data_6jui_residue ############################ # Computer software used # ############################ save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 6jui _Structure_validation_residue.Date_analyzed 2020-02-14 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 ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 0.281 0 N-CA-C 111.408 -0.677 . . . . 79.06 111.408 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 1.4 p -72.0 163.35 3.89 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 CA-C-O 121.787 0.803 . . . . 79.78 110.693 -176.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 36.7 m95 -108.43 118.91 38.01 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 123.485 0.714 . . . . 70.89 109.483 176.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 42.3 p -85.87 154.15 21.74 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.456 0.646 . . . . 68.93 110.55 -178.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 35.0 m-20 -56.19 -25.68 47.84 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 119.39 -0.924 . . . . 77.21 111.608 176.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 1.9 tp -74.12 -45.33 48.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 C-N-CA 120.725 -0.39 . . . . 105.23 110.794 176.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -64.94 -32.09 73.64 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 119.411 -0.916 . . . . 74.35 112.222 -176.267 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ASP . . . . . 0.485 ' OD2' ' NH2' ' A' ' 47' ' ' ARG . 86.6 m-20 -68.17 -35.27 77.78 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.255 -0.578 . . . . 65.12 111.371 176.447 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -67.68 -37.85 82.89 Favored 'General case' 0 C--O 1.241 0.612 0 C-N-CA 121.191 -0.204 . . . . 97.08 111.238 178.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ILE . . . . . 0.56 ' O ' ' OG ' ' A' ' 20' ' ' SER . 67.9 mt -68.75 -37.24 77.23 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 C-N-CA 120.532 -0.467 . . . . 68.77 110.219 173.567 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.7 tp -63.67 -45.5 89.81 Favored 'General case' 0 C--O 1.237 0.429 0 O-C-N 121.938 -0.477 . . . . 74.15 111.028 178.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 12.8 ttmt -62.12 -46.61 88.28 Favored 'General case' 0 C--O 1.242 0.666 0 O-C-N 122.123 -0.361 . . . . 112.59 110.989 179.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.17 -32.9 73.46 Favored 'General case' 0 C--O 1.242 0.678 0 C-N-CA 120.335 -0.546 . . . . 68.86 111.106 -177.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' SER . . . . . 0.56 ' OG ' ' O ' ' A' ' 16' ' ' ILE . 1.4 m -72.89 -37.95 67.12 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.726 -0.39 . . . . 62.8 111.496 177.274 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 3.0 t -64.19 -40.35 88.75 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 CA-C-O 120.983 0.42 . . . . 69.06 110.491 178.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.3 m -60.06 -19.25 52.06 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 112.696 0.628 . . . . 79.93 112.696 174.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.2 tttp -95.43 -46.62 6.62 Favored 'General case' 0 C--O 1.239 0.504 0 N-CA-C 113.203 0.816 . . . . 98.06 113.203 -176.053 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -109.19 6.6 24.88 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 113.735 1.013 . . . . 101.73 113.735 -177.962 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 68.77 -171.08 38.85 Favored Glycine 0 N--CA 1.443 -0.873 0 CA-C-O 122.996 1.331 . . . . 73.11 112.708 176.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LEU . . . . . 0.538 ' CD1' ' CZ2' ' A' ' 29' ' ' TRP . 2.8 mm? -75.55 178.51 5.94 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 107.629 -1.249 . . . . 85.59 107.629 165.491 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.6 m-20 60.73 28.79 18.51 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.976 0.362 . . . . 119.36 111.976 172.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -152.24 56.82 0.83 Allowed 'General case' 0 C--O 1.235 0.316 0 O-C-N 122.016 -0.428 . . . . 96.66 110.322 -179.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' TRP . . . . . 0.538 ' CZ2' ' CD1' ' A' ' 26' ' ' LEU . 86.6 m95 -86.38 -21.88 26.94 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 113.97 1.1 . . . . 84.32 113.97 -164.782 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -66.55 -42.69 86.77 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 119.498 -0.881 . . . . 89.09 111.245 172.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 11.5 mtt180 -65.75 -38.37 88.93 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 119.954 -0.698 . . . . 118.33 110.721 173.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 31.6 t -63.21 -45.93 97.15 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 CA-C-O 121.16 0.505 . . . . 80.94 110.052 176.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -62.7 -30.41 71.39 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 120.662 -0.415 . . . . 84.29 111.656 179.661 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.6 p -61.77 -36.08 80.02 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 112.049 0.388 . . . . 88.64 112.049 -175.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 35.5 mt -77.54 6.47 7.06 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 112.847 0.684 . . . . 87.37 112.847 178.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 11.1 mt -117.7 157.91 25.63 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 109.154 -0.684 . . . . 87.65 109.154 175.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -87.35 -54.74 4.13 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.015 -0.539 . . . . 94.65 112.377 -173.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -131.7 54.44 1.93 Allowed 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.618 0.723 . . . . 124.29 109.97 -174.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 40.6 mmtm -139.81 121.69 15.53 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 109.29 -0.633 . . . . 89.19 109.29 179.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 1.6 p -71.3 161.12 80.18 Favored Pre-proline 0 C--O 1.234 0.267 0 CA-C-O 120.991 0.424 . . . . 77.45 111.163 -177.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -58.01 -41.08 72.01 Favored 'Trans proline' 0 C--O 1.237 0.442 0 N-CA-C 113.034 0.359 . . . . 85.8 113.034 172.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.6 tptp -64.94 -37.59 88.14 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.165 -0.614 . . . . 107.34 111.781 176.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -64.67 -29.12 70.12 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.825 -0.35 . . . . 92.3 111.86 177.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 60.2 m -74.71 -41.04 60.92 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 120.343 -0.543 . . . . 65.31 110.945 177.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 77.7 tttt -58.1 -47.37 83.43 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.882 -0.327 . . . . 91.08 111.032 172.