data_6w68_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 6w68 _Structure_validation_residue.Date_analyzed 2020-08-14 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 ' 51' ' ' THR . . . . . . . . . . . . . 64.8 p . . . . . 0 C--O 1.226 -0.176 0 N-CA-C 109.995 -0.372 . . . . 89.33 109.995 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 43.7 t80 -115.68 129.19 56.39 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 123.037 0.535 . . . . 85.46 110.083 177.278 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 36.2 t -133.5 138.3 46.06 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.05 -0.722 . . . . 82.54 109.05 -176.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -138.38 146.29 42.09 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.021 0.439 . . . . 74.21 110.393 179.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 22.4 m -138.89 128.24 24.29 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 108.108 -1.071 . . . . 68.39 108.108 178.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 53.0 tp -100.59 110.35 22.49 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 108.89 -0.781 . . . . 68.16 108.89 170.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -67.71 -38.11 83.18 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.167 -0.613 . . . . 81.02 111.474 -176.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -72.87 -3.35 25.12 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 114.169 1.174 . . . . 73.49 114.169 179.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 61.6 t60 -63.36 -47.72 80.94 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 119.684 1.129 . . . . 65.06 112.237 -168.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 44.4 p -66.11 -37.32 85.46 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 119.383 -0.927 . . . . 62.08 111.165 -174.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 50.3 tttp -56.63 -52.93 62.98 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 120.969 0.414 . . . . 78.25 110.834 171.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -61.15 -45.29 95.25 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 120.862 0.363 . . . . 67.59 111.28 -176.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.92 -34.0 76.82 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 120.162 -0.615 . . . . 57.1 111.817 -176.611 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -68.75 -33.82 74.55 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 119.504 -0.878 . . . . 55.1 110.956 174.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -59.5 -40.53 96.36 Favored Glycine 0 C--N 1.335 0.489 0 C-N-CA 120.576 -0.821 . . . . 54.96 112.488 175.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 28.7 mt -72.01 -38.73 64.86 Favored 'Isoleucine or valine' 0 C--O 1.238 0.48 0 O-C-N 122.303 -0.528 . . . . 54.8 110.463 175.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 13.2 mtt -60.54 -37.63 81.85 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.291 -0.563 . . . . 55.81 111.182 176.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 63.4 t30 -65.8 -37.5 86.46 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.315 -0.554 . . . . 53.58 111.032 175.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 65.6 mt-10 -62.69 -42.33 99.58 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.308 -0.557 . . . . 60.19 111.238 176.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 66.6 mt -65.43 -31.33 72.37 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 119.749 -0.78 . . . . 54.18 111.308 -179.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 51.3 ttp85 -69.36 -48.74 60.4 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.304 -0.558 . . . . 55.69 110.582 176.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 86.9 mt -61.63 -29.09 69.83 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.489 -0.484 . . . . 56.27 111.445 178.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.7 m -89.61 -0.25 57.39 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 112.221 0.452 . . . . 57.91 112.221 177.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 80.8 mt-30 54.49 43.72 29.89 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.542 0.687 . . . . 59.84 111.338 -179.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -109.95 136.12 49.73 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.12 0.568 . . . . 62.14 110.152 176.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 64.3 mt 66.39 12.81 8.9 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 125.389 1.476 . . . . 57.27 112.801 177.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 86.7 m -73.19 142.1 47.36 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.248 0.547 . . . . 56.67 110.715 178.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 26.6 p30 -125.62 4.24 7.53 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 113.778 1.029 . . . . 62.23 113.778 -179.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 14.8 p -143.84 135.34 22.52 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 CA-C-N 119.015 0.825 . . . . 61.97 109.109 177.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 21.5 m -115.53 115.59 26.74 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 108.762 -0.829 . . . . 64.86 108.762 173.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 34.5 mt -89.8 112.86 24.31 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 109.374 -0.602 . . . . 65.08 109.374 178.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -95.0 110.26 22.19 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 108.403 -0.962 . . . . 72.56 108.403 174.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 40.5 t -105.25 111.63 35.46 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 N-CA-C 108.173 -1.047 . . . . 67.46 108.173 -173.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LYS . . . . . 0.603 ' NZ ' ' O ' ' A' ' 88' ' ' ALA . 14.1 tptt -118.6 122.92 43.74 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 123.579 0.751 . . . . 74.7 109.657 173.253 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 62.3 t80 -131.9 114.9 15.21 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 108.336 -0.987 . . . . 79.33 108.336 -176.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 42.31 -111.24 0.16 Allowed 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 125.388 1.475 . . . . 80.79 112.248 175.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 13.8 p-10 -103.4 -5.48 22.88 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 113.624 0.972 . . . . 79.06 113.624 -177.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ALA . . . . . 0.603 ' O ' ' NZ ' ' A' ' 84' ' ' LYS . . . -64.39 148.94 95.66 Favored Pre-proline 0 C--O 1.236 0.371 0 C-N-CA 120.174 -0.61 . . . . 75.45 109.514 175.586 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -65.04 143.09 77.49 Favored 'Trans proline' 0 C--O 1.234 0.301 0 CA-C-N 118.366 0.452 . . . . 69.32 111.186 178.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.67 141.58 58.47 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.59 -0.732 . . . . 67.48 110.492 177.