data_3s8l_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 3s8l _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 ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 1.982 0 CA-C-O 121.436 0.636 . . . . 71.310000000000002 109.686 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.24 116.5 19.54 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 117.773 2.509 . . . . 70.549999999999997 117.773 -158.219 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 4.6 mtpp -108.9 146.21 33.31 Favored Pre-proline 0 C--O 1.211 -0.954 0 C-N-CA 124.881 1.272 . . . . 53.829999999999998 111.759 177.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -65.47 155.28 69.65 Favored 'Trans proline' 0 CA--C 1.548 1.22 0 C-N-CA 115.676 -2.416 . . . . 32.82 111.545 174.206 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -72.0 138.2 82.19 Favored Pre-proline 0 N--CA 1.476 0.836 0 O-C-N 120.624 -1.297 . . . . 28.690000000000001 114.0 177.355 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -78.26 1.23 9.18 Favored 'Trans proline' 0 N--CA 1.44 -1.632 0 O-C-N 122.91 0.953 . . . . 27.75 113.547 -175.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 32.2 p-90 -108.91 -2.17 18.54 Favored 'General case' 0 C--O 1.209 -1.078 0 N-CA-C 113.506 0.928 . . . . 24.16 113.506 -171.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -97.97 112.65 24.51 Favored 'General case' 0 C--O 1.198 -1.627 0 C-N-CA 117.013 -1.875 . . . . 27.969999999999999 112.717 -177.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' PHE . . . . . . . . . . . . . 26.5 m-85 -110.06 5.97 22.56 Favored 'General case' 0 C--O 1.259 1.583 0 O-C-N 124.721 1.263 . . . . 30.719999999999999 112.847 -170.328 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 58.91 -141.74 46.77 Favored Glycine 0 N--CA 1.474 1.196 0 CA-C-O 122.667 1.148 . . . . 22.390000000000001 112.855 178.611 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 20.3 tttt -83.69 59.12 4.98 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 121.571 -0.958 . . . . 46.659999999999997 113.122 -175.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 16.9 pt -84.02 147.17 50.4 Favored Pre-proline 0 C--O 1.246 0.9 0 C-N-CA 114.903 -2.719 . . . . 37.829999999999998 112.074 168.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_exo -61.81 149.57 89.54 Favored 'Trans proline' 0 CA--C 1.486 -1.912 0 C-N-CA 118.069 -0.82 . . . . 26.629999999999999 113.235 177.154 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 41.9 ttt85 -43.19 -45.25 5.53 Favored 'General case' 0 C--O 1.257 1.456 0 O-C-N 125.111 1.507 . . . . 25.09 112.667 169.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.22 -37.08 77.87 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.916 -1.115 . . . . 23.68 110.276 -175.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LYS . . . . . 0.741 ' NZ ' ' CB ' ' A' ' 69' ' ' LYS . 1.8 mmmp? -67.5 -38.88 84.98 Favored 'General case' 0 C--O 1.166 -3.321 0 O-C-N 121.735 -0.603 . . . . 50.07 110.927 -179.216 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.62 -45.77 77.47 Favored 'General case' 0 N--CA 1.501 2.121 0 CA-C-O 119.532 -0.27 . . . . 25.120000000000001 110.74 170.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 -60.76 -45.73 93.18 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-O 120.712 0.291 . . . . 39.270000000000003 111.372 176.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 61.8 tt0 -56.38 -40.39 74.52 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 113.666 0.987 . . . . 32.25 113.666 176.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' MET . . . . . . . . . . . . . 12.7 tmm? -81.1 -45.46 16.42 Favored 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 105.046 -2.205 . . . . 43.700000000000003 105.046 -172.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 55.8 mt -62.88 -28.1 69.8 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 115.861 1.8 . . . . 26.23 115.861 -179.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 75.0 m -66.77 -13.15 61.12 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 119.048 -1.061 . . . . 27.59 112.069 -179.242 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 44.0 mtmt -96.53 -8.6 31.56 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 124.253 0.971 . . . . 36.659999999999997 112.633 -178.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 88.9 mm-40 -75.65 147.7 39.3 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 119.021 -1.072 . . . . 29.199999999999999 108.776 175.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 81.4 mtt180 -92.12 -25.15 18.87 Favored 'General case' 0 C--O 1.261 1.658 0 O-C-N 120.383 -1.448 . . . . 27.34 113.591 -175.5 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -109.57 126.03 53.16 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.404 0.52 . . . . 32.100000000000001 112.404 -165.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 82.6 m-20 -56.12 141.66 39.68 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 120.646 -0.422 . . . . 30.260000000000002 111.777 177.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 95.01 -16.62 60.95 Favored Glycine 0 CA--C 1.549 2.201 0 N-CA-C 115.289 0.875 . . . . 21.609999999999999 115.289 -173.242 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -57.79 136.09 56.89 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 105.437 -2.06 . . . . 21.190000000000001 105.437 176.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 20.2 p90 -155.03 167.07 31.58 Favored 'General case' 0 C--O 1.291 3.26 0 CA-C-O 122.31 1.052 . . . . 21.280000000000001 112.508 -164.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.4 pp -149.23 156.02 41.49 Favored 'General case' 0 C--O 1.262 1.753 0 CA-C-N 112.948 -1.933 . . . . 23.559999999999999 109.121 173.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 10.6 mm -105.44 131.69 54.16 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.241 0 N-CA-C 104.475 -2.417 . . . . 21.09 104.475 170.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 45.1 ptt85 -129.84 164.51 23.96 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 122.232 1.015 . . . . 21.809999999999999 111.562 174.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -95.03 120.55 35.44 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 104.471 -2.418 . . . . 24.120000000000001 104.471 179.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 46.8 t -62.5 137.45 58.26 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 107.452 -1.314 . . . . 21.809999999999999 107.452 -172.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -86.59 -29.59 22.49 Favored 'General case' 0 C--N 1.318 -0.797 0 O-C-N 125.035 1.459 . . . . 31.109999999999999 110.487 170.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 64.2 p -79.17 -20.87 47.36 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 120.471 -0.492 . . . . 29.0 111.945 -177.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -135.62 74.86 58.27 Favored Pre-proline 0 N--CA 1.477 0.887 0 N-CA-C 106.972 -1.492 . . . . 28.489999999999998 106.972 178.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -54.22 132.39 50.22 Favored 'Trans proline' 0 C--N 1.358 1.032 0 O-C-N 121.744 0.339 . . . . 29.91 112.11 -177.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 104.98 -12.82 49.46 Favored Glycine 0 CA--C 1.532 1.14 0 N-CA-C 109.504 -1.438 . . . . 26.010000000000002 109.504 -179.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -112.19 152.92 27.81 Favored 'General case' 0 N--CA 1.486 1.374 0 CA-C-O 122.077 0.941 . . . . 