C-N 119.582 -1.949 . . . . 60.0 114.146 -177.809 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' HOH . . . . . 0.434 ' O ' ' N ' ' A' ' 65' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.177 -2.734 0 N-CA-C 109.547 -0.538 . . . . 42.06 109.547 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . 0.25 73.2 mt -86.47 173.48 9.6 Favored 'General case' 0 N--CA 1.403 -2.796 0 C-N-CA 114.646 -2.821 . . . . 33.83 103.698 177.226 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . . . -131.6 128.6 39.5 Favored 'General case' 0 CA--C 1.498 -1.023 0 N-CA-C 103.241 -2.874 . . . . 31.87 103.241 -179.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -147.4 -163.61 10.7 Favored Glycine 0 C--N 1.304 -1.241 0 CA-C-O 123.488 1.605 . . . . 25.63 113.725 178.186 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.5 tttp -134.66 133.44 40.07 Favored 'General case' 0 N--CA 1.395 -3.22 0 N-CA-C 113.968 1.099 . . . . 59.48 113.968 -177.292 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 96.1 t -64.43 109.99 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.384 -3.755 0 N-CA-C 107.039 -1.467 . . . . 28.57 107.039 179.379 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.7 tttm -67.44 -42.86 82.45 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-O 122.553 1.168 . . . . 41.4 110.389 177.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 18.7 p-90 -170.68 145.5 2.5 Favored 'General case' 0 CA--C 1.452 -2.825 0 CA-C-N 113.287 -1.778 . . . . 35.55 108.612 -176.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -147.53 126.86 13.07 Favored 'General case' 0 CA--C 1.452 -2.816 0 CA-C-O 122.571 1.177 . . . . 41.2 108.079 178.25 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 38.3 t-20 -85.13 96.91 9.6 Favored 'General case' 0 N--CA 1.408 -2.532 0 N-CA-C 107.347 -1.353 . . . . 47.22 107.347 179.129 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.3 t -61.04 -20.5 62.61 Favored 'General case' 0 CA--C 1.566 1.579 0 N-CA-C 115.813 1.783 . . . . 49.2 115.813 -177.756 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -81.91 -47.25 12.99 Favored 'General case' 0 N--CA 1.413 -2.309 0 C-N-CA 116.239 -2.184 . . . . 59.19 113.457 177.367 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 14.4 mmtp -68.62 -31.71 71.07 Favored 'General case' 0 CA--C 1.573 1.844 0 C-N-CA 125.711 1.604 . . . . 60.0 114.436 179.099 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.93 26.11 27.52 Favored Glycine 0 C--N 1.291 -1.967 0 N-CA-C 117.721 1.849 . . . . 28.01 117.721 177.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 43.1 p90 -150.21 171.14 17.4 Favored 'General case' 0 C--O 1.198 -1.649 0 CA-C-N 119.586 1.693 . . . . 23.31 110.218 178.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 178.96 -160.7 26.48 Favored Glycine 0 N--CA 1.476 1.322 0 CA-C-O 115.97 -2.572 . . . . 18.35 111.63 177.31 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 34.8 m-85 -125.57 146.84 49.51 Favored 'General case' 0 C--O 1.171 -3.033 0 CA-C-N 119.386 1.593 . . . . 28.18 113.751 178.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ILE . . . . . 0.47 HD13 HG21 ' A' ' 47' ' ' VAL . 11.7 mt -106.1 146.83 12.33 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.405 0 N-CA-C 107.356 -1.35 . . . . 24.95 107.356 177.745 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -107.92 133.34 52.4 Favored 'General case' 0 C--N 1.277 -2.557 0 N-CA-C 105.642 -1.985 . . . . 59.39 105.642 179.013 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -141.63 140.82 30.62 Favored 'Isoleucine or valine' 0 N--CA 1.401 -2.895 0 CA-C-O 115.033 -2.413 . . . . 50.6 104.624 178.97 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . . . -80.95 132.31 35.4 Favored 'General case' 0 C--N 1.283 -2.3 0 O-C-N 124.948 1.405 . . . . 60.0 112.212 -178.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLY . . . . . 0.578 ' O ' ' HG2' ' A' ' 23' ' ' GLN . . . 72.05 50.1 19.25 Favored Glycine 0 C--O 1.197 -2.2 0 CA-C-N 113.146 -1.843 . . . . 