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.43 -52.38 63.79 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 120.756 0.312 . . . . 63.45 111.376 175.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ARG . . . . . 0.485 ' NH2' ' OD2' ' A' ' 14' ' ' ASP . 30.8 tpt180 -64.24 -35.44 80.83 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.493 -0.483 . . . . 66.54 112.191 -174.071 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 10.8 t-105 -75.84 -35.19 60.04 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 118.297 -1.361 . . . . 81.01 111.616 174.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 72.3 m-20 -74.24 -22.85 59.16 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 119.598 -0.841 . . . . 70.27 112.938 178.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 63.9 mm-40 -107.99 -6.36 16.63 Favored 'General case' 0 C--N 1.344 0.351 0 N-CA-C 113.05 0.759 . . . . 87.96 113.05 -177.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' TRP . . . . . 0.562 ' O ' ' NZ ' ' A' ' 58' ' ' LYS . 69.8 t-105 -150.15 -58.97 0.19 Allowed 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 117.933 -1.507 . . . . 75.63 112.686 -174.362 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.9 mt -72.73 -29.8 63.65 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 119.253 -0.979 . . . . 76.39 112.0 -165.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -54.7 126.24 56.76 Favored Pre-proline 0 C--O 1.244 0.785 0 C-N-CA 120.243 -0.583 . . . . 69.91 109.496 -179.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -70.11 -8.95 24.87 Favored 'Trans proline' 0 CA--C 1.51 -0.684 0 C-N-CA 120.917 1.078 . . . . 91.1 113.891 -178.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 9.3 p -81.64 -15.46 54.5 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 119.925 -0.71 . . . . 88.03 112.016 174.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ILE . . . . . . . . . . . . . 4.7 mt -75.09 132.79 32.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 N-CA-C 109.762 -0.458 . . . . 80.39 109.762 173.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 1.7 mtp180 -71.91 147.92 46.58 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.628 0.728 . . . . 106.41 110.53 177.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' LYS . . . . . 0.562 ' NZ ' ' O ' ' A' ' 51' ' ' TRP . 10.4 mptt -113.96 -13.72 12.5 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 113.35 0.871 . . . . 92.7 113.35 -178.442 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ILE . . . . . . . . . . . . . 10.8 tp -79.88 162.39 3.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.7 0.762 . . . . 114.47 109.271 -178.114 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.5 pm0 -59.25 157.61 10.42 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 121.838 0.827 . . . . 129.34 110.366 174.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 27.8 m95 -66.04 123.76 20.74 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.321 -0.854 . . . . 72.07 110.539 177.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 23.4 p -76.66 146.67 37.99 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.237 -0.653 . . . . 88.63 109.237 167.146 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 1.7 mtpp -76.37 -7.81 55.79 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 119.497 -0.881 . . . . 117.07 112.064 179.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.1 t0 -65.56 -37.64 87.28 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 119.585 -0.846 . . . . 108.3 110.507 158.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -75.3 -28.92 59.9 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.986 -0.285 . . . . 81.39 111.757 174.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 60.1 m-20 -69.36 -44.52 71.38 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 120.257 -0.577 . . . . 74.01 110.464 178.01 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -64.21 -38.94 92.86 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 111.885 0.328 . . . . 123.11 111.885 177.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.03 -40.79 94.91 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 119.865 -0.734 . . . . 89.15 110.672 174.298 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -67.91 -36.61 80.49 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-O 120.556 0.217 . . . . 73.19 111.11 179.786 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 61.5 mt -70.09 -43.04 71.9 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 120.463 -0.495 . . . . 78.02 112.161 179.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 13.8 m-70 -61.65 -41.17 97.14 Favored 'General case' 0 C--O 1.235 0.322 0 O-C-N 121.829 -0.544 . . . . 108.76 111.654 179.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 19.2 mt -80.59 -25.68 38.34 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 113.405 0.891 . . . . 75.92 113.405 -174.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -75.43 -31.09 60.24 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 118.061 0.391 . . . . 70.63 111.44 178.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt -76.55 -31.68 57.74 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 119.678 -0.809 . . . . 120.83 110.992 173.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 26.6 tp -72.53 -45.4 59.52 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.624 -0.43 . . . . 83.94 111.452 -179.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 6.3 mtp -133.2 80.48 58.98 Favored Pre-proline 0 C--O 1.237 0.4 0 CA-C-O 121.281 0.562 . . . . 107.11 110.324 -174.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -81.36 -2.12 11.42 Favored 'Trans proline' 0 C--O 1.237 0.43 0 N-CA-C 113.877 0.683 . . . . 112.08 113.877 172.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.6 m -83.43 -2.94 57.01 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.639 0.775 . . . . 136.46 113.036 -178.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' GLN . . . . . 0.401 ' O ' ' CG2' ' A' ' 82' ' ' THR . 1.1 pm0 -160.82 132.32 5.69 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 118.88 0.764 . . . . 138.72 109.79 179.034 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 49.3 m95 -100.54 -35.89 9.37 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 113.552 0.945 . . . . 119.6 113.552 -178.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -65.75 2.66 0.94 Allowed 'General case' 0 C--O 1.239 0.501 0 CA-C-N 118.357 0.526 . . . . 134.53 112.312 169.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' THR . . . . . 0.401 ' CG2' ' O ' ' A' ' 79' ' ' GLN . 1.8 t -94.0 -33.22 13.51 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 124.627 1.171 . . . . 137.6 112.056 178.51 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ILE . . . . . . . . . . . . . 2.8 mp -72.58 -32.14 40.26 Favored 'Isoleucine or valine' 0 C--O 1.24 0.583 0 CA-C-N 118.33 0.514 . . . . 119.52 110.682 177.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.23 -47.89 97.38 Favored Pre-proline 0 C--O 1.236 0.374 0 C-N-CA 125.161 1.385 . . . . 111.25 113.61 -171.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_exo -63.55 -0.8 2.67 Favored 'Trans proline' 0 C--O 1.237 0.448 0 CA-C-N 120.956 1.377 . . . . 