34.969999999999999 110.083 -178.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 91.1 m-85 -104.37 155.97 18.33 Favored 'General case' 0 N--CA 1.415 -2.2 0 N-CA-C 108.035 -1.098 . . . . 22.52 108.035 178.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 50.5 m -128.22 152.11 48.46 Favored 'General case' 0 N--CA 1.435 -1.178 0 CA-C-N 114.149 -1.387 . . . . 22.16 111.464 168.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 19.2 tp -112.12 127.13 55.83 Favored 'General case' 0 C--O 1.271 2.233 0 N-CA-C 107.127 -1.434 . . . . 21.800000000000001 107.127 179.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 72.3 m -115.08 133.38 56.09 Favored 'General case' 0 C--O 1.203 -1.348 0 O-C-N 121.39 -0.818 . . . . 19.02 109.103 179.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 6.0 t -135.63 133.1 51.76 Favored 'Isoleucine or valine' 0 C--O 1.246 0.887 0 O-C-N 124.018 0.824 . . . . 23.890000000000001 112.798 -171.095 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 27.5 tttp -71.99 127.16 31.7 Favored 'General case' 0 C--N 1.348 0.525 0 CA-C-O 119.391 -0.338 . . . . 37.899999999999999 110.422 175.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -138.27 113.69 9.55 Favored 'General case' 0 C--O 1.238 0.461 0 O-C-N 124.741 1.276 . . . . 36.789999999999999 111.687 165.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 55.01 -128.99 44.93 Favored Glycine 0 C--O 1.25 1.14 0 C-N-CA 119.961 -1.114 . . . . 35.409999999999997 110.577 -175.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 44.5 m-20 -96.18 13.72 26.4 Favored 'General case' 0 C--O 1.253 1.244 0 CA-C-O 121.864 0.84 . . . . 44.880000000000003 111.154 -178.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . 0.376 70.0 m-20 -109.36 162.17 14.59 Favored 'General case' 0 C--O 1.205 -1.249 0 CA-C-N 115.878 -0.601 . . . . 34.770000000000003 109.799 178.093 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 54.2 t -127.64 129.48 70.21 Favored 'Isoleucine or valine' 0 C--O 1.29 3.205 0 N-CA-C 104.537 -2.394 . . . . 26.149999999999999 104.537 163.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 11.9 mt-30 -100.73 146.94 26.6 Favored 'General case' 0 CA--C 1.571 1.767 0 N-CA-C 106.668 -1.604 . . . . 35.229999999999997 106.668 -178.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 82.4 m-70 -118.07 139.74 50.78 Favored 'General case' 0 N--CA 1.436 -1.17 0 N-CA-C 113.506 0.928 . . . . 22.579999999999998 113.506 174.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -127.36 138.16 52.95 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 106.837 -1.542 . . . . 23.620000000000001 106.837 179.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 34.4 mtmt -70.63 130.68 42.43 Favored 'General case' 0 C--O 1.253 1.252 0 O-C-N 124.252 0.97 . . . . 29.84 109.173 169.113 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 60.6 t -81.67 108.11 14.48 Favored 'Isoleucine or valine' 0 C--O 1.253 1.277 0 N-CA-C 107.666 -1.235 . . . . 23.620000000000001 107.666 164.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 70.6 mt -89.29 154.39 20.13 Favored 'General case' 0 CA--C 1.517 -0.292 0 O-C-N 123.977 0.798 . . . . 25.449999999999999 110.804 -176.688 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' ARG . . . . . 0.409 ' NH1' ' O ' ' A' ' 45' ' ' HOH . 29.9 mmm-85 -118.98 146.29 45.11 Favored 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 112.804 0.668 . . . . 36.579999999999998 112.804 175.183 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 14.3 p-10 -88.63 -171.98 3.55 Favored 'General case' 0 C--O 1.257 1.462 0 N-CA-C 107.7 -1.222 . . . . 30.350000000000001 107.7 172.041 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -68.15 -28.88 73.19 Favored Glycine 0 C--O 1.261 1.796 0 C-N-CA 120.544 -0.836 . . . . 35.670000000000002 115.141 179.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -87.64 3.55 47.33 Favored 'General case' 0 C--O 1.216 -0.682 0 C-N-CA 124.222 1.009 . . . . 35.840000000000003 111.68 -177.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 81.63 12.01 82.22 Favored Glycine 0 CA--C 1.531 1.04 0 N-CA-C 118.5 2.16 . . . . 31.440000000000001 118.5 -175.611 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 27.4 mttt -75.07 159.2 31.99 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 119.645 1.722 . . . . 42.030000000000001 109.788 176.021 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 98.1 m-85 -111.21 141.75 44.32 Favored 'General case' 0 C--O 1.265 1.896 0 CA-C-O 118.158 -0.925 . . . . 25.800000000000001 109.935 -173.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 35.1 p90 -153.99 160.72 42.17 Favored 'General case' 0 C--O 1.258 1.519 0 O-C-N 125.399 1.687 . . . . 23.18 114.942 173.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 66.6 mt -98.78 -46.92 5.49 Favored 'General case' 0 C--O 1.273 2.324 0 C-N-CA 119.698 -0.801 . . . . 22.609999999999999 113.113 169.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -124.68 -71.76 0.7 Allowed 'General case' 0 C--O 1.209 -1.061 0 CA-C-N 114.32 -1.309 . . . . 28.309999999999999 110.594 -174.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 76.5 t -132.46 -48.15 0.69 Allowed 'Isoleucine or valine' 0 C--O 1.205 -1.27 0 O-C-N 124.794 1.309 . . . . 30.190000000000001 112.793 -171.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 60.8 t -78.41 136.24 24.38 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.791 0 N-CA-C 106.823 -1.547 . . . . 26.59 106.823 -178.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 47.6 pttt -123.15 157.92 31.88 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 123.945 0.778 . . . . 24.32 111.916 -176.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -141.68 160.35 40.35 Favored 'General case' 0 C--O 1.189 -2.102 0 N-CA-C 113.484 0.92 . . . . 24.07 113.484 -168.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 47.1 m-20 -79.0 -5.02 52.9 Favored 'General case' 0 C--O 1.25 1.101 0 O-C-N 123.396 0.435 . . . . 37.5 111.091 -177.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 89.6 p -153.64 150.73 28.91 Favored 'General case' 0 N--CA 1.509 2.511 0 CA-C-O 122.148 0.975 . . . . 23.84 111.926 -178.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 46.4 mt -54.74 -36.8 65.17 Favored 'General case' 0 C--O 1.213 -0.846 0 C-N-CA 118.294 -1.362 . . . . 23.309999999999999 111.058 168.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 36.0 t-20 -58.0 -47.96 81.46 Favored 'General case' 0 C--O 1.25 1.101 0 N-CA-C 108.684 -0.858 . . . . 25.550000000000001 108.684 -176.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -65.83 -40.54 91.88 Favored 'General case' 0 C--O 1.256 1.426 0 N-CA-C 113.94 1.089 . . . . 30.5 113.94 179.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 5.5 tt -58.19 -45.79 86.92 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.327 0.491 . . . . 26.57 112.327 174.195 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 23.5 t -57.36 -50.85 75.58 Favored 'Isoleucine or valine' 0 C--N 1.357 0.894 0 N-CA-C 107.49 -1.3 . . . . 22.16 107.49 177.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 87.8 m-20 -68.84 -37.53 79.22 Favored 'General case' 0 C--O 1.261 1.676 0 C-N-CA 118.44 -1.304 . . . . 25.68 111.969 -170.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -55.66 -41.14 73.22 Favored 'General case' 0 C--O 1.258 1.513 0 CA-C-N 115.32 -0.854 . . . . 27.449999999999999 109.199 175.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' HIS . . . . . . . . . . . . . 