60.0 111.995 179.266 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLN . . . . . 0.578 ' HG2' ' O ' ' A' ' 22' ' ' GLY 0.286 20.1 mm-40 -171.99 175.52 3.79 Favored 'General case' 0 C--O 1.245 0.831 0 N-CA-C 101.762 -3.421 . . . . 60.0 101.762 177.812 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 43.9 m-20 -98.99 -177.5 3.65 Favored 'General case' 0 C--O 1.187 -2.214 0 C-N-CA 115.404 -2.518 . . . . 60.0 105.165 177.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 79.5 m-20 -66.79 142.12 57.48 Favored 'General case' 0 N--CA 1.427 -1.6 0 O-C-N 119.378 -2.076 . . . . 43.99 105.811 178.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 57.3 t -102.04 122.17 53.95 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.959 0 CA-C-O 118.429 -0.795 . . . . 30.89 111.549 -179.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -61.69 141.57 57.76 Favored 'General case' 0 C--N 1.352 0.702 0 CA-C-N 122.299 2.318 . . . . 20.59 106.793 179.133 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 6.1 p -136.83 132.43 47.7 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.295 0 O-C-N 119.683 -1.885 . . . . 17.08 109.057 179.682 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 50.3 t-80 -115.38 152.41 32.9 Favored 'General case' 0 C--O 1.16 -3.612 0 O-C-N 126.543 2.402 . . . . 14.62 105.237 -178.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 13.2 p90 -56.78 -25.19 54.85 Favored 'General case' 0 CA--C 1.484 -1.582 0 N-CA-C 118.494 2.776 . . . . 27.67 118.494 -178.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.3 p -69.1 -8.85 49.09 Favored 'General case' 0 C--O 1.198 -1.622 0 O-C-N 125.68 1.862 . . . . 26.09 112.065 -179.361 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -88.79 -15.43 34.64 Favored 'General case' 0 C--O 1.282 2.803 0 CA-C-O 121.471 0.653 . . . . 20.63 110.361 -179.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 57.4 mt -71.3 124.69 28.23 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.423 0 N-CA-C 114.795 1.406 . . . . 27.06 114.795 -178.91 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 92.6 mm-40 -89.53 154.32 20.09 Favored 'General case' 0 C--O 1.271 2.232 0 C-N-CA 127.207 2.203 . . . . 47.43 106.096 179.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.38 -173.18 14.58 Favored Glycine 0 N--CA 1.416 -2.653 0 C-N-CA 125.963 1.744 . . . . 55.74 110.393 -179.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . . . -117.56 154.28 31.79 Favored 'General case' 0 N--CA 1.404 -2.753 0 N-CA-C 103.149 -2.908 . . . . 50.74 103.149 -177.654 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 101.24 -176.68 26.92 Favored Glycine 0 CA--C 1.477 -2.314 0 C-N-CA 117.76 -2.162 . . . . 41.59 114.775 -178.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -62.35 127.54 31.8 Favored 'General case' 0 C--N 1.296 -1.757 0 CA-C-N 117.922 0.861 . . . . 30.75 110.142 -179.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 36.1 mmtm -80.43 113.77 18.85 Favored 'General case' 0 C--O 1.195 -1.805 0 O-C-N 118.563 -2.586 . . . . 43.26 111.543 -179.409 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 10.9 t -160.45 171.03 19.77 Favored 'General case' 0 CA--C 1.501 -0.937 0 CA-C-O 116.206 -1.854 . . . . 24.19 106.262 178.454 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 18.8 mt -149.32 151.6 34.42 Favored 'General case' 0 CA--C 1.488 -1.409 0 N-CA-C 105.446 -2.057 . . . . 26.59 105.446 -178.102 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -102.81 149.64 24.29 Favored 'General case' 0 N--CA 1.413 -2.3 0 C-N-CA 125.68 1.592 . . . . 56.53 112.767 178.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 74.3 tt0 -63.43 140.45 58.87 Favored 'General case' 0 CA--C 1.582 2.176 0 N-CA-C 103.139 -2.911 . . . . 56.75 103.139 178.193 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 93.31 -24.16 26.53 Favored Glycine 0 C--N 1.31 -0.902 0 N-CA-C 116.288 1.275 . . . . 30.84 116.288 177.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -62.41 142.6 57.78 Favored 'General case' 0 C--N 1.256 -3.484 0 N-CA-C 113.222 0.823 . . . . 