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -129.88 166.15 20.57 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.794 0.806 . . . . 66.86 110.128 174.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 17.8 mt-30 -132.61 139.44 47.78 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.023 -0.99 . . . . 70.69 108.786 -175.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -135.36 122.49 21.5 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 109.642 -0.503 . . . . 63.18 109.642 174.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 93.1 mtp -90.82 147.23 23.33 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.55 -0.537 . . . . 63.14 109.55 173.17 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -161.73 178.4 9.02 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.977 -0.749 . . . . 54.32 108.977 -176.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 19.4 m80 -105.59 124.69 49.97 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 123.775 0.83 . . . . 53.6 109.278 175.133 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LYS . . . . . 0.421 ' NZ ' ' OE1' ' A' ' 121' ' ' GLU . 93.1 mttt -54.81 -35.69 64.16 Favored 'General case' 0 C--O 1.236 0.344 0 O-C-N 123.355 0.409 . . . . 67.54 111.464 -177.537 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -64.57 -37.47 87.67 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.542 -0.463 . . . . 51.81 111.371 -178.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 59.5 t -71.57 -48.17 54.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 C-N-CA 119.853 -0.739 . . . . 52.35 110.158 -179.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 72.9 mt -55.13 -45.83 75.61 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.683 -0.407 . . . . 55.41 110.795 175.769 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.11 -30.1 70.16 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.939 -0.305 . . . . 53.51 111.759 -179.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 81.5 p -78.42 -13.08 60.0 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.655 0.613 . . . . 53.96 112.655 -175.325 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 9.7 m -118.8 -12.33 9.66 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 113.057 0.762 . . . . 57.88 113.057 -175.154 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 1.2 t -140.77 113.26 7.06 Favored Pre-proline 0 C--O 1.238 0.495 0 CA-C-N 118.494 0.588 . . . . 56.53 110.403 -177.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_exo -52.96 -27.75 36.85 Favored 'Trans proline' 0 C--O 1.238 0.488 0 N-CA-C 113.76 0.638 . . . . 55.03 113.76 173.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 48.4 t -75.19 -40.42 43.81 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 C-N-CA 120.36 -0.536 . . . . 55.33 110.746 -177.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -65.78 -39.4 90.94 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 119.704 -0.798 . . . . 57.28 111.555 174.124 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 30.2 ttpt -56.91 -52.33 65.61 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 120.294 -0.562 . . . . 59.95 111.203 -179.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.44 -39.29 85.4 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.221 -0.592 . . . . 61.32 111.187 179.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 6.3 ttp -55.14 -36.49 65.84 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.765 -0.374 . . . . 66.03 111.198 174.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -99.12 -27.21 13.93 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 113.116 0.784 . . . . 65.16 113.116 -175.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 76.3 p -84.8 100.83 11.8 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 107.837 -1.171 . . . . 72.73 107.837 177.923 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 3.3 p30 -135.03 164.4 27.71 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 107.424 -1.325 . . . . 90.73 107.424 170.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.83 -23.55 56.35 Favored Glycine 0 CA--C 1.52 0.387 0 N-CA-C 115.52 0.968 . . . . 93.11 115.52 -175.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -78.05 146.67 35.15 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 119.242 1.521 . . . . 93.74 112.011 -174.767 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 10.8 mmt85 -85.42 92.98 8.63 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 115.047 -0.979 . . . . 93.47 108.526 164.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 10.9 mp0 -63.45 139.57 58.78 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.519 0.676 . . . . 94.41 111.168 178.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -97.78 96.23 8.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.228 -0.896 . . . . 95.03 109.009 -173.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 84.14 -114.97 3.99 Favored Glycine 0 N--CA 1.45 -0.399 0 N-CA-C 116.006 1.162 . . . . 90.76 116.006 172.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 50.4 tpp -110.69 104.09 12.73 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 123.337 0.655 . . . . 79.88 109.893 -163.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' GLU . . . . . 0.421 ' OE1' ' NZ ' ' A' ' 97' ' ' LYS . 85.7 tt0 -87.01 133.36 33.59 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 116.147 -0.479 . . . . 74.07 110.141 176.54 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 55.4 t -94.88 135.58 28.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 N-CA-C 108.901 -0.777 . . . . 68.78 108.901 169.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 55.7 t -125.15 122.87 64.08 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 N-CA-C 108.524 -0.917 . . . . 66.81 108.524 178.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 14.9 m -84.85 127.57 34.21 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.409 -0.589 . . . . 68.67 109.409 176.409 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 40.9 mm -117.34 123.83 72.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 N-CA-C 109.436 -0.579 . . . . 68.53 109.436 -176.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -113.37 156.42 23.47 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 123.765 0.826 . . . . 84.28 109.804 -178.186 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 74.74 12.33 82.88 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 116.354 1.301 . . . . 73.35 116.354 167.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 8.5 tt -135.65 139.04 47.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 N-CA-C 107.316 -1.364 . . . . 71.67 107.316 171.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 72.1 t60 -70.9 146.53 93.23 Favored Pre-proline 0 C--N 1.328 -0.347 0 C-N-CA 120.148 -0.621 . . . . 69.06 110.981 -177.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -47.5 -45.85 22.0 Favored 'Trans proline' 0 C--O 1.238 0.519 0 N-CA-C 114.893 1.074 . . . . 66.39 114.893 172.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 8.7 mttt -66.95 -29.36 69.21 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 118.782 -1.167 . . . . 70.04 111.575 -176.