27.5 m80 -87.73 9.53 21.31 Favored 'General case' 0 N--CA 1.404 -2.742 0 N-CA-C 115.275 1.583 . . . . 23.129999999999999 115.275 -174.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 93.4 mtt-85 -76.4 -22.49 54.67 Favored 'General case' 0 N--CA 1.487 1.418 0 CA-C-N 115.419 -0.81 . . . . 23.100000000000001 109.842 167.048 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 81.4 p -127.48 3.45 6.23 Favored 'General case' 0 C--O 1.259 1.584 0 N-CA-C 116.581 2.067 . . . . 25.030000000000001 116.581 176.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 48.0 m -125.19 129.74 50.72 Favored 'General case' 0 CA--C 1.556 1.192 0 N-CA-C 105.182 -2.155 . . . . 26.640000000000001 105.182 171.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 37.9 t -59.33 138.57 57.58 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 121.315 0.578 . . . . 22.48 112.225 -171.766 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 27.1 m -76.05 -12.77 14.64 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.382 0 N-CA-C 114.157 1.169 . . . . 26.57 114.157 171.413 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 9.0 t -115.9 146.43 42.06 Favored 'General case' 0 C--O 1.272 2.262 0 N-CA-C 109.398 -0.593 . . . . 23.739999999999998 109.398 -173.226 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 72.4 mtt180 -90.28 -4.5 57.12 Favored 'General case' 0 N--CA 1.479 0.998 0 O-C-N 126.076 2.11 . . . . 41.759999999999998 111.829 171.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -111.05 -22.32 11.53 Favored 'General case' 0 C--O 1.247 0.947 0 N-CA-C 115.817 1.784 . . . . 38.109999999999999 115.817 -179.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 17.9 mp0 -144.83 162.23 37.32 Favored 'General case' 0 C--O 1.217 -0.606 0 N-CA-C 108.036 -1.098 . . . . 38.399999999999999 108.036 177.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -86.86 101.11 13.06 Favored 'General case' 0 CA--C 1.504 -0.826 0 N-CA-C 108.91 -0.774 . . . . 26.170000000000002 108.91 170.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 67.0 mt -124.71 115.46 44.5 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.248 0 N-CA-C 107.58 -1.267 . . . . 29.07 107.58 -178.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 77.5 m-85 -113.81 135.16 54.26 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 107.783 -1.192 . . . . 27.010000000000002 107.783 -178.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.3 mt -60.66 129.62 42.42 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 125.275 1.609 . . . . 22.559999999999999 112.35 -177.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 -136.46 153.18 51.13 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 106.967 -1.494 . . . . 41.299999999999997 106.967 171.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -64.15 141.83 58.63 Favored 'General case' 0 C--O 1.201 -1.499 0 O-C-N 124.058 0.849 . . . . 31.77 113.035 -177.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 19.7 pt -55.58 148.34 3.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 C-N-CA 120.053 -0.659 . . . . 33.140000000000001 111.303 172.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -45.26 -67.3 0.3 Allowed 'General case' 0 C--O 1.262 1.748 0 N-CA-C 115.714 1.746 . . . . 42.859999999999999 115.714 171.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' GLN . . . . . . . . . . . . . 4.5 mm100 98.85 114.33 0.01 OUTLIER 'General case' 0 C--O 1.198 -1.655 0 N-CA-C 119.071 2.989 . . . . 64.329999999999998 119.071 179.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 39.3 t . . . . . 0 N--CA 1.479 1.021 0 C-N-CA 123.588 0.755 . . . . 54.159999999999997 112.174 179.741 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.818 . . . . . . . . 30.600000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' 192 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' ASN . . . . . . . . . . . . . 47.6 p-10 -104.54 21.36 16.91 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 113.707 -1.588 . . . . 26.280000000000001 111.411 -175.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.569 0 O-C-N 120.366 -1.459 . . . . 25.190000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' HOH . . . . . 0.409 ' O ' ' NH1' ' A' ' 112' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 1.982 0 CA-C-O 121.436 0.636 . . . . 71.31 109.686 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.24 116.5 19.54 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 117.773 2.509 . . . . 70.55 117.773 -158.219 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 4.6 mtpp -108.9 146.21 33.31 Favored Pre-proline 0 C--O 1.211 -0.954 0 C-N-CA 124.881 1.272 . . . . 53.83 111.759 177.603 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -65.47 155.28 69.65 Favored 'Trans proline' 0 CA--C 1.548 1.22 0 C-N-CA 115.676 -2.416 . . . . 32.82 111.545 174.206 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -72.0 138.2 82.19 Favored Pre-proline 0 N--CA 1.476 0.836 0 O-C-N 120.624 -1.297 . . . . 28.69 114.0 177.355 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -78.26 1.23 9.18 Favored 'Trans proline' 0 N--CA 1.44 -1.632 0 O-C-N 122.91 0.953 . . . . 27.75 113.547 -175.633 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 32.2 p-90 -108.91 -2.17 18.54 Favored 'General case' 0 C--O 1.209 -1.078 0 N-CA-C 113.506 0.928 . . . . 24.16 113.506 -171.505 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -97.97 112.65 24.51 Favored 'General case' 0 C--O 1.198 -1.627 0 C-N-CA 117.013 -1.875 . . . . 27.97 112.717 -177.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' PHE . . . . . 0.455 ' CE2' ' HE2' ' A' ' 73' ' ' MET . 26.5 m-85 -110.06 5.97 22.56 Favored 'General case' 0 C--O 1.259 1.583 0 O-C-N 124.721 1.263 . . . . 30.72 112.847 -170.328 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 58.91 -141.74 46.77 Favored Glycine 0 N--CA 1.474 1.196 0 CA-C-O 122.667 1.148 . . . . 22.39 112.855 178.611 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' LYS . . . . . 0.601 ' HE3' ' HG2' ' A' ' 89' ' ' GLU . 20.3 tttt -83.69 59.12 4.98 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 121.571 -0.958 . . . . 46.66 113.122 -175.451 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 16.9 pt -84.02 147.17 50.4 Favored Pre-proline 0 C--O 1.246 0.9 0 C-N-CA 114.903 -2.719 . . . . 37.83 112.074 168.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_exo -61.81 149.57 89.54 Favored 'Trans proline' 0 CA--C 1.486 -1.912 0 C-N-CA 118.069 -0.82 . . . . 26.63 113.235 177.154 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 41.9 ttt85 -43.19 -45.25 5.53 Favored 'General case' 0 C--O 1.257 1.456 0 O-C-N 125.111 1.507 . . . . 25.09 112.667 169.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.22 -37.08 77.87 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.916 -1.115 . . . . 23.68 110.276 -175.245 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LYS . . . . . 1.04 ' HB3' ' NZ ' ' A' ' 69' ' ' LYS . 1.8 mmmp? -67.5 -38.88 84.98 Favored 'General case' 0 C--O 1.166 -3.321 0 O-C-N 121.735 -0.603 . . . . 50.07 110.927 -179.216 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.62 -45.77 77.47 Favored 'General case' 0 N--CA 1.501 2.121 0 CA-C-O 119.532 -0.27 . . . . 25.12 110.74 170.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 -60.76 -45.73 93.18 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-O 120.712 0.291 . . . . 39.27 111.372 176.647 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 61.8 tt0 -56.38 -40.39 74.52 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 113.666 0.987 . . . . 