43.97 113.222 -179.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -92.26 138.42 31.54 Favored 'General case' 0 N--CA 1.404 -2.77 0 C-N-CA 124.382 1.073 . . . . 29.03 108.711 176.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' VAL . . . . . 0.47 HG21 HD13 ' A' ' 18' ' ' ILE . 2.8 m -142.23 151.82 18.35 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.152 0 N-CA-C 113.884 1.068 . . . . 31.49 113.884 179.467 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 19.9 m -108.53 132.13 54.15 Favored 'General case' 0 N--CA 1.424 -1.757 0 N-CA-C 105.008 -2.219 . . . . 34.16 105.008 176.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 6.9 p90 -154.93 175.17 14.13 Favored 'General case' 0 C--O 1.291 3.246 0 N-CA-C 112.748 0.647 . . . . 26.89 112.748 -179.309 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 70.5 mt-10 -121.21 155.7 34.02 Favored 'General case' 0 CA--C 1.439 -3.301 0 N-CA-C 106.035 -1.839 . . . . 33.41 106.035 175.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 73.8 mt -107.05 123.32 62.1 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.941 0 N-CA-C 103.05 -2.944 . . . . 25.96 103.05 176.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 62.8 t -116.18 128.05 73.6 Favored 'Isoleucine or valine' 0 C--O 1.186 -2.283 0 N-CA-C 104.959 -2.237 . . . . 24.66 104.959 -179.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -124.95 121.31 34.09 Favored 'General case' 1 C--O 1.152 -4.073 0 CA-C-O 124.967 2.318 . . . . 33.93 110.762 -176.753 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -116.05 -144.05 8.0 Favored Glycine 0 C--O 1.204 -1.739 0 CA-C-N 112.765 -2.016 . . . . 32.65 109.586 176.124 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -86.65 -8.4 57.48 Favored 'General case' 0 N--CA 1.407 -2.578 0 C-N-CA 116.791 -1.964 . . . . 42.38 113.729 -179.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -85.64 -2.85 58.6 Favored 'General case' 0 N--CA 1.412 -2.342 0 O-C-N 125.265 1.603 . . . . 32.67 112.665 176.186 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.12 176.12 29.05 Favored Glycine 0 CA--C 1.559 2.807 0 O-C-N 118.155 -2.841 . . . . 17.13 109.567 -177.466 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -74.66 138.68 24.25 Favored 'Trans proline' 0 C--O 1.205 -1.138 0 C-N-CA 122.862 2.375 . . . . 22.17 115.575 178.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 22.5 pt20 -146.63 161.31 40.81 Favored 'General case' 0 CA--C 1.476 -1.896 0 CA-C-O 117.016 -1.469 . . . . 27.21 107.374 176.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -78.22 149.43 33.66 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 121.603 2.001 . . . . 19.16 112.072 -178.894 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -141.73 153.43 44.61 Favored 'General case' 0 N--CA 1.398 -3.072 0 C-N-CA 117.757 -1.577 . . . . 15.43 107.157 177.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 55.58 47.24 21.24 Favored 'General case' 0 C--N 1.297 -1.682 0 N-CA-C 117.624 2.453 . . . . 43.87 117.624 -177.674 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 43.6 t -71.13 118.96 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.522 0 O-C-N 118.471 -2.643 . . . . 27.83 110.781 -179.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -117.56 137.84 52.31 Favored 'General case' 0 N--CA 1.412 -2.358 0 N-CA-C 106.847 -1.538 . . . . 33.46 106.847 178.379 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 12.7 mttm -79.89 102.19 9.0 Favored 'General case' 0 N--CA 1.426 -1.646 0 CA-C-O 124.628 2.156 . . . . 50.47 108.823 -178.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . . . -90.29 -169.03 2.27 Favored 'General case' 0 C--N 1.381 1.964 0 N-CA-C 103.261 -2.866 . . . . 60.0 103.261 177.366 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.273 2.307 0 O-C-N 119.582 -1.949 . . . . 60.0 114.146 -177.809 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.177 -2.734 0 N-CA-C 109.547 -0.538 . . . . 