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 20.6 t -71.34 -52.12 28.98 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 C-N-CA 120.341 -0.543 . . . . 63.24 110.563 178.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 6.7 tpt -50.19 -49.76 51.47 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.855 0.36 . . . . 67.02 111.792 173.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -52.41 -48.34 65.76 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 120.863 0.363 . . . . 65.19 111.665 177.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 81.7 mtt180 -68.31 -29.83 68.68 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.19 -0.604 . . . . 81.26 111.566 -176.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 82.5 mt -73.41 -46.53 48.13 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.43 -0.508 . . . . 57.77 110.654 178.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 96.2 mt -52.12 -47.84 42.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 CA-C-O 121.1 0.476 . . . . 56.92 110.679 171.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -58.77 -39.39 80.88 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.254 -0.578 . . . . 63.91 111.297 178.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -63.16 -44.56 95.17 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.107 -0.637 . . . . 60.22 110.835 178.029 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -56.4 -34.42 66.71 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 112.019 0.377 . . . . 55.73 112.019 179.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 33.9 m-85 -97.59 -14.27 21.1 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 113.622 0.971 . . . . 55.29 113.622 -174.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 56.1 p -126.81 -13.7 5.78 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 114.473 1.286 . . . . 57.45 114.473 -172.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . 73.5 2.07 4.17 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 126.957 2.103 . . . . 60.19 112.365 -176.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 34.7 m -126.82 157.38 39.4 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 109.133 -0.691 . . . . 63.49 109.133 -177.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 18.8 tt -148.78 144.58 18.48 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 N-CA-C 108.325 -0.991 . . . . 71.68 108.325 176.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 1.4 t -140.57 144.26 35.77 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 109.551 -0.537 . . . . 83.81 109.551 -176.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 1.1 ptt? -165.66 157.18 14.23 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.034 -0.728 . . . . 84.45 109.034 -173.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -81.13 154.44 35.2 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.321 -0.942 . . . . 85.15 111.945 174.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -56.26 -14.89 3.15 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 113.762 1.023 . . . . 86.82 113.762 -169.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -100.7 -9.67 21.61 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 118.906 0.775 . . . . 89.98 112.98 177.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' CYS . . . . . . . . . . . . . 16.1 m -82.1 -20.12 38.75 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 113.132 0.79 . . . . 96.8 113.132 171.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 75.9 t -53.65 -30.73 18.88 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 N-CA-C 112.058 0.392 . . . . 79.67 112.058 -170.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 20.1 tp -76.45 -44.79 34.16 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 119.512 -0.875 . . . . 73.19 111.492 -175.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 47.9 m80 -66.04 -29.25 69.56 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.282 -0.567 . . . . 79.86 112.068 178.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 44.8 t -72.61 -38.4 58.92 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 C-N-CA 120.491 -0.484 . . . . 68.95 110.922 -179.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' MET . . . . . . . . . . . . . 12.1 ttp -63.25 -42.88 99.23 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 119.902 -0.719 . . . . 71.08 110.858 175.136 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -50.19 -52.83 32.34 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 120.977 0.417 . . . . 65.65 110.657 173.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -63.47 -41.33 99.32 Favored Glycine 0 C--N 1.336 0.534 0 C-N-CA 120.282 -0.961 . . . . 62.48 112.689 177.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -64.41 -39.92 94.78 Favored 'General case' 0 C--O 1.236 0.375 0 O-C-N 122.264 -0.551 . . . . 60.44 111.473 178.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 74.6 t -62.53 -43.53 98.48 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 C-N-CA 120.476 -0.49 . . . . 59.93 110.323 173.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 16.1 ttt -63.04 -31.43 72.57 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 112.095 0.406 . . . . 74.42 112.095 -177.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -107.75 13.87 26.06 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 112.638 0.607 . . . . 63.24 112.638 178.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 51.04 47.16 25.37 Favored 'General case' 0 N--CA 1.463 0.196 0 C-N-CA 123.969 0.908 . . . . 60.78 112.213 171.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 39.5 mt -91.79 86.96 2.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 N-CA-C 104.595 -2.372 . . . . 64.68 104.595 173.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -61.72 -30.04 70.5 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 112.956 0.724 . . . . 68.66 112.956 -168.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.85 -41.12 92.07 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 119.7 -0.8 . . . . 66.96 110.784 175.663 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 79.9 t -77.54 -38.46 26.07 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 C-N-CA 120.572 -0.451 . . . . 69.01 110.427 -174.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 53.3 t -55.29 -51.98 50.32 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 CA-C-O 121.142 0.496 . . . . 70.32 110.361 174.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 5.5 ttm180 -59.29 -35.27 73.47 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 122.155 -0.34 . . . . 81.28 111.072 -178.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -76.11 -44.9 36.45 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.567 -0.453 . . . . 73.37 111.141 -177.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' CYS . . . . . . . . . . . . . 88.7 m -64.12 -31.49 72.7 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.573 -0.451 . . . . 75.45 111.168 177.688 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -67.68 -45.04 76.33 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 120.958 -0.297 . . . . 76.68 110.832 175.