32.25 113.666 176.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' MET . . . . . 0.455 ' HE2' ' CE2' ' A' ' 62' ' ' PHE . 12.7 tmm? -81.1 -45.46 16.42 Favored 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 105.046 -2.205 . . . . 43.7 105.046 -172.307 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 55.8 mt -62.88 -28.1 69.8 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 115.861 1.8 . . . . 26.23 115.861 -179.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 75.0 m -66.77 -13.15 61.12 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 119.048 -1.061 . . . . 29.9 112.069 -179.242 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 44.0 mtmt -96.53 -8.6 31.56 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 124.253 0.971 . . . . 36.66 112.633 -178.088 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 88.9 mm-40 -75.65 147.7 39.3 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 119.021 -1.072 . . . . 29.2 108.776 175.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ARG . . . . . 0.859 ' HA ' ' H31' ' A' ' 2' ' ' GOL . 81.4 mtt180 -92.12 -25.15 18.87 Favored 'General case' 0 C--O 1.261 1.658 0 O-C-N 120.383 -1.448 . . . . 27.34 113.591 -175.5 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -109.57 126.03 53.16 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.404 0.52 . . . . 32.1 112.404 -165.999 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 82.6 m-20 -56.12 141.66 39.68 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 120.646 -0.422 . . . . 30.26 111.777 177.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 95.01 -16.62 60.95 Favored Glycine 0 CA--C 1.549 2.201 0 N-CA-C 115.289 0.875 . . . . 21.61 115.289 -173.242 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -57.79 136.09 56.89 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 105.437 -2.06 . . . . 21.19 105.437 176.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 20.2 p90 -155.03 167.07 31.58 Favored 'General case' 0 C--O 1.291 3.26 0 CA-C-O 122.31 1.052 . . . . 21.28 112.508 -164.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.4 pp -149.23 156.02 41.49 Favored 'General case' 0 C--O 1.262 1.753 0 CA-C-N 112.948 -1.933 . . . . 23.56 109.121 173.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 10.6 mm -105.44 131.69 54.16 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.241 0 N-CA-C 104.475 -2.417 . . . . 21.09 104.475 170.323 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 45.1 ptt85 -129.84 164.51 23.96 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 122.232 1.015 . . . . 21.81 111.562 174.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -95.03 120.55 35.44 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 104.471 -2.418 . . . . 24.12 104.471 179.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 46.8 t -62.5 137.45 58.26 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 107.452 -1.314 . . . . 21.81 107.452 -172.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLU . . . . . 0.601 ' HG2' ' HE3' ' A' ' 64' ' ' LYS . 37.3 mt-10 -86.59 -29.59 22.49 Favored 'General case' 0 C--N 1.318 -0.797 0 O-C-N 125.035 1.459 . . . . 31.11 110.487 170.617 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 64.2 p -79.17 -20.87 47.36 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 120.471 -0.492 . . . . 29.0 111.945 -177.834 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -135.62 74.86 58.27 Favored Pre-proline 0 N--CA 1.477 0.887 0 N-CA-C 106.972 -1.492 . . . . 28.49 106.972 178.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -54.22 132.39 50.22 Favored 'Trans proline' 0 C--N 1.358 1.032 0 O-C-N 121.744 0.339 . . . . 29.91 112.11 -177.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 104.98 -12.82 49.46 Favored Glycine 0 CA--C 1.532 1.14 0 N-CA-C 109.504 -1.438 . . . . 26.01 109.504 -179.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -112.19 152.92 27.81 Favored 'General case' 0 N--CA 1.486 1.374 0 CA-C-O 122.077 0.941 . . . . 34.97 110.083 -178.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 91.1 m-85 -104.37 155.97 18.33 Favored 'General case' 0 N--CA 1.415 -2.2 0 N-CA-C 108.035 -1.098 . . . . 22.52 108.035 178.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 50.5 m -128.22 152.11 48.46 Favored 'General case' 0 N--CA 1.435 -1.178 0 CA-C-N 114.149 -1.387 . . . . 22.16 111.464 168.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 19.2 tp -112.12 127.13 55.83 Favored 'General case' 0 C--O 1.271 2.233 0 N-CA-C 107.127 -1.434 . . . . 21.8 107.127 179.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 72.3 m -115.08 133.38 56.09 Favored 'General case' 0 C--O 1.203 -1.348 0 O-C-N 121.39 -0.818 . . . . 19.02 109.103 179.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 6.0 t -135.63 133.1 51.76 Favored 'Isoleucine or valine' 0 C--O 1.246 0.887 0 O-C-N 124.018 0.824 . . . . 23.89 112.798 -171.095 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 27.5 tttp -71.99 127.16 31.7 Favored 'General case' 0 C--N 1.348 0.525 0 CA-C-O 119.391 -0.338 . . . . 37.9 110.422 175.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -138.27 113.69 9.55 Favored 'General case' 0 C--O 1.238 0.461 0 O-C-N 124.741 1.276 . . . . 36.79 111.687 165.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 55.01 -128.99 44.93 Favored Glycine 0 C--O 1.25 1.14 0 C-N-CA 119.961 -1.114 . . . . 35.41 110.577 -175.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 44.5 m-20 -96.18 13.72 26.4 Favored 'General case' 0 C--O 1.253 1.244 0 CA-C-O 121.864 0.84 . . . . 44.88 111.154 -178.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . 0.376 70.0 m-20 -109.36 162.17 14.59 Favored 'General case' 0 C--O 1.205 -1.249 0 CA-C-N 115.878 -0.601 . . . . 34.77 109.799 178.093 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 54.2 t -127.64 129.48 70.21 Favored 'Isoleucine or valine' 0 C--O 1.29 3.205 0 N-CA-C 104.537 -2.394 . . . . 26.15 104.537 163.116 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 40.4 mt-30 -100.73 146.94 26.6 Favored 'General case' 0 CA--C 1.571 1.767 0 N-CA-C 106.668 -1.604 . . . . 35.23 106.668 -178.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 82.4 m-70 -118.07 139.74 50.78 Favored 'General case' 0 N--CA 1.436 -1.17 0 N-CA-C 113.506 0.928 . . . . 22.58 113.506 174.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -127.36 138.16 52.95 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 106.837 -1.542 . . . . 23.62 106.837 179.105 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 34.4 mtmt -70.63 130.68 42.43 Favored 'General case' 0 C--O 1.253 1.252 0 O-C-N 124.252 0.97 . . . . 29.84 109.173 169.113 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 60.6 t -81.67 108.11 14.48 Favored 'Isoleucine or valine' 0 C--O 1.253 1.277 0 N-CA-C 107.666 -1.235 . . . . 23.62 107.666 164.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 70.6 mt -89.29 154.39 20.13 Favored 'General case' 0 CA--C 1.517 -0.292 0 O-C-N 123.977 0.798 . . . . 25.45 110.804 -176.688 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 29.9 mmm-85 -118.98 146.29 45.11 Favored 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 112.804 0.668 . . . . 36.58 112.804 175.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 14.3 p-10 -88.63 -171.98 3.55 Favored 'General case' 0 C--O 1.257 1.462 0 N-CA-C 107.7 -1.222 . . . . 