42.06 109.547 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . 0.25 73.2 mt -86.47 173.48 9.6 Favored 'General case' 0 N--CA 1.403 -2.796 0 C-N-CA 114.646 -2.821 . . . . 33.83 103.698 177.226 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' GLU . . . . . . . . . . . . . . . -131.6 128.6 39.5 Favored 'General case' 0 CA--C 1.498 -1.023 0 N-CA-C 103.241 -2.874 . . . . 31.87 103.241 -179.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -147.4 -163.61 10.7 Favored Glycine 0 C--N 1.304 -1.241 0 CA-C-O 123.488 1.605 . . . . 25.63 113.725 178.186 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 5.5 tttp -134.66 133.44 40.07 Favored 'General case' 0 N--CA 1.395 -3.22 0 N-CA-C 113.968 1.099 . . . . 59.48 113.968 -177.292 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 96.1 t -64.43 109.99 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.384 -3.755 0 N-CA-C 107.039 -1.467 . . . . 28.57 107.039 179.379 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.7 tttm -67.44 -42.86 82.45 Favored 'General case' 0 N--CA 1.478 0.94 0 CA-C-O 122.553 1.168 . . . . 41.4 110.389 177.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 18.7 p-90 -170.68 145.5 2.5 Favored 'General case' 0 CA--C 1.452 -2.825 0 CA-C-N 113.287 -1.778 . . . . 35.55 108.612 -176.981 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 28.6 t80 -147.53 126.86 13.07 Favored 'General case' 0 CA--C 1.452 -2.816 0 CA-C-O 122.571 1.177 . . . . 41.2 108.079 178.25 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ASN . . . . . . . . . . . . . 38.3 t-20 -85.13 96.91 9.6 Favored 'General case' 0 N--CA 1.408 -2.532 0 N-CA-C 107.347 -1.353 . . . . 47.22 107.347 179.129 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 7.3 t -61.04 -20.5 62.61 Favored 'General case' 0 CA--C 1.566 1.579 0 N-CA-C 115.813 1.783 . . . . 49.2 115.813 -177.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -81.91 -47.25 12.99 Favored 'General case' 0 N--CA 1.413 -2.309 0 C-N-CA 116.239 -2.184 . . . . 59.19 113.457 177.367 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 14.4 mmtp -68.62 -31.71 71.07 Favored 'General case' 0 CA--C 1.573 1.844 0 C-N-CA 125.711 1.604 . . . . 60.0 114.436 179.099 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 88.93 26.11 27.52 Favored Glycine 0 C--N 1.291 -1.967 0 N-CA-C 117.721 1.849 . . . . 28.01 117.721 177.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' PHE . . . . . . . . . . . . . 43.1 p90 -150.21 171.14 17.4 Favored 'General case' 0 C--O 1.198 -1.649 0 CA-C-N 119.586 1.693 . . . . 23.31 110.218 178.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 178.96 -160.7 26.48 Favored Glycine 0 N--CA 1.476 1.322 0 CA-C-O 115.97 -2.572 . . . . 18.35 111.63 177.31 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' PHE . . . . . . . . . . . . . 34.8 m-85 -125.57 146.84 49.51 Favored 'General case' 0 C--O 1.171 -3.033 0 CA-C-N 119.386 1.593 . . . . 28.18 113.751 178.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ILE . . . . . 0.47 HD13 HG21 ' A' ' 47' ' ' VAL . 11.7 mt -106.1 146.83 12.33 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.405 0 N-CA-C 107.356 -1.35 . . . . 24.95 107.356 177.745 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -107.92 133.34 52.4 Favored 'General case' 0 C--N 1.277 -2.557 0 N-CA-C 105.642 -1.985 . . . . 59.39 105.642 179.013 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -141.63 140.82 30.62 Favored 'Isoleucine or valine' 0 N--CA 1.401 -2.895 0 CA-C-O 115.033 -2.413 . . . . 50.6 104.624 178.97 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . . . -80.95 132.31 35.4 Favored 'General case' 0 C--N 1.283 -2.3 0 O-C-N 124.948 1.405 . . . . 60.0 112.212 -178.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLY . . . . . 0.578 ' O ' ' HG2' ' A' ' 23' ' ' GLN . . . 72.05 50.1 19.25 Favored Glycine 0 C--O 1.197 -2.2 0 CA-C-N 113.146 -1.843 . . . . 60.0 111.995 179.266 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLN . . . . . 0.578 ' HG2' ' O ' ' A' ' 22' ' ' GLY 0.286 20.1 mm-40 -171.99 175.52 3.79 Favored 'General case' 0 C--O 1.245 0.831 0 N-CA-C 101.762 -3.421 . . . . 60.0 101.762 177.812 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 43.9 m-20 -98.99 -177.5 3.65 Favored 'General case' 0 C--O 1.187 -2.214 0 C-N-CA 115.404 -2.518 . . . . 60.0 105.165 177.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 79.5 m-20 -66.79 142.12 57.48 Favored 'General case' 0 N--CA 1.427 -1.6 0 O-C-N 119.378 -2.076 . . . . 43.99 105.811 178.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 57.3 t -102.04 122.17 53.95 Favored 'Isoleucine or valine' 0 N--CA 1.42 -1.959 0 CA-C-O 118.429 -0.795 . . . . 30.89 111.549 -179.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 89.0 t80 -61.69 141.57 57.76 Favored 'General case' 0 C--N 1.352 0.702 0 CA-C-N 122.299 2.318 . . . . 20.59 106.793 179.133 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 6.1 p -136.83 132.43 47.7 Favored 'Isoleucine or valine' 0 C--O 1.204 -1.295 0 O-C-N 119.683 -1.885 . . . . 17.08 109.057 179.682 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' HIS . . . . . . . . . . . . . 50.3 t-80 -115.38 152.41 32.9 Favored 'General case' 0 C--O 1.16 -3.612 0 O-C-N 126.543 2.402 . . . . 14.62 105.237 -178.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' PHE . . . . . . . . . . . . . 13.2 p90 -56.78 -25.19 54.85 Favored 'General case' 0 CA--C 1.484 -1.582 0 N-CA-C 118.494 2.776 . . . . 27.67 118.494 -178.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 4.3 p -69.1 -8.85 49.09 Favored 'General case' 0 C--O 1.198 -1.622 0 O-C-N 125.68 1.862 . . . . 26.09 112.065 -179.361 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -88.79 -15.43 34.64 Favored 'General case' 0 C--O 1.282 2.803 0 CA-C-O 121.471 0.653 . . . . 20.63 110.361 -179.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 57.4 mt -71.3 124.69 28.23 Favored 'Isoleucine or valine' 0 CA--C 1.488 -1.423 0 N-CA-C 114.795 1.406 . . . . 27.06 114.795 -178.91 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLN . . . . . . . . . . . . . 92.6 mm-40 -89.53 154.32 20.09 Favored 'General case' 0 C--O 1.271 2.232 0 C-N-CA 127.207 2.203 . . . . 47.43 106.096 179.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 116.38 -173.18 14.58 Favored Glycine 0 N--CA 1.416 -2.653 0 C-N-CA 125.963 1.744 . . . . 55.74 110.393 -179.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . . . -117.56 154.28 31.79 Favored 'General case' 0 N--CA 1.404 -2.753 0 N-CA-C 103.149 -2.908 . . . . 50.74 103.149 -177.654 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 101.24 -176.68 26.92 Favored Glycine 0 CA--C 1.477 -2.314 0 C-N-CA 117.76 -2.162 . . . . 41.59 114.775 -178.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -62.35 127.54 31.8 Favored 'General case' 0 C--N 1.296 -1.757 0 CA-C-N 117.922 0.861 . . . . 30.75 110.142 -179.402 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 36.1 mmtm -80.43 113.77 18.85 Favored 'General case' 0 C--O 1.195 -1.805 0 O-C-N 118.563 -2.586 . . . . 43.26 111.543 -179.409 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 10.9 t -160.45 171.03 19.77 Favored 'General case' 0 CA--C 1.501 -0.937 0 CA-C-O 116.206 -1.854 . . . . 24.19 106.262 178.454 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 18.8 mt -149.32 151.6 34.42 Favored 'General case' 0 CA--C 1.488 -1.409 0 N-CA-C 105.446 -2.057 . . . . 26.59 105.446 -178.102 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 21.7 mt-10 -102.81 149.64 24.29 Favored 'General case' 0 N--CA 1.413 -2.3 0 C-N-CA 125.68 1.592 . . . . 56.53 112.767 178.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 74.3 tt0 -63.43 140.45 58.87 Favored 'General case' 0 CA--C 1.582 2.176 0 N-CA-C 103.139 -2.911 . . . . 56.75 103.139 178.193 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 93.31 -24.16 26.53 Favored Glycine 0 C--N 1.31 -0.902 0 N-CA-C 116.288 1.275 . . . . 30.84 116.288 177.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -62.41 142.6 57.78 Favored 'General case' 0 C--N 1.256 -3.484 0 N-CA-C 113.222 0.823 . . . . 