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -55.15 -42.07 72.61 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 121.208 -0.197 . . . . 81.13 111.497 176.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -66.29 -50.39 63.83 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.56 -0.456 . . . . 83.15 111.999 -176.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 25.1 mt -59.0 -41.23 87.19 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.445 -0.502 . . . . 77.65 112.128 -179.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 81.1 t -63.66 -38.74 83.06 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 C-N-CA 120.533 -0.467 . . . . 80.19 111.369 178.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -70.07 -19.77 63.26 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 119.016 -1.074 . . . . 88.15 113.415 178.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -78.11 27.47 0.19 Allowed 'General case' 0 C--O 1.235 0.337 0 CA-C-N 118.884 0.765 . . . . 83.44 112.25 173.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 36.0 mt . . . . . 0 C--N 1.329 -0.294 0 CA-C-O 120.751 0.31 . . . . 80.7 110.613 -172.681 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 64.8 p . . . . . 0 C--O 1.226 -0.176 0 N-CA-C 109.995 -0.372 . . . . 89.33 109.995 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 43.7 t80 -115.68 129.19 56.39 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 123.037 0.535 . . . . 85.46 110.083 177.278 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 36.2 t -133.5 138.3 46.06 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.05 -0.722 . . . . 82.54 109.05 -176.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -138.38 146.29 42.09 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.021 0.439 . . . . 74.21 110.393 179.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 22.4 m -138.89 128.24 24.29 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 108.108 -1.071 . . . . 68.39 108.108 178.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LEU . . . . . 0.489 HD23 ' HB2' ' A' ' 59' ' ' HIS . 53.0 tp -100.59 110.35 22.49 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 108.89 -0.781 . . . . 68.16 108.89 170.939 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -67.71 -38.11 83.18 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.167 -0.613 . . . . 81.02 111.474 -176.026 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -72.87 -3.35 25.12 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 114.169 1.174 . . . . 73.49 114.169 179.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' HIS . . . . . 0.489 ' HB2' HD23 ' A' ' 56' ' ' LEU . 61.6 t60 -63.36 -47.72 80.94 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 119.684 1.129 . . . . 65.06 112.237 -168.605 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 44.4 p -66.11 -37.32 85.46 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 119.383 -0.927 . . . . 62.08 111.165 -174.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 50.3 tttp -56.63 -52.93 62.98 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 120.969 0.414 . . . . 78.25 110.834 171.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -61.15 -45.29 95.25 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 120.862 0.363 . . . . 67.59 111.28 -176.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.92 -34.0 76.82 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 120.162 -0.615 . . . . 57.1 111.817 -176.611 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -68.75 -33.82 74.55 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 119.504 -0.878 . . . . 55.1 110.956 174.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLY . . . . . 0.504 ' O ' ' HG3' ' A' ' 69' ' ' GLU . . . -59.5 -40.53 96.36 Favored Glycine 0 C--N 1.335 0.489 0 C-N-CA 120.576 -0.821 . . . . 54.96 112.488 175.313 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 28.7 mt -72.01 -38.73 64.86 Favored 'Isoleucine or valine' 0 C--O 1.238 0.48 0 O-C-N 122.303 -0.528 . . . . 54.8 110.463 175.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 13.2 mtt -60.54 -37.63 81.85 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.291 -0.563 . . . . 55.81 111.182 176.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 63.4 t30 -65.8 -37.5 86.46 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.315 -0.554 . . . . 53.58 111.032 175.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' GLU . . . . . 0.504 ' HG3' ' O ' ' A' ' 65' ' ' GLY . 65.6 mt-10 -62.69 -42.33 99.58 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.308 -0.557 . . . . 60.19 111.238 176.481 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 66.6 mt -65.43 -31.33 72.37 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 119.749 -0.78 . . . . 54.18 111.308 -179.366 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 51.3 ttp85 -69.36 -48.74 60.4 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.304 -0.558 . . . . 55.69 110.582 176.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 86.9 mt -61.63 -29.09 69.83 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.489 -0.484 . . . . 56.27 111.445 178.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.7 m -89.61 -0.25 57.39 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 112.221 0.452 . . . . 57.91 112.221 177.15 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 80.8 mt-30 54.49 43.72 29.89 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.542 0.687 . . . . 59.84 111.338 -179.718 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -109.95 136.12 49.73 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.12 0.568 . . . . 62.14 110.152 176.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 64.3 mt 66.39 12.81 8.9 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 125.389 1.476 . . . . 57.27 112.801 177.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 86.7 m -73.19 142.1 47.36 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.248 0.547 . . . . 56.67 110.715 178.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 26.6 p30 -125.62 4.24 7.53 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 113.778 1.029 . . . . 62.23 113.778 -179.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 14.8 p -143.84 135.34 22.52 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 CA-C-N 119.015 0.825 . . . . 61.97 109.109 177.132 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 21.5 m -115.53 115.59 26.74 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 108.762 -0.829 . . . . 64.86 108.762 173.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 34.5 mt -89.8 112.86 24.31 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 109.374 -0.602 . . . . 65.08 109.374 178.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 23.9 mt-30 -95.0 110.26 22.19 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 108.403 -0.962 . . . . 72.56 108.403 174.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 40.5 t -105.25 111.63 35.46 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 N-CA-C 108.173 -1.047 . . . . 67.46 108.173 -173.505 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LYS . . . . . 0.593 ' NZ ' ' O ' ' A' ' 88' ' ' ALA . 