148.29 115.04 -179.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 11.8 mm -112.56 -41.66 4.02 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 CA-C-N 119.463 1.029 . . . . 136.22 111.275 178.786 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' VAL . . . . . 0.554 ' O ' ' N ' ' A' ' 89' ' ' ARG . 7.4 p -94.19 116.61 35.88 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 N-CA-C 108.556 -0.905 . . . . 116.3 108.556 170.791 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -60.74 34.38 0.04 OUTLIER Glycine 0 C--N 1.331 0.292 0 N-CA-C 117.567 1.787 . . . . 107.92 117.567 -168.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ARG . . . . . 0.554 ' N ' ' O ' ' A' ' 87' ' ' VAL . 12.1 mmt180 -122.65 169.18 11.31 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 124.245 1.018 . . . . 94.55 110.2 175.523 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 2.4 p -73.86 158.17 34.99 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.073 -0.967 . . . . 82.59 111.104 177.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -56.69 -48.81 76.85 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 114.733 -1.121 . . . . 57.35 111.781 176.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -64.09 -37.58 87.97 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.145 -0.622 . . . . 113.97 110.816 -177.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -61.81 -39.57 92.2 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 111.528 0.196 . . . . 86.47 111.528 170.166 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 92.8 m -63.29 -46.21 87.84 Favored 'General case' 0 C--O 1.238 0.484 0 O-C-N 122.019 -0.426 . . . . 60.74 111.24 178.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 10.1 tp -60.71 -48.54 81.34 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 120.49 -0.484 . . . . 66.51 110.514 -179.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -68.7 -36.09 78.01 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 119.695 -0.802 . . . . 95.22 111.784 -176.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -68.3 -32.5 72.69 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 118.89 -1.124 . . . . 76.95 110.917 178.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 22.6 t80 -68.69 -39.0 80.75 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 120.744 -0.383 . . . . 73.26 111.148 177.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 22.5 tp60 -61.93 -39.76 93.14 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.856 -0.338 . . . . 66.03 111.755 176.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 16.8 tttp -62.97 -47.45 83.14 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 120.653 -0.419 . . . . 102.08 110.96 177.041 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 90.9 mt -60.93 -31.18 70.72 Favored 'General case' 0 C--O 1.236 0.355 0 O-C-N 122.128 -0.357 . . . . 66.43 111.649 177.275 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 84.2 mt -73.93 -42.14 61.03 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 122.167 -0.333 . . . . 69.14 111.712 170.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -59.25 -44.83 92.36 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.13 -0.628 . . . . 75.4 111.015 176.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -65.51 -38.98 91.26 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 120.527 -0.469 . . . . 100.07 111.314 -178.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.93 -43.77 87.1 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.028 -0.669 . . . . 67.5 111.061 177.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -57.08 -39.29 74.7 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 111.622 0.23 . . . . 71.08 111.622 177.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -68.89 -19.48 64.22 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 118.982 -1.087 . . . . 83.76 111.757 178.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.426 0 CA-C-O 121.393 0.616 . . . . 88.96 111.85 175.502 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 0.281 0 N-CA-C 111.408 -0.677 . . . . 79.06 111.408 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 1.4 p -72.0 163.35 3.89 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 CA-C-O 121.787 0.803 . . . . 79.78 110.693 -176.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 36.7 m95 -108.43 118.91 38.01 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 123.485 0.714 . . . . 70.89 109.483 176.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' THR . . . . . 0.567 ' OG1' HG23 ' A' ' 12' ' ' ILE . 42.3 p -85.87 154.15 21.74 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.456 0.646 . . . . 68.93 110.55 -178.867 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 35.0 m-20 -56.19 -25.68 47.84 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 119.39 -0.924 . . . . 77.21 111.608 176.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ILE . . . . . 0.567 HG23 ' OG1' ' A' ' 10' ' ' THR . 1.9 tp -74.12 -45.33 48.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 C-N-CA 120.725 -0.39 . . . . 105.23 110.794 176.011 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -64.94 -32.09 73.64 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 119.411 -0.916 . . . . 74.35 112.222 -176.267 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 86.6 m-20 -68.17 -35.27 77.78 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.255 -0.578 . . . . 65.12 111.371 176.447 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -67.68 -37.85 82.89 Favored 'General case' 0 C--O 1.241 0.612 0 C-N-CA 121.191 -0.204 . . . . 97.08 111.238 178.764 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ILE . . . . . 0.486 ' O ' ' OG ' ' A' ' 20' ' ' SER . 67.9 mt -68.75 -37.24 77.23 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 C-N-CA 120.532 -0.467 . . . . 68.77 110.219 173.567 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.7 tp -63.67 -45.5 89.81 Favored 'General case' 0 C--O 1.237 0.429 0 O-C-N 121.938 -0.477 . . . . 74.15 111.028 178.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 12.8 ttmt -62.12 -46.61 88.28 Favored 'General case' 0 C--O 1.242 0.666 0 O-C-N 122.123 -0.361 . . . . 112.59 110.989 179.588 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.17 -32.9 73.46 Favored 'General case' 0 C--O 1.242 0.678 0 C-N-CA 120.335 -0.546 . . . . 68.86 111.106 -177.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' SER . . . . . 0.486 ' OG ' ' O ' ' A' ' 16' ' ' ILE . 1.4 m -72.89 -37.95 67.12 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.726 -0.39 . . . . 62.8 111.496 177.274 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 3.0 t -64.19 -40.35 88.75 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 CA-C-O 120.983 0.42 . . . . 69.06 110.491 178.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.3 m -60.06 -19.25 52.06 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 112.696 0.628 . . . . 79.93 112.696 174.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.2 tttp -95.43 -46.62 6.62 Favored 'General case' 0 C--O 1.239 0.504 0 N-CA-C 113.203 0.816 . . . . 