30.35 107.7 172.041 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -68.15 -28.88 73.19 Favored Glycine 0 C--O 1.261 1.796 0 C-N-CA 120.544 -0.836 . . . . 35.67 115.141 179.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -87.64 3.55 47.33 Favored 'General case' 0 C--O 1.216 -0.682 0 C-N-CA 124.222 1.009 . . . . 35.84 111.68 -177.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 81.63 12.01 82.22 Favored Glycine 0 CA--C 1.531 1.04 0 N-CA-C 118.5 2.16 . . . . 31.44 118.5 -175.611 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 27.4 mttt -75.07 159.2 31.99 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 119.645 1.722 . . . . 42.03 109.788 176.021 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 98.1 m-85 -111.21 141.75 44.32 Favored 'General case' 0 C--O 1.265 1.896 0 CA-C-O 118.158 -0.925 . . . . 25.8 109.935 -173.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 35.1 p90 -153.99 160.72 42.17 Favored 'General case' 0 C--O 1.258 1.519 0 O-C-N 125.399 1.687 . . . . 23.18 114.942 173.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 66.6 mt -98.78 -46.92 5.49 Favored 'General case' 0 C--O 1.273 2.324 0 C-N-CA 119.698 -0.801 . . . . 22.61 113.113 169.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -124.68 -71.76 0.7 Allowed 'General case' 0 C--O 1.209 -1.061 0 CA-C-N 114.32 -1.309 . . . . 28.31 110.594 -174.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 76.5 t -132.46 -48.15 0.69 Allowed 'Isoleucine or valine' 0 C--O 1.205 -1.27 0 O-C-N 124.794 1.309 . . . . 30.19 112.793 -171.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 60.8 t -78.41 136.24 24.38 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.791 0 N-CA-C 106.823 -1.547 . . . . 26.59 106.823 -178.366 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 47.6 pttt -123.15 157.92 31.88 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 123.945 0.778 . . . . 24.32 111.916 -176.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -141.68 160.35 40.35 Favored 'General case' 0 C--O 1.189 -2.102 0 N-CA-C 113.484 0.92 . . . . 24.34 113.484 -168.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 47.1 m-20 -79.0 -5.02 52.9 Favored 'General case' 0 C--O 1.25 1.101 0 O-C-N 123.396 0.435 . . . . 37.5 111.091 -177.396 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 89.6 p -153.64 150.73 28.91 Favored 'General case' 0 N--CA 1.509 2.511 0 CA-C-O 122.148 0.975 . . . . 23.84 111.926 -178.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 46.4 mt -54.74 -36.8 65.17 Favored 'General case' 0 C--O 1.213 -0.846 0 C-N-CA 118.294 -1.362 . . . . 23.31 111.058 168.097 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 36.0 t-20 -58.0 -47.96 81.46 Favored 'General case' 0 C--O 1.25 1.101 0 N-CA-C 108.684 -0.858 . . . . 25.55 108.684 -176.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -65.83 -40.54 91.88 Favored 'General case' 0 C--O 1.256 1.426 0 N-CA-C 113.94 1.089 . . . . 30.5 113.94 179.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 5.5 tt -58.19 -45.79 86.92 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.327 0.491 . . . . 26.57 112.327 174.195 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 23.5 t -57.36 -50.85 75.58 Favored 'Isoleucine or valine' 0 C--N 1.357 0.894 0 N-CA-C 107.49 -1.3 . . . . 22.16 107.49 177.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 87.8 m-20 -68.84 -37.53 79.22 Favored 'General case' 0 C--O 1.261 1.676 0 C-N-CA 118.44 -1.304 . . . . 25.68 111.969 -170.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -55.66 -41.14 73.22 Favored 'General case' 0 C--O 1.258 1.513 0 CA-C-N 115.32 -0.854 . . . . 27.45 109.199 175.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' HIS . . . . . . . . . . . . . 27.5 m80 -87.73 9.53 21.31 Favored 'General case' 0 N--CA 1.404 -2.742 0 N-CA-C 115.275 1.583 . . . . 23.13 115.275 -174.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 93.4 mtt-85 -76.4 -22.49 54.67 Favored 'General case' 0 N--CA 1.487 1.418 0 CA-C-N 115.419 -0.81 . . . . 23.1 109.842 167.048 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 81.4 p -127.48 3.45 6.23 Favored 'General case' 0 C--O 1.259 1.584 0 N-CA-C 116.581 2.067 . . . . 25.03 116.581 176.264 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 48.0 m -125.19 129.74 50.72 Favored 'General case' 0 CA--C 1.556 1.192 0 N-CA-C 105.182 -2.155 . . . . 26.64 105.182 171.586 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 37.9 t -59.33 138.57 57.58 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 121.315 0.578 . . . . 22.48 112.225 -171.766 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 27.1 m -76.05 -12.77 14.64 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.382 0 N-CA-C 114.157 1.169 . . . . 26.57 114.157 171.413 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 9.0 t -115.9 146.43 42.06 Favored 'General case' 0 C--O 1.272 2.262 0 N-CA-C 109.398 -0.593 . . . . 23.74 109.398 -173.226 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 72.4 mtt180 -90.28 -4.5 57.12 Favored 'General case' 0 N--CA 1.479 0.998 0 O-C-N 126.076 2.11 . . . . 41.76 111.829 171.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -111.05 -22.32 11.53 Favored 'General case' 0 C--O 1.247 0.947 0 N-CA-C 115.817 1.784 . . . . 38.11 115.817 -179.398 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 17.9 mp0 -144.83 162.23 37.32 Favored 'General case' 0 C--O 1.217 -0.606 0 N-CA-C 108.036 -1.098 . . . . 38.4 108.036 177.324 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -86.86 101.11 13.06 Favored 'General case' 0 CA--C 1.504 -0.826 0 N-CA-C 108.91 -0.774 . . . . 26.17 108.91 170.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 67.0 mt -124.71 115.46 44.5 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.248 0 N-CA-C 107.58 -1.267 . . . . 29.07 107.58 -178.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 77.5 m-85 -113.81 135.16 54.26 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 107.783 -1.192 . . . . 27.01 107.783 -178.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.3 mt -60.66 129.62 42.42 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 125.275 1.609 . . . . 22.56 112.35 -177.856 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 -136.46 153.18 51.13 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 106.967 -1.494 . . . . 41.3 106.967 171.169 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -64.15 141.83 58.63 Favored 'General case' 0 C--O 1.201 -1.499 0 O-C-N 124.058 0.849 . . . . 31.77 113.035 -177.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 19.7 pt -55.58 148.34 3.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 C-N-CA 120.053 -0.659 . . . . 33.14 111.303 172.424 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' GLU . . . . . 0.714 ' O ' ' HB2' ' A' ' 153' ' ' GLN . 47.8 mt-10 -45.26 -67.3 0.3 Allowed 'General case' 0 C--O 1.262 1.748 0 N-CA-C 115.714 1.746 . . . . 42.86 115.714 171.512 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 153' ' ' GLN . . . . . 0.714 ' HB2' ' O ' ' A' ' 152' ' ' GLU . 4.5 mm100 98.85 114.33 0.01 OUTLIER 'General case' 0 C--O 1.198 -1.655 0 N-CA-C 119.071 2.989 . . . . 64.33 119.071 179.701 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 39.3 t . . . . . 0 N--CA 1.479 1.021 0 C-N-CA 123.588 0.755 . . . . 54.16 112.174 179.741 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.818 . . . . . . . . 30.6 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 2' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 3' ' ' 192 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 4' ' ' ASN . . . . . . . . . . . . . 