14.1 tptt -118.6 122.92 43.74 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 123.579 0.751 . . . . 74.7 109.657 173.253 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 62.3 t80 -131.9 114.9 15.21 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 108.336 -0.987 . . . . 79.33 108.336 -176.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 42.31 -111.24 0.16 Allowed 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 125.388 1.475 . . . . 80.79 112.248 175.666 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 13.8 p-10 -103.4 -5.48 22.88 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 113.624 0.972 . . . . 79.06 113.624 -177.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ALA . . . . . 0.593 ' O ' ' NZ ' ' A' ' 84' ' ' LYS . . . -64.39 148.94 95.66 Favored Pre-proline 0 C--O 1.236 0.371 0 C-N-CA 120.174 -0.61 . . . . 75.45 109.514 175.586 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -65.04 143.09 77.49 Favored 'Trans proline' 0 C--O 1.234 0.301 0 CA-C-N 118.366 0.452 . . . . 69.32 111.186 178.324 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.67 141.58 58.47 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.59 -0.732 . . . . 67.48 110.492 177.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -129.88 166.15 20.57 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.794 0.806 . . . . 66.86 110.128 174.662 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 17.8 mt-30 -132.61 139.44 47.78 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.023 -0.99 . . . . 70.69 108.786 -175.642 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -135.36 122.49 21.5 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 109.642 -0.503 . . . . 63.18 109.642 174.584 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 93.1 mtp -90.82 147.23 23.33 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.55 -0.537 . . . . 63.14 109.55 173.17 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -161.73 178.4 9.02 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.977 -0.749 . . . . 54.32 108.977 -176.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 19.4 m80 -105.59 124.69 49.97 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 123.775 0.83 . . . . 53.6 109.278 175.133 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -54.81 -35.69 64.16 Favored 'General case' 0 C--O 1.236 0.344 0 O-C-N 123.355 0.409 . . . . 67.54 111.464 -177.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -64.57 -37.47 87.67 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.542 -0.463 . . . . 51.81 111.371 -178.26 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 59.5 t -71.57 -48.17 54.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 C-N-CA 119.853 -0.739 . . . . 52.35 110.158 -179.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 72.9 mt -55.13 -45.83 75.61 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.683 -0.407 . . . . 55.41 110.795 175.769 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.11 -30.1 70.16 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.939 -0.305 . . . . 53.51 111.759 -179.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 81.5 p -78.42 -13.08 60.0 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.655 0.613 . . . . 53.96 112.655 -175.325 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 9.7 m -118.8 -12.33 9.66 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 113.057 0.762 . . . . 57.88 113.057 -175.154 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 1.2 t -140.77 113.26 7.06 Favored Pre-proline 0 C--O 1.238 0.495 0 CA-C-N 118.494 0.588 . . . . 56.53 110.403 -177.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_exo -52.96 -27.75 36.85 Favored 'Trans proline' 0 C--O 1.238 0.488 0 N-CA-C 113.76 0.638 . . . . 55.03 113.76 173.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 48.4 t -75.19 -40.42 43.81 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 C-N-CA 120.36 -0.536 . . . . 55.33 110.746 -177.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -65.78 -39.4 90.94 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 119.704 -0.798 . . . . 57.28 111.555 174.124 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 30.2 ttpt -56.91 -52.33 65.61 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 120.294 -0.562 . . . . 59.95 111.203 -179.352 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.44 -39.29 85.4 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.221 -0.592 . . . . 61.32 111.187 179.017 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 6.3 ttp -55.14 -36.49 65.84 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.765 -0.374 . . . . 66.03 111.198 174.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -99.12 -27.21 13.93 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 113.116 0.784 . . . . 65.16 113.116 -175.108 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 76.3 p -84.8 100.83 11.8 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 107.837 -1.171 . . . . 72.73 107.837 177.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ASN . . . . . 0.744 ' OD1' HD23 ' A' ' 115' ' ' LEU . 3.3 p30 -135.03 164.4 27.71 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 107.424 -1.325 . . . . 90.73 107.424 170.784 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.83 -23.55 56.35 Favored Glycine 0 CA--C 1.52 0.387 0 N-CA-C 115.52 0.968 . . . . 93.11 115.52 -175.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' LEU . . . . . 0.744 HD23 ' OD1' ' A' ' 113' ' ' ASN . 0.7 OUTLIER -78.05 146.67 35.15 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 119.242 1.521 . . . . 93.74 112.011 -174.767 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 10.8 mmt85 -85.42 92.98 8.63 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 115.047 -0.979 . . . . 93.47 108.526 164.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 10.9 mp0 -63.45 139.57 58.78 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.519 0.676 . . . . 94.41 111.168 178.192 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -97.78 96.23 8.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.228 -0.896 . . . . 95.03 109.009 -173.291 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 84.14 -114.97 3.99 Favored Glycine 0 N--CA 1.45 -0.399 0 N-CA-C 116.006 1.162 . . . . 90.76 116.006 172.474 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 50.4 tpp -110.69 104.09 12.73 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 123.337 0.655 . . . . 79.88 109.893 -163.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -87.01 133.36 33.59 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 116.147 -0.479 . . . . 74.07 110.141 176.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 55.4 t -94.88 135.58 28.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 N-CA-C 108.901 -0.777 . . . . 68.78 108.901 169.485 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 55.7 t -125.15 122.87 64.08 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 N-CA-C 108.524 -0.917 . . . . 66.81 108.524 178.417 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 14.9 m -84.85 127.57 34.21 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.409 -0.589 . . . . 