98.06 113.203 -176.053 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -109.19 6.6 24.88 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 113.735 1.013 . . . . 101.73 113.735 -177.962 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 68.77 -171.08 38.85 Favored Glycine 0 N--CA 1.443 -0.873 0 CA-C-O 122.996 1.331 . . . . 73.11 112.708 176.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LEU . . . . . 0.725 HD12 ' HZ2' ' A' ' 29' ' ' TRP . 2.8 mm? -75.55 178.51 5.94 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 107.629 -1.249 . . . . 85.59 107.629 165.491 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.6 m-20 60.73 28.79 18.51 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.976 0.362 . . . . 119.36 111.976 172.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -152.24 56.82 0.83 Allowed 'General case' 0 C--O 1.235 0.316 0 O-C-N 122.016 -0.428 . . . . 96.66 110.322 -179.364 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' TRP . . . . . 0.725 ' HZ2' HD12 ' A' ' 26' ' ' LEU . 86.6 m95 -86.38 -21.88 26.94 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 113.97 1.1 . . . . 84.32 113.97 -164.782 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -66.55 -42.69 86.77 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 119.498 -0.881 . . . . 89.09 111.245 172.036 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 11.5 mtt180 -65.75 -38.37 88.93 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 119.954 -0.698 . . . . 118.33 110.721 173.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 31.6 t -63.21 -45.93 97.15 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 CA-C-O 121.16 0.505 . . . . 80.94 110.052 176.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -62.7 -30.41 71.39 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 120.662 -0.415 . . . . 84.29 111.656 179.661 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.6 p -61.77 -36.08 80.02 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 112.049 0.388 . . . . 88.64 112.049 -175.315 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 35.5 mt -77.54 6.47 7.06 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 112.847 0.684 . . . . 87.37 112.847 178.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 11.1 mt -117.7 157.91 25.63 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 109.154 -0.684 . . . . 87.65 109.154 175.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -87.35 -54.74 4.13 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.015 -0.539 . . . . 94.65 112.377 -173.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -131.7 54.44 1.93 Allowed 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.618 0.723 . . . . 124.29 109.97 -174.191 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 40.6 mmtm -139.81 121.69 15.53 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 109.29 -0.633 . . . . 89.19 109.29 179.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' THR . . . . . 0.436 HG23 ' OE1' ' A' ' 43' ' ' GLN . 1.6 p -71.3 161.12 80.18 Favored Pre-proline 0 C--O 1.234 0.267 0 CA-C-O 120.991 0.424 . . . . 77.45 111.163 -177.774 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -58.01 -41.08 72.01 Favored 'Trans proline' 0 C--O 1.237 0.442 0 N-CA-C 113.034 0.359 . . . . 85.8 113.034 172.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.6 tptp -64.94 -37.59 88.14 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.165 -0.614 . . . . 107.34 111.781 176.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLN . . . . . 0.436 ' OE1' HG23 ' A' ' 40' ' ' THR . 89.4 mt-30 -64.67 -29.12 70.12 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.825 -0.35 . . . . 92.3 111.86 177.77 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 60.2 m -74.71 -41.04 60.92 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 120.343 -0.543 . . . . 65.31 110.945 177.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 77.7 tttt -58.1 -47.37 83.43 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.882 -0.327 . . . . 91.08 111.032 172.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.43 -52.38 63.79 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 120.756 0.312 . . . . 63.45 111.376 175.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 30.8 tpt180 -64.24 -35.44 80.83 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.493 -0.483 . . . . 66.54 112.191 -174.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 10.8 t-105 -75.84 -35.19 60.04 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 118.297 -1.361 . . . . 81.01 111.616 174.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ASN . . . . . 0.436 ' O ' HD11 ' A' ' 56' ' ' ILE . 72.3 m-20 -74.24 -22.85 59.16 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 119.598 -0.841 . . . . 70.27 112.938 178.614 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 63.9 mm-40 -107.99 -6.36 16.63 Favored 'General case' 0 C--N 1.344 0.351 0 N-CA-C 113.05 0.759 . . . . 87.96 113.05 -177.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 69.8 t-105 -150.15 -58.97 0.19 Allowed 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 117.933 -1.507 . . . . 75.63 112.686 -174.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.9 mt -72.73 -29.8 63.65 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 119.253 -0.979 . . . . 76.39 112.0 -165.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ASP . . . . . 0.836 ' HB3' HD12 ' A' ' 56' ' ' ILE . 31.6 t0 -54.7 126.24 56.76 Favored Pre-proline 0 C--O 1.244 0.785 0 C-N-CA 120.243 -0.583 . . . . 69.91 109.496 -179.674 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -70.11 -8.95 24.87 Favored 'Trans proline' 0 CA--C 1.51 -0.684 0 C-N-CA 120.917 1.078 . . . . 91.1 113.891 -178.088 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 9.3 p -81.64 -15.46 54.5 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 119.925 -0.71 . . . . 88.03 112.016 174.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ILE . . . . . 0.836 HD12 ' HB3' ' A' ' 53' ' ' ASP . 4.7 mt -75.09 132.79 32.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 N-CA-C 109.762 -0.458 . . . . 80.39 109.762 173.431 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ARG . . . . . 0.621 HH21 HG21 ' A' ' 59' ' ' ILE . 1.7 mtp180 -71.91 147.92 46.58 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.628 0.728 . . . . 106.41 110.53 177.614 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 10.4 mptt -113.96 -13.72 12.5 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 113.35 0.871 . . . . 92.7 113.35 -178.442 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ILE . . . . . 0.621 HG21 HH21 ' A' ' 57' ' ' ARG . 10.8 tp -79.88 162.39 3.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.7 0.762 . . . . 114.47 109.271 -178.114 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.5 pm0 -59.25 157.61 10.42 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 121.838 0.827 . . . . 129.34 110.366 174.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 27.8 m95 -66.04 123.76 20.74 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.321 -0.854 . . . . 72.07 110.539 177.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 23.4 p -76.66 146.67 37.99 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.237 -0.653 . . . . 