47.6 p-10 -104.54 21.36 16.91 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 113.707 -1.588 . . . . 26.28 111.411 -175.229 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.569 0 O-C-N 120.366 -1.459 . . . . 25.19 . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' GOL . . . . . 0.859 ' H31' ' HA ' ' A' ' 78' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 19' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 20' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 21' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 29' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 30' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 41' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 42' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 43' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 44' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 45' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 49' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 50' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 51' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 52' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 170' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 173' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 174' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 46' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 47' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 48' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 1.982 0 CA-C-O 121.436 0.636 . . . . 71.310000000000002 109.686 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -79.24 116.5 19.54 Favored 'General case' 0 N--CA 1.477 0.892 0 N-CA-C 117.773 2.509 . . . . 70.549999999999997 117.773 -158.219 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 4.6 mtpp -108.9 146.21 33.31 Favored Pre-proline 0 C--O 1.211 -0.954 0 C-N-CA 124.881 1.272 . . . . 53.829999999999998 111.759 177.603 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -65.47 155.28 69.65 Favored 'Trans proline' 0 CA--C 1.548 1.22 0 C-N-CA 115.676 -2.416 . . . . 32.82 111.545 174.206 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 88.8 m-70 -72.0 138.2 82.19 Favored Pre-proline 0 N--CA 1.476 0.836 0 O-C-N 120.624 -1.297 . . . . 28.690000000000001 114.0 177.355 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' PRO . . . . . . . . . . . . . 68.7 Cg_endo -78.26 1.23 9.18 Favored 'Trans proline' 0 N--CA 1.44 -1.632 0 O-C-N 122.91 0.953 . . . . 27.75 113.547 -175.633 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' TRP . . . . . . . . . . . . . 32.2 p-90 -108.91 -2.17 18.54 Favored 'General case' 0 C--O 1.209 -1.078 0 N-CA-C 113.506 0.928 . . . . 24.16 113.506 -171.505 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -97.97 112.65 24.51 Favored 'General case' 0 C--O 1.198 -1.627 0 C-N-CA 117.013 -1.875 . . . . 27.969999999999999 112.717 -177.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' PHE . . . . . 0.455 ' CE2' ' HE2' ' A' ' 73' ' ' MET . 26.5 m-85 -110.06 5.97 22.56 Favored 'General case' 0 C--O 1.259 1.583 0 O-C-N 124.721 1.263 . . . . 30.719999999999999 112.847 -170.328 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 58.91 -141.74 46.77 Favored Glycine 0 N--CA 1.474 1.196 0 CA-C-O 122.667 1.148 . . . . 22.390000000000001 112.855 178.611 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.601 ' HE3' ' HG2' ' A' ' 89' ' ' GLU . 20.3 tttt -83.69 59.12 4.98 Favored 'General case' 0 N--CA 1.43 -1.432 0 O-C-N 121.571 -0.958 . . . . 46.659999999999997 113.122 -175.451 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 16.9 pt -84.02 147.17 50.4 Favored Pre-proline 0 C--O 1.246 0.9 0 C-N-CA 114.903 -2.719 . . . . 37.829999999999998 112.074 168.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 70.9 Cg_exo -61.81 149.57 89.54 Favored 'Trans proline' 0 CA--C 1.486 -1.912 0 C-N-CA 118.069 -0.82 . . . . 26.629999999999999 113.235 177.154 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 41.9 ttt85 -43.19 -45.25 5.53 Favored 'General case' 0 C--O 1.257 1.456 0 O-C-N 125.111 1.507 . . . . 25.09 112.667 169.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.22 -37.08 77.87 Favored 'General case' 0 N--CA 1.43 -1.433 0 O-C-N 120.916 -1.115 . . . . 23.68 110.276 -175.245 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LYS . . . . . 1.04 ' NZ ' ' HB3' ' A' ' 69' ' ' LYS . 1.8 mmmp? -67.5 -38.88 84.98 Favored 'General case' 0 C--O 1.166 -3.321 0 O-C-N 121.735 -0.603 . . . . 50.07 110.927 -179.216 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -55.62 -45.77 77.47 Favored 'General case' 0 N--CA 1.501 2.121 0 CA-C-O 119.532 -0.27 . . . . 25.120000000000001 110.74 170.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 -60.76 -45.73 93.18 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-O 120.712 0.291 . . . . 39.270000000000003 111.372 176.647 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 61.8 tt0 -56.38 -40.39 74.52 Favored 'General case' 0 C--N 1.33 -0.269 0 N-CA-C 113.666 0.987 . . . . 32.25 113.666 176.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' MET . . . . . 0.455 ' HE2' ' CE2' ' A' ' 62' ' ' PHE . 12.7 tmm? -81.1 -45.46 16.42 Favored 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 105.046 -2.205 . . . . 43.700000000000003 105.046 -172.307 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 55.8 mt -62.88 -28.1 69.8 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 115.861 1.8 . . . . 26.23 115.861 -179.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' SER . . . . . . . . . . . . . 75.0 m -66.77 -13.15 61.12 Favored 'General case' 0 N--CA 1.443 -0.797 0 C-N-CA 119.048 -1.061 . . . . 29.899999999999999 112.069 -179.242 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 44.0 mtmt -96.53 -8.6 31.56 Favored 'General case' 0 N--CA 1.464 0.272 0 O-C-N 124.253 0.971 . . . . 36.659999999999997 112.633 -178.088 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 88.9 mm-40 -75.65 147.7 39.3 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 119.021 -1.072 . . . . 29.199999999999999 108.776 175.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.859 ' HA ' ' H31' ' A' ' 2' ' ' GOL . 81.4 mtt180 -92.12 -25.15 18.87 Favored 'General case' 0 C--O 1.261 1.658 0 O-C-N 120.383 -1.448 . . . . 27.34 113.591 -175.5 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -109.57 126.03 53.16 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 112.404 0.52 . . . . 32.100000000000001 112.404 -165.999 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ASP . . . . . . . . . . . . . 82.6 m-20 -56.12 141.66 39.68 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 120.646 -0.422 . . . . 30.260000000000002 111.777 177.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . 95.01 -16.62 60.95 Favored Glycine 0 CA--C 1.549 2.201 0 N-CA-C 115.289 0.875 . . . . 21.609999999999999 115.289 -173.242 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -57.79 136.09 56.89 Favored 'General case' 0 CA--C 1.549 0.924 0 N-CA-C 105.437 -2.06 . . . . 21.190000000000001 105.437 176.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' PHE . . . . . . . . . . . . . 20.2 p90 -155.03 167.07 31.58 Favored 'General case' 0 C--O 1.291 3.26 0 CA-C-O 122.31 1.052 . . . . 21.280000000000001 112.508 -164.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 4.4 pp -149.23 156.02 41.49 Favored 'General case' 0 C--O 1.262 1.753 0 CA-C-N 112.948 -1.933 . . . . 23.559999999999999 109.121 173.