68.67 109.409 176.409 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 40.9 mm -117.34 123.83 72.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 N-CA-C 109.436 -0.579 . . . . 68.53 109.436 -176.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -113.37 156.42 23.47 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 123.765 0.826 . . . . 84.28 109.804 -178.186 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 74.74 12.33 82.88 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 116.354 1.301 . . . . 73.35 116.354 167.203 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 8.5 tt -135.65 139.04 47.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 N-CA-C 107.316 -1.364 . . . . 71.67 107.316 171.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HIS . . . . . 0.589 ' CD2' ' HD2' ' A' ' 131' ' ' LYS . 72.1 t60 -70.9 146.53 93.23 Favored Pre-proline 0 C--N 1.328 -0.347 0 C-N-CA 120.148 -0.621 . . . . 69.06 110.981 -177.887 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -47.5 -45.85 22.0 Favored 'Trans proline' 0 C--O 1.238 0.519 0 N-CA-C 114.893 1.074 . . . . 66.39 114.893 172.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' LYS . . . . . 0.589 ' HD2' ' CD2' ' A' ' 129' ' ' HIS . 8.7 mttt -66.95 -29.36 69.21 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 118.782 -1.167 . . . . 70.04 111.575 -176.849 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 132' ' ' VAL . . . . . 0.538 HG13 ' HA ' ' A' ' 155' ' ' VAL . 20.6 t -71.34 -52.12 28.98 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 C-N-CA 120.341 -0.543 . . . . 63.24 110.563 178.382 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 6.7 tpt -50.19 -49.76 51.47 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.855 0.36 . . . . 67.02 111.792 173.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -52.41 -48.34 65.76 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 120.863 0.363 . . . . 65.19 111.665 177.454 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 81.7 mtt180 -68.31 -29.83 68.68 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.19 -0.604 . . . . 81.26 111.566 -176.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 82.5 mt -73.41 -46.53 48.13 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.43 -0.508 . . . . 57.77 110.654 178.34 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 96.2 mt -52.12 -47.84 42.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 CA-C-O 121.1 0.476 . . . . 56.92 110.679 171.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -58.77 -39.39 80.88 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.254 -0.578 . . . . 63.91 111.297 178.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -63.16 -44.56 95.17 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.107 -0.637 . . . . 60.22 110.835 178.029 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -56.4 -34.42 66.71 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 112.019 0.377 . . . . 55.73 112.019 179.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 33.9 m-85 -97.59 -14.27 21.1 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 113.622 0.971 . . . . 55.29 113.622 -174.481 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 56.1 p -126.81 -13.7 5.78 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 114.473 1.286 . . . . 57.45 114.473 -172.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . 73.5 2.07 4.17 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 126.957 2.103 . . . . 60.19 112.365 -176.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 34.7 m -126.82 157.38 39.4 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 109.133 -0.691 . . . . 63.49 109.133 -177.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 18.8 tt -148.78 144.58 18.48 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 N-CA-C 108.325 -0.991 . . . . 71.68 108.325 176.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 1.4 t -140.57 144.26 35.77 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 109.551 -0.537 . . . . 83.81 109.551 -176.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 1.1 ptt? -165.66 157.18 14.23 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.034 -0.728 . . . . 84.45 109.034 -173.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -81.13 154.44 35.2 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.321 -0.942 . . . . 85.15 111.945 174.058 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -56.26 -14.89 3.15 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 113.762 1.023 . . . . 86.82 113.762 -169.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -100.7 -9.67 21.61 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 118.906 0.775 . . . . 89.98 112.98 177.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' CYS . . . . . . . . . . . . . 16.1 m -82.1 -20.12 38.75 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 113.132 0.79 . . . . 96.8 113.132 171.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 75.9 t -53.65 -30.73 18.88 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 N-CA-C 112.058 0.392 . . . . 79.67 112.058 -170.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 20.1 tp -76.45 -44.79 34.16 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 119.512 -0.875 . . . . 73.19 111.492 -175.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 47.9 m80 -66.04 -29.25 69.56 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.282 -0.567 . . . . 79.86 112.068 178.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 155' ' ' VAL . . . . . 0.538 ' HA ' HG13 ' A' ' 132' ' ' VAL . 44.8 t -72.61 -38.4 58.92 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 C-N-CA 120.491 -0.484 . . . . 68.95 110.922 -179.83 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 156' ' ' MET . . . . . . . . . . . . . 12.1 ttp -63.25 -42.88 99.23 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 119.902 -0.719 . . . . 71.08 110.858 175.136 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -50.19 -52.83 32.34 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 120.977 0.417 . . . . 65.65 110.657 173.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -63.47 -41.33 99.32 Favored Glycine 0 C--N 1.336 0.534 0 C-N-CA 120.282 -0.961 . . . . 62.48 112.689 177.846 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -64.41 -39.92 94.78 Favored 'General case' 0 C--O 1.236 0.375 0 O-C-N 122.264 -0.551 . . . . 60.44 111.473 178.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 74.6 t -62.53 -43.53 98.48 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 C-N-CA 120.476 -0.49 . . . . 59.93 110.323 173.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 16.1 ttt -63.04 -31.43 72.57 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 112.095 0.406 . . . . 74.42 112.095 -177.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 162' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -107.75 13.87 26.06 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 112.638 0.607 . . . . 63.24 112.638 178.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 163' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 51.04 47.16 25.37 Favored 'General case' 0 N--CA 1.463 0.196 0 C-N-CA 123.969 0.908 . . . . 