88.63 109.237 167.146 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LYS . . . . . 0.541 ' HA ' ' HB2' ' A' ' 66' ' ' ASP . 1.7 mtpp -76.37 -7.81 55.79 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 119.497 -0.881 . . . . 117.07 112.064 179.437 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.1 t0 -65.56 -37.64 87.28 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 119.585 -0.846 . . . . 108.3 110.507 158.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -75.3 -28.92 59.9 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.986 -0.285 . . . . 81.39 111.757 174.848 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ASP . . . . . 0.541 ' HB2' ' HA ' ' A' ' 63' ' ' LYS . 60.1 m-20 -69.36 -44.52 71.38 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 120.257 -0.577 . . . . 74.01 110.464 178.01 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -64.21 -38.94 92.86 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 111.885 0.328 . . . . 123.11 111.885 177.456 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.03 -40.79 94.91 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 119.865 -0.734 . . . . 89.15 110.672 174.298 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LEU . . . . . 0.452 HD11 ' HB2' ' A' ' 98' ' ' TYR . 2.8 tm? -67.91 -36.61 80.49 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-O 120.556 0.217 . . . . 73.19 111.11 179.786 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LEU . . . . . 0.446 HD23 ' HE1' ' A' ' 98' ' ' TYR . 61.5 mt -70.09 -43.04 71.9 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 120.463 -0.495 . . . . 78.02 112.161 179.283 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 13.8 m-70 -61.65 -41.17 97.14 Favored 'General case' 0 C--O 1.235 0.322 0 O-C-N 121.829 -0.544 . . . . 108.76 111.654 179.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 19.2 mt -80.59 -25.68 38.34 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 113.405 0.891 . . . . 75.92 113.405 -174.215 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -75.43 -31.09 60.24 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 118.061 0.391 . . . . 70.63 111.44 178.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt -76.55 -31.68 57.74 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 119.678 -0.809 . . . . 120.83 110.992 173.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 26.6 tp -72.53 -45.4 59.52 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.624 -0.43 . . . . 83.94 111.452 -179.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 6.3 mtp -133.2 80.48 58.98 Favored Pre-proline 0 C--O 1.237 0.4 0 CA-C-O 121.281 0.562 . . . . 107.11 110.324 -174.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -81.36 -2.12 11.42 Favored 'Trans proline' 0 C--O 1.237 0.43 0 N-CA-C 113.877 0.683 . . . . 112.08 113.877 172.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' THR . . . . . . . . . . . . . 1.6 m -83.43 -2.94 57.01 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.639 0.775 . . . . 136.46 113.036 -178.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' GLN . . . . . 0.713 ' O ' HG22 ' A' ' 82' ' ' THR . 0.3 OUTLIER -160.82 132.32 5.69 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 118.88 0.764 . . . . 138.72 109.79 179.034 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 49.3 m95 -100.54 -35.89 9.37 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 113.552 0.945 . . . . 119.6 113.552 -178.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -65.75 2.66 0.94 Allowed 'General case' 0 C--O 1.239 0.501 0 CA-C-N 118.357 0.526 . . . . 134.53 112.312 169.53 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' THR . . . . . 0.713 HG22 ' O ' ' A' ' 79' ' ' GLN . 1.8 t -94.0 -33.22 13.51 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 124.627 1.171 . . . . 137.6 112.056 178.51 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ILE . . . . . 0.552 HD12 ' CG2' ' A' ' 82' ' ' THR . 2.8 mp -72.58 -32.14 40.26 Favored 'Isoleucine or valine' 0 C--O 1.24 0.583 0 CA-C-N 118.33 0.514 . . . . 119.52 110.682 177.467 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ALA . . . . . 0.421 ' HB3' ' HD3' ' A' ' 85' ' ' PRO . . . -59.23 -47.89 97.38 Favored Pre-proline 0 C--O 1.236 0.374 0 C-N-CA 125.161 1.385 . . . . 111.25 113.61 -171.464 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' PRO . . . . . 0.421 ' HD3' ' HB3' ' A' ' 84' ' ' ALA . 51.3 Cg_exo -63.55 -0.8 2.67 Favored 'Trans proline' 0 C--O 1.237 0.448 0 CA-C-N 120.956 1.377 . . . . 148.29 115.04 -179.661 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 11.8 mm -112.56 -41.66 4.02 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 CA-C-N 119.463 1.029 . . . . 136.22 111.275 178.786 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' VAL . . . . . 0.448 ' O ' ' N ' ' A' ' 89' ' ' ARG . 7.4 p -94.19 116.61 35.88 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 N-CA-C 108.556 -0.905 . . . . 116.3 108.556 170.791 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -60.74 34.38 0.04 OUTLIER Glycine 0 C--N 1.331 0.292 0 N-CA-C 117.567 1.787 . . . . 107.92 117.567 -168.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ARG . . . . . 0.448 ' N ' ' O ' ' A' ' 87' ' ' VAL . 12.1 mmt180 -122.65 169.18 11.31 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 124.245 1.018 . . . . 94.55 110.2 175.523 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 2.4 p -73.86 158.17 34.99 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.073 -0.967 . . . . 82.59 111.104 177.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -56.69 -48.81 76.85 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 114.733 -1.121 . . . . 57.35 111.781 176.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -64.09 -37.58 87.97 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.145 -0.622 . . . . 113.97 110.816 -177.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -61.81 -39.57 92.2 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 111.528 0.196 . . . . 86.47 111.528 170.166 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 92.8 m -63.29 -46.21 87.84 Favored 'General case' 0 C--O 1.238 0.484 0 O-C-N 122.019 -0.426 . . . . 60.74 111.24 178.16 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 10.1 tp -60.71 -48.54 81.34 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 120.49 -0.484 . . . . 66.51 110.514 -179.147 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -68.7 -36.09 78.01 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 119.695 -0.802 . . . . 95.22 111.784 -176.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -68.3 -32.5 72.69 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 118.89 -1.124 . . . . 76.95 110.917 178.078 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' TYR . . . . . 0.452 ' HB2' HD11 ' A' ' 69' ' ' LEU . 22.6 t80 -68.69 -39.0 80.75 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 120.744 -0.383 . . . . 73.26 111.148 177.824 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 22.5 tp60 -61.93 -39.76 93.14 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.856 -0.338 . . . . 66.03 111.755 176.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 16.8 tttp -62.97 -47.45 83.14 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 120.653 -0.419 . . . . 