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ILE . . . . . . . . . . . . . 10.6 mm -105.44 131.69 54.16 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.241 0 N-CA-C 104.475 -2.417 . . . . 21.09 104.475 170.323 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ARG . . . . . . . . . . . . . 45.1 ptt85 -129.84 164.51 23.96 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 122.232 1.015 . . . . 21.809999999999999 111.562 174.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' GLU . . . . . . . . . . . . . 24.1 mt-10 -95.03 120.55 35.44 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 104.471 -2.418 . . . . 24.120000000000001 104.471 179.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 46.8 t -62.5 137.45 58.26 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 107.452 -1.314 . . . . 21.809999999999999 107.452 -172.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLU . . . . . 0.601 ' HG2' ' HE3' ' A' ' 64' ' ' LYS . 37.3 mt-10 -86.59 -29.59 22.49 Favored 'General case' 0 C--N 1.318 -0.797 0 O-C-N 125.035 1.459 . . . . 31.109999999999999 110.487 170.617 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 64.2 p -79.17 -20.87 47.36 Favored 'General case' 0 C--N 1.318 -0.785 0 C-N-CA 120.471 -0.492 . . . . 29.0 111.945 -177.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -135.62 74.86 58.27 Favored Pre-proline 0 N--CA 1.477 0.887 0 N-CA-C 106.972 -1.492 . . . . 28.489999999999998 106.972 178.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' PRO . . . . . . . . . . . . . 16.9 Cg_exo -54.22 132.39 50.22 Favored 'Trans proline' 0 C--N 1.358 1.032 0 O-C-N 121.744 0.339 . . . . 29.91 112.11 -177.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 104.98 -12.82 49.46 Favored Glycine 0 CA--C 1.532 1.14 0 N-CA-C 109.504 -1.438 . . . . 26.010000000000002 109.504 -179.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -112.19 152.92 27.81 Favored 'General case' 0 N--CA 1.486 1.374 0 CA-C-O 122.077 0.941 . . . . 34.969999999999999 110.083 -178.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' PHE . . . . . . . . . . . . . 91.1 m-85 -104.37 155.97 18.33 Favored 'General case' 0 N--CA 1.415 -2.2 0 N-CA-C 108.035 -1.098 . . . . 22.52 108.035 178.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' SER . . . . . . . . . . . . . 50.5 m -128.22 152.11 48.46 Favored 'General case' 0 N--CA 1.435 -1.178 0 CA-C-N 114.149 -1.387 . . . . 22.16 111.464 168.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 19.2 tp -112.12 127.13 55.83 Favored 'General case' 0 C--O 1.271 2.233 0 N-CA-C 107.127 -1.434 . . . . 21.800000000000001 107.127 179.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 72.3 m -115.08 133.38 56.09 Favored 'General case' 0 C--O 1.203 -1.348 0 O-C-N 121.39 -0.818 . . . . 19.02 109.103 179.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 6.0 t -135.63 133.1 51.76 Favored 'Isoleucine or valine' 0 C--O 1.246 0.887 0 O-C-N 124.018 0.824 . . . . 23.890000000000001 112.798 -171.095 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 27.5 tttp -71.99 127.16 31.7 Favored 'General case' 0 C--N 1.348 0.525 0 CA-C-O 119.391 -0.338 . . . . 37.899999999999999 110.422 175.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -138.27 113.69 9.55 Favored 'General case' 0 C--O 1.238 0.461 0 O-C-N 124.741 1.276 . . . . 36.789999999999999 111.687 165.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 55.01 -128.99 44.93 Favored Glycine 0 C--O 1.25 1.14 0 C-N-CA 119.961 -1.114 . . . . 35.409999999999997 110.577 -175.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 44.5 m-20 -96.18 13.72 26.4 Favored 'General case' 0 C--O 1.253 1.244 0 CA-C-O 121.864 0.84 . . . . 44.880000000000003 111.154 -178.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ASP . . . . . . . . . . . . 0.376 70.0 m-20 -109.36 162.17 14.59 Favored 'General case' 0 C--O 1.205 -1.249 0 CA-C-N 115.878 -0.601 . . . . 34.770000000000003 109.799 178.093 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 54.2 t -127.64 129.48 70.21 Favored 'Isoleucine or valine' 0 C--O 1.29 3.205 0 N-CA-C 104.537 -2.394 . . . . 26.149999999999999 104.537 163.116 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' GLN . . . . . . . . . . . . . 11.9 mt-30 -100.73 146.94 26.6 Favored 'General case' 0 CA--C 1.571 1.767 0 N-CA-C 106.668 -1.604 . . . . 35.229999999999997 106.668 -178.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HIS . . . . . . . . . . . . . 82.4 m-70 -118.07 139.74 50.78 Favored 'General case' 0 N--CA 1.436 -1.17 0 N-CA-C 113.506 0.928 . . . . 22.579999999999998 113.506 174.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -127.36 138.16 52.95 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 106.837 -1.542 . . . . 23.620000000000001 106.837 179.105 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 34.4 mtmt -70.63 130.68 42.43 Favored 'General case' 0 C--O 1.253 1.252 0 O-C-N 124.252 0.97 . . . . 29.84 109.173 169.113 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' VAL . . . . . . . . . . . . . 60.6 t -81.67 108.11 14.48 Favored 'Isoleucine or valine' 0 C--O 1.253 1.277 0 N-CA-C 107.666 -1.235 . . . . 23.620000000000001 107.666 164.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 70.6 mt -89.29 154.39 20.13 Favored 'General case' 0 CA--C 1.517 -0.292 0 O-C-N 123.977 0.798 . . . . 25.449999999999999 110.804 -176.688 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 29.9 mmm-85 -118.98 146.29 45.11 Favored 'General case' 0 CA--C 1.509 -0.633 0 N-CA-C 112.804 0.668 . . . . 36.579999999999998 112.804 175.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 14.3 p-10 -88.63 -171.98 3.55 Favored 'General case' 0 C--O 1.257 1.462 0 N-CA-C 107.7 -1.222 . . . . 30.350000000000001 107.7 172.041 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -68.15 -28.88 73.19 Favored Glycine 0 C--O 1.261 1.796 0 C-N-CA 120.544 -0.836 . . . . 35.670000000000002 115.141 179.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' ALA . . . . . . . . . . . . . . . -87.64 3.55 47.33 Favored 'General case' 0 C--O 1.216 -0.682 0 C-N-CA 124.222 1.009 . . . . 35.840000000000003 111.68 -177.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 81.63 12.01 82.22 Favored Glycine 0 CA--C 1.531 1.04 0 N-CA-C 118.5 2.16 . . . . 31.440000000000001 118.5 -175.611 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' LYS . . . . . . . . . . . . . 27.4 mttt -75.07 159.2 31.99 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-N 119.645 1.722 . . . . 42.030000000000001 109.788 176.021 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' TYR . . . . . . . . . . . . . 98.1 m-85 -111.21 141.75 44.32 Favored 'General case' 0 C--O 1.265 1.896 0 CA-C-O 118.158 -0.925 . . . . 25.800000000000001 109.935 -173.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' PHE . . . . . . . . . . . . . 35.1 p90 -153.99 160.72 42.17 Favored 'General case' 0 C--O 1.258 1.519 0 O-C-N 125.399 1.687 . . . . 23.18 114.942 173.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 66.6 mt -98.78 -46.92 5.49 Favored 'General case' 0 C--O 1.273 2.324 0 C-N-CA 119.698 -0.801 . . . . 22.609999999999999 113.113 169.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' TRP . . . . . . . . . . . . . 98.2 m95 -124.68 -71.76 0.7 Allowed 'General case' 0 C--O 1.209 -1.061 0 CA-C-N 114.32 -1.309 . . . . 28.309999999999999 110.594 -174.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 76.5 t -132.46 -48.15 0.69 Allowed 'Isoleucine or valine' 0 C--O 1.205 -1.27 0 O-C-N 124.794 1.309 . . . . 