60.78 112.213 171.926 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 39.5 mt -91.79 86.96 2.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 N-CA-C 104.595 -2.372 . . . . 64.68 104.595 173.203 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -61.72 -30.04 70.5 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 112.956 0.724 . . . . 68.66 112.956 -168.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.85 -41.12 92.07 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 119.7 -0.8 . . . . 66.96 110.784 175.663 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 79.9 t -77.54 -38.46 26.07 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 C-N-CA 120.572 -0.451 . . . . 69.01 110.427 -174.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 53.3 t -55.29 -51.98 50.32 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 CA-C-O 121.142 0.496 . . . . 70.32 110.361 174.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 5.5 ttm180 -59.29 -35.27 73.47 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 122.155 -0.34 . . . . 81.28 111.072 -178.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -76.11 -44.9 36.45 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.567 -0.453 . . . . 73.37 111.141 -177.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 171' ' ' CYS . . . . . . . . . . . . . 88.7 m -64.12 -31.49 72.7 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.573 -0.451 . . . . 75.45 111.168 177.688 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -67.68 -45.04 76.33 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 120.958 -0.297 . . . . 76.68 110.832 175.762 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -55.15 -42.07 72.61 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 121.208 -0.197 . . . . 81.13 111.497 176.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 174' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -66.29 -50.39 63.83 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.56 -0.456 . . . . 83.15 111.999 -176.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 25.1 mt -59.0 -41.23 87.19 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.445 -0.502 . . . . 77.65 112.128 -179.085 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 81.1 t -63.66 -38.74 83.06 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 C-N-CA 120.533 -0.467 . . . . 80.19 111.369 178.228 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -70.07 -19.77 63.26 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 119.016 -1.074 . . . . 88.15 113.415 178.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 178' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -78.11 27.47 0.19 Allowed 'General case' 0 C--O 1.235 0.337 0 CA-C-N 118.884 0.765 . . . . 83.44 112.25 173.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 36.0 mt . . . . . 0 C--N 1.329 -0.294 0 CA-C-O 120.751 0.31 . . . . 80.7 110.613 -172.681 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 64.8 p . . . . . 0 C--O 1.226 -0.176 0 N-CA-C 109.995 -0.372 . . . . 89.33 109.995 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 43.7 t80 -115.68 129.19 56.39 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 123.037 0.535 . . . . 85.46 110.083 177.278 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 36.2 t -133.5 138.3 46.06 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 109.05 -0.722 . . . . 82.54 109.05 -176.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 66.2 t80 -138.38 146.29 42.09 Favored 'General case' 0 C--O 1.233 0.201 0 CA-C-O 121.021 0.439 . . . . 74.21 110.393 179.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 22.4 m -138.89 128.24 24.29 Favored 'General case' 0 C--O 1.234 0.272 0 N-CA-C 108.108 -1.071 . . . . 68.39 108.108 178.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.489 HD23 ' HB2' ' A' ' 59' ' ' HIS . 53.0 tp -100.59 110.35 22.49 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 108.89 -0.781 . . . . 68.16 108.89 170.939 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -67.71 -38.11 83.18 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.167 -0.613 . . . . 81.02 111.474 -176.026 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 7.5 t0 -72.87 -3.35 25.12 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 114.169 1.174 . . . . 73.49 114.169 179.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.489 ' HB2' HD23 ' A' ' 56' ' ' LEU . 61.6 t60 -63.36 -47.72 80.94 Favored 'General case' 0 C--O 1.237 0.404 0 CA-C-N 119.684 1.129 . . . . 65.06 112.237 -168.605 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 44.4 p -66.11 -37.32 85.46 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 119.383 -0.927 . . . . 62.08 111.165 -174.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 50.3 tttp -56.63 -52.93 62.98 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 120.969 0.414 . . . . 78.25 110.834 171.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -61.15 -45.29 95.25 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-O 120.862 0.363 . . . . 67.59 111.28 -176.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.92 -34.0 76.82 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 120.162 -0.615 . . . . 57.1 111.817 -176.611 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 1.6 m-85 -68.75 -33.82 74.55 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 119.504 -0.878 . . . . 55.1 110.956 174.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLY . . . . . 0.504 ' O ' ' HG3' ' A' ' 69' ' ' GLU . . . -59.5 -40.53 96.36 Favored Glycine 0 C--N 1.335 0.489 0 C-N-CA 120.576 -0.821 . . . . 54.96 112.488 175.313 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 28.7 mt -72.01 -38.73 64.86 Favored 'Isoleucine or valine' 0 C--O 1.238 0.48 0 O-C-N 122.303 -0.528 . . . . 54.8 110.463 175.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 13.2 mtt -60.54 -37.63 81.85 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.291 -0.563 . . . . 55.81 111.182 176.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 63.4 t30 -65.8 -37.5 86.46 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 120.315 -0.554 . . . . 53.58 111.032 175.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.504 ' HG3' ' O ' ' A' ' 65' ' ' GLY . 65.6 mt-10 -62.69 -42.33 99.58 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.308 -0.557 . . . . 60.19 111.238 176.481 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 66.6 mt -65.43 -31.33 72.37 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 119.749 -0.78 . . . . 54.18 111.308 -179.366 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 51.3 ttp85 -69.36 -48.74 60.4 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.304 -0.558 . . . . 55.69 110.582 176.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 86.9 mt -61.63 -29.09 69.83 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.489 -0.484 . . . . 56.27 111.445 178.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 2.7 m -89.61 -0.25 57.39 Favored 'General case' 0 C--O 1.235 0.317 0 N-CA-C 112.221 0.452 . . . . 