102.08 110.96 177.041 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 90.9 mt -60.93 -31.18 70.72 Favored 'General case' 0 C--O 1.236 0.355 0 O-C-N 122.128 -0.357 . . . . 66.43 111.649 177.275 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 84.2 mt -73.93 -42.14 61.03 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 122.167 -0.333 . . . . 69.14 111.712 170.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -59.25 -44.83 92.36 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.13 -0.628 . . . . 75.4 111.015 176.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -65.51 -38.98 91.26 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 120.527 -0.469 . . . . 100.07 111.314 -178.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.93 -43.77 87.1 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.028 -0.669 . . . . 67.5 111.061 177.908 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -57.08 -39.29 74.7 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 111.622 0.23 . . . . 71.08 111.622 177.481 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -68.89 -19.48 64.22 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 118.982 -1.087 . . . . 83.76 111.757 178.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.426 0 CA-C-O 121.393 0.616 . . . . 88.96 111.85 175.502 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.518 0.281 0 N-CA-C 111.408 -0.677 . . . . 79.060000000000002 111.408 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 1.4 p -72.0 163.35 3.89 Favored 'Isoleucine or valine' 0 C--O 1.239 0.506 0 CA-C-O 121.787 0.803 . . . . 79.780000000000001 110.693 -176.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' TRP . . . . . . . . . . . . . 36.7 m95 -108.43 118.91 38.01 Favored 'General case' 0 C--O 1.238 0.482 0 C-N-CA 123.485 0.714 . . . . 70.890000000000001 109.483 176.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' THR . . . . . 0.567 ' OG1' HG23 ' A' ' 12' ' ' ILE . 42.3 p -85.87 154.15 21.74 Favored 'General case' 0 C--N 1.322 -0.602 0 CA-C-O 121.456 0.646 . . . . 68.930000000000007 110.55 -178.867 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ASN . . . . . . . . . . . . . 35.0 m-20 -56.19 -25.68 47.84 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 119.39 -0.924 . . . . 77.209999999999994 111.608 176.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ILE . . . . . 0.567 HG23 ' OG1' ' A' ' 10' ' ' THR . 1.9 tp -74.12 -45.33 48.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 C-N-CA 120.725 -0.39 . . . . 105.23 110.794 176.011 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -64.94 -32.09 73.64 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 119.411 -0.916 . . . . 74.349999999999994 112.222 -176.267 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 86.6 m-20 -68.17 -35.27 77.78 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.255 -0.578 . . . . 65.120000000000005 111.371 176.447 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -67.68 -37.85 82.89 Favored 'General case' 0 C--O 1.241 0.612 0 C-N-CA 121.191 -0.204 . . . . 97.079999999999998 111.238 178.764 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.486 ' O ' ' OG ' ' A' ' 20' ' ' SER . 67.9 mt -68.75 -37.24 77.23 Favored 'Isoleucine or valine' 0 C--O 1.237 0.399 0 C-N-CA 120.532 -0.467 . . . . 68.769999999999996 110.219 173.567 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 64.7 tp -63.67 -45.5 89.81 Favored 'General case' 0 C--O 1.237 0.429 0 O-C-N 121.938 -0.477 . . . . 74.150000000000006 111.028 178.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 12.8 ttmt -62.12 -46.61 88.28 Favored 'General case' 0 C--O 1.242 0.666 0 O-C-N 122.123 -0.361 . . . . 112.59 110.989 179.588 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -68.17 -32.9 73.46 Favored 'General case' 0 C--O 1.242 0.678 0 C-N-CA 120.335 -0.546 . . . . 68.859999999999999 111.106 -177.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' SER . . . . . 0.486 ' OG ' ' O ' ' A' ' 16' ' ' ILE . 1.4 m -72.89 -37.95 67.12 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.726 -0.39 . . . . 62.799999999999997 111.496 177.274 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 3.0 t -64.19 -40.35 88.75 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 CA-C-O 120.983 0.42 . . . . 69.060000000000002 110.491 178.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 1.3 m -60.06 -19.25 52.06 Favored 'General case' 0 C--O 1.234 0.278 0 N-CA-C 112.696 0.628 . . . . 79.930000000000007 112.696 174.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 21.2 tttp -95.43 -46.62 6.62 Favored 'General case' 0 C--O 1.239 0.504 0 N-CA-C 113.203 0.816 . . . . 98.060000000000002 113.203 -176.053 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' TYR . . . . . . . . . . . . . 10.0 m-85 -109.19 6.6 24.88 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 113.735 1.013 . . . . 101.73 113.735 -177.962 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 68.77 -171.08 38.85 Favored Glycine 0 N--CA 1.443 -0.873 0 CA-C-O 122.996 1.331 . . . . 73.109999999999999 112.708 176.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.725 HD12 ' HZ2' ' A' ' 29' ' ' TRP . 2.8 mm? -75.55 178.51 5.94 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 107.629 -1.249 . . . . 85.590000000000003 107.629 165.491 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 7.6 m-20 60.73 28.79 18.51 Favored 'General case' 0 C--N 1.328 -0.354 0 N-CA-C 111.976 0.362 . . . . 119.36 111.976 172.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 2.9 tt0 -152.24 56.82 0.83 Allowed 'General case' 0 C--O 1.235 0.316 0 O-C-N 122.016 -0.428 . . . . 96.659999999999997 110.322 -179.364 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.725 ' HZ2' HD12 ' A' ' 26' ' ' LEU . 86.6 m95 -86.38 -21.88 26.94 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 113.97 1.1 . . . . 84.319999999999993 113.97 -164.782 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -66.55 -42.69 86.77 Favored 'General case' 0 C--O 1.237 0.429 0 C-N-CA 119.498 -0.881 . . . . 89.090000000000003 111.245 172.036 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 11.5 mtt180 -65.75 -38.37 88.93 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 119.954 -0.698 . . . . 118.33 110.721 173.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' VAL . . . . . . . . . . . . . 31.6 t -63.21 -45.93 97.15 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 CA-C-O 121.16 0.505 . . . . 80.939999999999998 110.052 176.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -62.7 -30.41 71.39 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 120.662 -0.415 . . . . 84.290000000000006 111.656 179.661 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.6 p -61.77 -36.08 80.02 Favored 'General case' 0 C--O 1.234 0.248 0 N-CA-C 112.049 0.388 . . . . 88.640000000000001 112.049 -175.315 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 35.5 mt -77.54 6.47 7.06 Favored 'General case' 0 C--N 1.321 -0.658 0 N-CA-C 112.847 0.684 . . . . 87.370000000000005 112.847 178.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 11.1 mt -117.7 157.91 25.63 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 109.154 -0.684 . . . . 