30.190000000000001 112.793 -171.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 60.8 t -78.41 136.24 24.38 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.791 0 N-CA-C 106.823 -1.547 . . . . 26.59 106.823 -178.366 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' LYS . . . . . . . . . . . . . 47.6 pttt -123.15 157.92 31.88 Favored 'General case' 0 N--CA 1.508 2.468 0 O-C-N 123.945 0.778 . . . . 24.32 111.916 -176.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' PHE . . . . . . . . . . . . . 5.5 m-85 -141.68 160.35 40.35 Favored 'General case' 0 C--O 1.189 -2.102 0 N-CA-C 113.484 0.92 . . . . 24.34 113.484 -168.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 47.1 m-20 -79.0 -5.02 52.9 Favored 'General case' 0 C--O 1.25 1.101 0 O-C-N 123.396 0.435 . . . . 37.5 111.091 -177.396 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' SER . . . . . . . . . . . . . 89.6 p -153.64 150.73 28.91 Favored 'General case' 0 N--CA 1.509 2.511 0 CA-C-O 122.148 0.975 . . . . 23.84 111.926 -178.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 46.4 mt -54.74 -36.8 65.17 Favored 'General case' 0 C--O 1.213 -0.846 0 C-N-CA 118.294 -1.362 . . . . 23.309999999999999 111.058 168.097 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' ASN . . . . . . . . . . . . . 36.0 t-20 -58.0 -47.96 81.46 Favored 'General case' 0 C--O 1.25 1.101 0 N-CA-C 108.684 -0.858 . . . . 25.550000000000001 108.684 -176.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' GLU . . . . . . . . . . . . . 25.8 mt-10 -65.83 -40.54 91.88 Favored 'General case' 0 C--O 1.256 1.426 0 N-CA-C 113.94 1.089 . . . . 30.5 113.94 179.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 5.5 tt -58.19 -45.79 86.92 Favored 'General case' 0 CA--C 1.541 0.614 0 N-CA-C 112.327 0.491 . . . . 26.57 112.327 174.195 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 23.5 t -57.36 -50.85 75.58 Favored 'Isoleucine or valine' 0 C--N 1.357 0.894 0 N-CA-C 107.49 -1.3 . . . . 22.16 107.49 177.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' ASP . . . . . . . . . . . . . 87.8 m-20 -68.84 -37.53 79.22 Favored 'General case' 0 C--O 1.261 1.676 0 C-N-CA 118.44 -1.304 . . . . 25.68 111.969 -170.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' TYR . . . . . . . . . . . . . 83.4 t80 -55.66 -41.14 73.22 Favored 'General case' 0 C--O 1.258 1.513 0 CA-C-N 115.32 -0.854 . . . . 27.449999999999999 109.199 175.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' HIS . . . . . . . . . . . . . 27.5 m80 -87.73 9.53 21.31 Favored 'General case' 0 N--CA 1.404 -2.742 0 N-CA-C 115.275 1.583 . . . . 23.129999999999999 115.275 -174.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 93.4 mtt-85 -76.4 -22.49 54.67 Favored 'General case' 0 N--CA 1.487 1.418 0 CA-C-N 115.419 -0.81 . . . . 23.100000000000001 109.842 167.048 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' SER . . . . . . . . . . . . . 81.4 p -127.48 3.45 6.23 Favored 'General case' 0 C--O 1.259 1.584 0 N-CA-C 116.581 2.067 . . . . 25.030000000000001 116.581 176.264 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' THR . . . . . . . . . . . . . 48.0 m -125.19 129.74 50.72 Favored 'General case' 0 CA--C 1.556 1.192 0 N-CA-C 105.182 -2.155 . . . . 26.640000000000001 105.182 171.586 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' SER . . . . . . . . . . . . . 37.9 t -59.33 138.57 57.58 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 121.315 0.578 . . . . 22.48 112.225 -171.766 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' VAL . . . . . . . . . . . . . 27.1 m -76.05 -12.77 14.64 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.382 0 N-CA-C 114.157 1.169 . . . . 26.57 114.157 171.413 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' SER . . . . . . . . . . . . . 9.0 t -115.9 146.43 42.06 Favored 'General case' 0 C--O 1.272 2.262 0 N-CA-C 109.398 -0.593 . . . . 23.739999999999998 109.398 -173.226 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' ARG . . . . . . . . . . . . . 72.4 mtt180 -90.28 -4.5 57.12 Favored 'General case' 0 N--CA 1.479 0.998 0 O-C-N 126.076 2.11 . . . . 41.759999999999998 111.829 171.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 88.6 m-20 -111.05 -22.32 11.53 Favored 'General case' 0 C--O 1.247 0.947 0 N-CA-C 115.817 1.784 . . . . 38.109999999999999 115.817 -179.398 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' GLN . . . . . . . . . . . . . 17.9 mp0 -144.83 162.23 37.32 Favored 'General case' 0 C--O 1.217 -0.606 0 N-CA-C 108.036 -1.098 . . . . 38.399999999999999 108.036 177.324 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' GLN . . . . . . . . . . . . . 15.1 mm100 -86.86 101.11 13.06 Favored 'General case' 0 CA--C 1.504 -0.826 0 N-CA-C 108.91 -0.774 . . . . 26.170000000000002 108.91 170.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' ILE . . . . . . . . . . . . . 67.0 mt -124.71 115.46 44.5 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.248 0 N-CA-C 107.58 -1.267 . . . . 29.07 107.58 -178.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 77.5 m-85 -113.81 135.16 54.26 Favored 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 107.783 -1.192 . . . . 27.010000000000002 107.783 -178.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' LEU . . . . . . . . . . . . . 84.3 mt -60.66 129.62 42.42 Favored 'General case' 0 N--CA 1.474 0.763 0 O-C-N 125.275 1.609 . . . . 22.559999999999999 112.35 -177.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 -136.46 153.18 51.13 Favored 'General case' 0 C--N 1.316 -0.869 0 N-CA-C 106.967 -1.494 . . . . 41.299999999999997 106.967 171.169 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -64.15 141.83 58.63 Favored 'General case' 0 C--O 1.201 -1.499 0 O-C-N 124.058 0.849 . . . . 31.77 113.035 -177.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' ILE . . . . . . . . . . . . . 19.7 pt -55.58 148.34 3.49 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.654 0 C-N-CA 120.053 -0.659 . . . . 33.140000000000001 111.303 172.424 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' GLU . . . . . 0.714 ' O ' ' HB2' ' A' ' 153' ' ' GLN . 47.8 mt-10 -45.26 -67.3 0.3 Allowed 'General case' 0 C--O 1.262 1.748 0 N-CA-C 115.714 1.746 . . . . 42.859999999999999 115.714 171.512 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' GLN . . . . . 0.714 ' HB2' ' O ' ' A' ' 152' ' ' GLU . 4.5 mm100 98.85 114.33 0.01 OUTLIER 'General case' 0 C--O 1.198 -1.655 0 N-CA-C 119.071 2.989 . . . . 64.329999999999998 119.071 179.701 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' VAL . . . . . . . . . . . . . 39.3 t . . . . . 0 N--CA 1.479 1.021 0 C-N-CA 123.588 0.755 . . . . 54.159999999999997 112.174 179.741 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' ACE . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.818 . . . . . . . . 30.600000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' PTR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' 192 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' ASN . . . . . . . . . . . . . 47.6 p-10 -104.54 21.36 16.91 Favored 'General case' 0 C--N 1.306 -1.284 0 CA-C-N 113.707 -1.588 . . . . 26.280000000000001 111.411 -175.229 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' NH2 . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 0.569 0 O-C-N 120.366 -1.459 . . . . 25.190000000000001 . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' GOL . . . . . 0.859 ' H31' ' HA ' ' A' ' 78' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_