43.97 113.222 -179.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -92.26 138.42 31.54 Favored 'General case' 0 N--CA 1.404 -2.77 0 C-N-CA 124.382 1.073 . . . . 29.03 108.711 176.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' VAL . . . . . 0.47 HG21 HD13 ' A' ' 18' ' ' ILE . 2.8 m -142.23 151.82 18.35 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.152 0 N-CA-C 113.884 1.068 . . . . 31.49 113.884 179.467 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' SER . . . . . . . . . . . . . 19.9 m -108.53 132.13 54.15 Favored 'General case' 0 N--CA 1.424 -1.757 0 N-CA-C 105.008 -2.219 . . . . 34.16 105.008 176.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 6.9 p90 -154.93 175.17 14.13 Favored 'General case' 0 C--O 1.291 3.246 0 N-CA-C 112.748 0.647 . . . . 26.89 112.748 -179.309 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 70.5 mt-10 -121.21 155.7 34.02 Favored 'General case' 0 CA--C 1.439 -3.301 0 N-CA-C 106.035 -1.839 . . . . 33.41 106.035 175.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 73.8 mt -107.05 123.32 62.1 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.941 0 N-CA-C 103.05 -2.944 . . . . 25.96 103.05 176.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 62.8 t -116.18 128.05 73.6 Favored 'Isoleucine or valine' 0 C--O 1.186 -2.283 0 N-CA-C 104.959 -2.237 . . . . 24.66 104.959 -179.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 83.1 tt0 -124.95 121.31 34.09 Favored 'General case' 1 C--O 1.152 -4.073 0 CA-C-O 124.967 2.318 . . . . 33.93 110.762 -176.753 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -116.05 -144.05 8.0 Favored Glycine 0 C--O 1.204 -1.739 0 CA-C-N 112.765 -2.016 . . . . 32.65 109.586 176.124 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 3.8 p-10 -86.65 -8.4 57.48 Favored 'General case' 0 N--CA 1.407 -2.578 0 C-N-CA 116.791 -1.964 . . . . 42.38 113.729 -179.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -85.64 -2.85 58.6 Favored 'General case' 0 N--CA 1.412 -2.342 0 O-C-N 125.265 1.603 . . . . 32.67 112.665 176.186 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.12 176.12 29.05 Favored Glycine 0 CA--C 1.559 2.807 0 O-C-N 118.155 -2.841 . . . . 17.13 109.567 -177.466 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 89.1 Cg_endo -74.66 138.68 24.25 Favored 'Trans proline' 0 C--O 1.205 -1.138 0 C-N-CA 122.862 2.375 . . . . 22.17 115.575 178.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 22.5 pt20 -146.63 161.31 40.81 Favored 'General case' 0 CA--C 1.476 -1.896 0 CA-C-O 117.016 -1.469 . . . . 27.21 107.374 176.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -78.22 149.43 33.66 Favored 'General case' 0 N--CA 1.447 -0.577 0 CA-C-N 121.603 2.001 . . . . 19.16 112.072 -178.894 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -141.73 153.43 44.61 Favored 'General case' 0 N--CA 1.398 -3.072 0 C-N-CA 117.757 -1.577 . . . . 15.43 107.157 177.506 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 87.4 m-20 55.58 47.24 21.24 Favored 'General case' 0 C--N 1.297 -1.682 0 N-CA-C 117.624 2.453 . . . . 43.87 117.624 -177.674 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 43.6 t -71.13 118.96 16.6 Favored 'Isoleucine or valine' 0 N--CA 1.409 -2.522 0 O-C-N 118.471 -2.643 . . . . 27.83 110.781 -179.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -117.56 137.84 52.31 Favored 'General case' 0 N--CA 1.412 -2.358 0 N-CA-C 106.847 -1.538 . . . . 33.46 106.847 178.379 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 12.7 mttm -79.89 102.19 9.0 Favored 'General case' 0 N--CA 1.426 -1.646 0 CA-C-O 124.628 2.156 . . . . 50.47 108.823 -178.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . . . -90.29 -169.03 2.27 Favored 'General case' 0 C--N 1.381 1.964 0 N-CA-C 103.261 -2.866 . . . . 60.0 103.261 177.366 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.273 2.307 0 O-C-N 119.582 -1.949 . . . . 60.0 114.146 -177.809 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_