87.650000000000006 109.154 175.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -87.35 -54.74 4.13 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-N 116.015 -0.539 . . . . 94.650000000000006 112.377 -173.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -131.7 54.44 1.93 Allowed 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 121.618 0.723 . . . . 124.29000000000001 109.97 -174.191 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 40.6 mmtm -139.81 121.69 15.53 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 109.29 -0.633 . . . . 89.189999999999998 109.29 179.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' THR . . . . . 0.436 HG23 ' OE1' ' A' ' 43' ' ' GLN . 1.6 p -71.3 161.12 80.18 Favored Pre-proline 0 C--O 1.234 0.267 0 CA-C-O 120.991 0.424 . . . . 77.450000000000003 111.163 -177.774 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -58.01 -41.08 72.01 Favored 'Trans proline' 0 C--O 1.237 0.442 0 N-CA-C 113.034 0.359 . . . . 85.799999999999997 113.034 172.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 12.6 tptp -64.94 -37.59 88.14 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.165 -0.614 . . . . 107.34 111.781 176.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.436 ' OE1' HG23 ' A' ' 40' ' ' THR . 89.4 mt-30 -64.67 -29.12 70.12 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.825 -0.35 . . . . 92.299999999999997 111.86 177.77 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 60.2 m -74.71 -41.04 60.92 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 120.343 -0.543 . . . . 65.310000000000002 110.945 177.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 77.7 tttt -58.1 -47.37 83.43 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.882 -0.327 . . . . 91.079999999999998 111.032 172.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -55.43 -52.38 63.79 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 120.756 0.312 . . . . 63.450000000000003 111.376 175.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 30.8 tpt180 -64.24 -35.44 80.83 Favored 'General case' 0 C--O 1.236 0.343 0 C-N-CA 120.493 -0.483 . . . . 66.540000000000006 112.191 -174.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' TRP . . . . . . . . . . . . . 10.8 t-105 -75.84 -35.19 60.04 Favored 'General case' 0 C--N 1.329 -0.313 0 C-N-CA 118.297 -1.361 . . . . 81.010000000000005 111.616 174.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.436 ' O ' HD11 ' A' ' 56' ' ' ILE . 72.3 m-20 -74.24 -22.85 59.16 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 119.598 -0.841 . . . . 70.269999999999996 112.938 178.614 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 63.9 mm-40 -107.99 -6.36 16.63 Favored 'General case' 0 C--N 1.344 0.351 0 N-CA-C 113.05 0.759 . . . . 87.959999999999994 113.05 -177.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' TRP . . . . . . . . . . . . . 69.8 t-105 -150.15 -58.97 0.19 Allowed 'General case' 0 C--N 1.325 -0.467 0 C-N-CA 117.933 -1.507 . . . . 75.629999999999995 112.686 -174.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 2.9 mt -72.73 -29.8 63.65 Favored 'General case' 0 C--O 1.239 0.518 0 C-N-CA 119.253 -0.979 . . . . 76.390000000000001 112.0 -165.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.836 ' HB3' HD12 ' A' ' 56' ' ' ILE . 31.6 t0 -54.7 126.24 56.76 Favored Pre-proline 0 C--O 1.244 0.785 0 C-N-CA 120.243 -0.583 . . . . 69.909999999999997 109.496 -179.674 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -70.11 -8.95 24.87 Favored 'Trans proline' 0 CA--C 1.51 -0.684 0 C-N-CA 120.917 1.078 . . . . 91.099999999999994 113.891 -178.088 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 9.3 p -81.64 -15.46 54.5 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 119.925 -0.71 . . . . 88.030000000000001 112.016 174.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ILE . . . . . 0.836 HD12 ' HB3' ' A' ' 53' ' ' ASP . 4.7 mt -75.09 132.79 32.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 N-CA-C 109.762 -0.458 . . . . 80.390000000000001 109.762 173.431 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.621 HH21 HG21 ' A' ' 59' ' ' ILE . 1.7 mtp180 -71.91 147.92 46.58 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.628 0.728 . . . . 106.41 110.53 177.614 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 10.4 mptt -113.96 -13.72 12.5 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 113.35 0.871 . . . . 92.700000000000003 113.35 -178.442 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.621 HG21 HH21 ' A' ' 57' ' ' ARG . 10.8 tp -79.88 162.39 3.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-O 121.7 0.762 . . . . 114.47 109.271 -178.114 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 6.5 pm0 -59.25 157.61 10.42 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 121.838 0.827 . . . . 129.34 110.366 174.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' TRP . . . . . . . . . . . . . 27.8 m95 -66.04 123.76 20.74 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 115.321 -0.854 . . . . 72.069999999999993 110.539 177.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 23.4 p -76.66 146.67 37.99 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 109.237 -0.653 . . . . 88.629999999999995 109.237 167.146 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.541 ' HA ' ' HB2' ' A' ' 66' ' ' ASP . 1.7 mtpp -76.37 -7.81 55.79 Favored 'General case' 0 C--O 1.232 0.157 0 C-N-CA 119.497 -0.881 . . . . 117.06999999999999 112.064 179.437 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.1 t0 -65.56 -37.64 87.28 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 119.585 -0.846 . . . . 108.3 110.507 158.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -75.3 -28.92 59.9 Favored 'General case' 0 C--O 1.238 0.452 0 C-N-CA 120.986 -0.285 . . . . 81.390000000000001 111.757 174.848 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.541 ' HB2' ' HA ' ' A' ' 63' ' ' LYS . 60.1 m-20 -69.36 -44.52 71.38 Favored 'General case' 0 C--O 1.238 0.459 0 C-N-CA 120.257 -0.577 . . . . 74.010000000000005 110.464 178.01 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -64.21 -38.94 92.86 Favored 'General case' 0 C--O 1.237 0.407 0 N-CA-C 111.885 0.328 . . . . 123.11 111.885 177.456 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -61.03 -40.79 94.91 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 119.865 -0.734 . . . . 89.150000000000006 110.672 174.298 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.452 HD11 ' HB2' ' A' ' 98' ' ' TYR . 2.8 tm? -67.91 -36.61 80.49 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-O 120.556 0.217 . . . . 73.189999999999998 111.11 179.786 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LEU . . . . . 0.446 HD23 ' HE1' ' A' ' 98' ' ' TYR . 61.5 mt -70.09 -43.04 71.9 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 120.463 -0.495 . . . . 78.019999999999996 112.161 179.283 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' HIS . . . . . . . . . . . . . 13.8 m-70 -61.65 -41.17 97.14 Favored 'General case' 0 C--O 1.235 0.322 0 O-C-N 121.829 -0.544 . . . . 108.76000000000001 111.654 179.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 19.2 mt -80.59 -25.68 38.34 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 113.405 0.891 . . . . 75.920000000000002 113.405 -174.215 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -75.43 -31.09 60.24 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 118.061 0.391 . . . . 70.629999999999995 111.44 178.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt -76.55 -31.68 57.74 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 119.678 -0.809 . . . . 120.83 110.992 173.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 26.6 tp -72.53 -45.4 59.52 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.624 -0.43 . . . . 83.939999999999998 111.452 -179.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' MET . . . . . . . . . . . . . 6.3 mtp -133.2 80.48 58.98 Favored Pre-proline 0 C--O 1.237 0.4 0 CA-C-O 121.281 0.562 . . . . 107.11 110.324 -174.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -81.36 -2.12 11.42 Favored 'Trans proline' 0 C--O 1.237 0.43 0 N-CA-C 113.877 0.683 . . . . 112.08 113.877 172.537 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' THR . . . . . 0.477 ' HB ' ' NE2' ' A' ' 79' ' ' GLN . 1.6 m -83.43 -2.94 57.01 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.639 0.775 . . . . 136.46000000000001 113.036 -178.213 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' GLN . . . . . 0.713 ' O ' HG22 ' A' ' 82' ' ' THR . 1.1 pm0 -160.82 132.32 5.69 Favored 'General case' 0 C--O 1.234 0.257 0 CA-C-N 118.88 0.764 . . . . 138.72 109.79 179.034 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' TRP . . . . . . . . . . . . . 49.3 m95 -100.54 -35.89 9.37 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 113.552 0.945 . . . . 119.59999999999999 113.552 -178.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -65.75 2.66 0.94 Allowed 'General case' 0 C--O 1.239 0.501 0 CA-C-N 118.357 0.526 . . . . 134.53 112.312 169.53 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' THR . . . . . 0.713 HG22 ' O ' ' A' ' 79' ' ' GLN . 1.8 t -94.0 -33.22 13.51 Favored 'General case' 0 C--O 1.233 0.228 0 C-N-CA 124.627 1.171 . . . . 137.59999999999999 112.056 178.51 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.552 HD12 ' CG2' ' A' ' 82' ' ' THR . 2.8 mp -72.58 -32.14 40.26 Favored 'Isoleucine or valine' 0 C--O 1.24 0.583 0 CA-C-N 118.33 0.514 . . . . 119.52 110.682 177.467 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.421 ' HB3' ' HD3' ' A' ' 85' ' ' PRO . . . -59.23 -47.89 97.38 Favored Pre-proline 0 C--O 1.236 0.374 0 C-N-CA 125.161 1.385 . . . . 111.25 113.61 -171.464 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' PRO . . . . . 0.421 ' HD3' ' HB3' ' A' ' 84' ' ' ALA . 51.3 Cg_exo -63.55 -0.8 2.67 Favored 'Trans proline' 0 C--O 1.237 0.448 0 CA-C-N 120.956 1.377 . . . . 148.28999999999999 115.04 -179.661 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 11.8 mm -112.56 -41.66 4.02 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 CA-C-N 119.463 1.029 . . . . 136.22 111.275 178.786 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.448 ' O ' ' N ' ' A' ' 89' ' ' ARG . 7.4 p -94.19 116.61 35.88 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 N-CA-C 108.556 -0.905 . . . . 116.3 108.556 170.791 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -60.74 34.38 0.04 OUTLIER Glycine 0 C--N 1.331 0.292 0 N-CA-C 117.567 1.787 . . . . 107.92 117.567 -168.509 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ARG . . . . . 0.448 ' N ' ' O ' ' A' ' 87' ' ' VAL . 12.1 mmt180 -122.65 169.18 11.31 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 124.245 1.018 . . . . 94.549999999999997 110.2 175.523 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' THR . . . . . . . . . . . . . 2.4 p -73.86 158.17 34.99 Favored 'General case' 0 C--N 1.327 -0.399 0 CA-C-N 115.073 -0.967 . . . . 82.590000000000003 111.104 177.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -56.69 -48.81 76.85 Favored 'General case' 0 C--O 1.24 0.557 0 CA-C-N 114.733 -1.121 . . . . 57.350000000000001 111.781 176.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -64.09 -37.58 87.97 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.145 -0.622 . . . . 113.97 110.816 -177.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -61.81 -39.57 92.2 Favored 'General case' 0 C--O 1.239 0.529 0 N-CA-C 111.528 0.196 . . . . 86.469999999999999 111.528 170.166 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 92.8 m -63.29 -46.21 87.84 Favored 'General case' 0 C--O 1.238 0.484 0 O-C-N 122.019 -0.426 . . . . 60.740000000000002 111.24 178.16 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' LEU . . . . . . . . . . . . . 10.1 tp -60.71 -48.54 81.34 Favored 'General case' 0 C--O 1.24 0.557 0 C-N-CA 120.49 -0.484 . . . . 66.510000000000005 110.514 -179.147 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -68.7 -36.09 78.01 Favored 'General case' 0 C--O 1.234 0.263 0 C-N-CA 119.695 -0.802 . . . . 95.219999999999999 111.784 -176.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -68.3 -32.5 72.69 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 118.89 -1.124 . . . . 76.950000000000003 110.917 178.078 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' TYR . . . . . 0.452 ' HB2' HD11 ' A' ' 69' ' ' LEU . 22.6 t80 -68.69 -39.0 80.75 Favored 'General case' 0 C--O 1.234 0.286 0 C-N-CA 120.744 -0.383 . . . . 73.260000000000005 111.148 177.824 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' GLN . . . . . . . . . . . . . 22.5 tp60 -61.93 -39.76 93.14 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.856 -0.338 . . . . 66.030000000000001 111.755 176.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 16.8 tttp -62.97 -47.45 83.14 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 120.653 -0.419 . . . . 102.08 110.96 177.041 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 90.9 mt -60.93 -31.18 70.72 Favored 'General case' 0 C--O 1.236 0.355 0 O-C-N 122.128 -0.357 . . . . 66.430000000000007 111.649 177.275 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 84.2 mt -73.93 -42.14 61.03 Favored 'General case' 0 C--O 1.237 0.41 0 O-C-N 122.167 -0.333 . . . . 69.140000000000001 111.712 170.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -59.25 -44.83 92.36 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.13 -0.628 . . . . 75.400000000000006 111.015 176.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 48.7 mt-10 -65.51 -38.98 91.26 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 120.527 -0.469 . . . . 100.06999999999999 111.314 -178.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -65.93 -43.77 87.1 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.028 -0.669 . . . . 67.5 111.061 177.908 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 8.6 tt0 -57.08 -39.29 74.7 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 111.622 0.23 . . . . 71.079999999999998 111.622 177.481 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -68.89 -19.48 64.22 Favored 'General case' 0 C--O 1.236 0.352 0 C-N-CA 118.982 -1.087 . . . . 83.760000000000005 111.757 178.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.536 0.426 0 CA-C-O 121.393 0.616 . . . . 88.959999999999994 111.85 175.502 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_