57.91 112.221 177.15 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 80.8 mt-30 54.49 43.72 29.89 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-O 121.542 0.687 . . . . 59.84 111.338 -179.718 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 94.4 mt-30 -109.95 136.12 49.73 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 123.12 0.568 . . . . 62.14 110.152 176.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 64.3 mt 66.39 12.81 8.9 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 125.389 1.476 . . . . 57.27 112.801 177.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 86.7 m -73.19 142.1 47.36 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.248 0.547 . . . . 56.67 110.715 178.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 26.6 p30 -125.62 4.24 7.53 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 113.778 1.029 . . . . 62.23 113.778 -179.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 14.8 p -143.84 135.34 22.52 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 CA-C-N 119.015 0.825 . . . . 61.97 109.109 177.132 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 21.5 m -115.53 115.59 26.74 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 108.762 -0.829 . . . . 64.86 108.762 173.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 34.5 mt -89.8 112.86 24.31 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 109.374 -0.602 . . . . 65.08 109.374 178.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -95.0 110.26 22.19 Favored 'General case' 0 C--O 1.236 0.376 0 N-CA-C 108.403 -0.962 . . . . 72.56 108.403 174.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 40.5 t -105.25 111.63 35.46 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 N-CA-C 108.173 -1.047 . . . . 67.46 108.173 -173.505 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.593 ' NZ ' ' O ' ' A' ' 88' ' ' ALA . 14.1 tptt -118.6 122.92 43.74 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 123.579 0.751 . . . . 74.7 109.657 173.253 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 62.3 t80 -131.9 114.9 15.21 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 108.336 -0.987 . . . . 79.33 108.336 -176.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 3.3 pt20 42.31 -111.24 0.16 Allowed 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 125.388 1.475 . . . . 80.79 112.248 175.666 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 13.8 p-10 -103.4 -5.48 22.88 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 113.624 0.972 . . . . 79.06 113.624 -177.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ALA . . . . . 0.593 ' O ' ' NZ ' ' A' ' 84' ' ' LYS . . . -64.39 148.94 95.66 Favored Pre-proline 0 C--O 1.236 0.371 0 C-N-CA 120.174 -0.61 . . . . 75.45 109.514 175.586 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -65.04 143.09 77.49 Favored 'Trans proline' 0 C--O 1.234 0.301 0 CA-C-N 118.366 0.452 . . . . 69.32 111.186 178.324 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -62.67 141.58 58.47 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.59 -0.732 . . . . 67.48 110.492 177.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -129.88 166.15 20.57 Favored 'General case' 0 C--O 1.234 0.254 0 CA-C-O 121.794 0.806 . . . . 66.86 110.128 174.662 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 17.8 mt-30 -132.61 139.44 47.78 Favored 'General case' 0 C--O 1.234 0.238 0 CA-C-N 115.023 -0.99 . . . . 70.69 108.786 -175.642 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 52.7 m-85 -135.36 122.49 21.5 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 109.642 -0.503 . . . . 63.18 109.642 174.584 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 93.1 mtp -90.82 147.23 23.33 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 109.55 -0.537 . . . . 63.14 109.55 173.17 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -161.73 178.4 9.02 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.977 -0.749 . . . . 54.32 108.977 -176.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 19.4 m80 -105.59 124.69 49.97 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 123.775 0.83 . . . . 53.6 109.278 175.133 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 93.1 mttt -54.81 -35.69 64.16 Favored 'General case' 0 C--O 1.236 0.344 0 O-C-N 123.355 0.409 . . . . 67.54 111.464 -177.537 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -64.57 -37.47 87.67 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.542 -0.463 . . . . 51.81 111.371 -178.26 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 59.5 t -71.57 -48.17 54.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.42 0 C-N-CA 119.853 -0.739 . . . . 52.35 110.158 -179.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 72.9 mt -55.13 -45.83 75.61 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.683 -0.407 . . . . 55.41 110.795 175.769 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -61.11 -30.1 70.16 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.939 -0.305 . . . . 53.51 111.759 -179.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 81.5 p -78.42 -13.08 60.0 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.655 0.613 . . . . 53.96 112.655 -175.325 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 9.7 m -118.8 -12.33 9.66 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 113.057 0.762 . . . . 57.88 113.057 -175.154 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 1.2 t -140.77 113.26 7.06 Favored Pre-proline 0 C--O 1.238 0.495 0 CA-C-N 118.494 0.588 . . . . 56.53 110.403 -177.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_exo -52.96 -27.75 36.85 Favored 'Trans proline' 0 C--O 1.238 0.488 0 N-CA-C 113.76 0.638 . . . . 55.03 113.76 173.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 48.4 t -75.19 -40.42 43.81 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 C-N-CA 120.36 -0.536 . . . . 55.33 110.746 -177.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 14.6 m-85 -65.78 -39.4 90.94 Favored 'General case' 0 C--O 1.236 0.372 0 C-N-CA 119.704 -0.798 . . . . 57.28 111.555 174.124 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 30.2 ttpt -56.91 -52.33 65.61 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 120.294 -0.562 . . . . 59.95 111.203 -179.352 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -67.44 -39.29 85.4 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.221 -0.592 . . . . 61.32 111.187 179.017 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 6.3 ttp -55.14 -36.49 65.84 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.765 -0.374 . . . . 66.03 111.198 174.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -99.12 -27.21 13.93 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 113.116 0.784 . . . . 65.16 113.116 -175.108 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 76.3 p -84.8 100.83 11.8 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 107.837 -1.171 . . . . 72.73 107.837 177.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ASN . . . . . 0.744 ' OD1' HD23 ' A' ' 115' ' ' LEU . 3.3 p30 -135.03 164.4 27.71 Favored 'General case' 0 C--N 1.327 -0.393 0 N-CA-C 107.424 -1.325 . . . . 90.73 107.424 170.784 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -58.83 -23.55 56.35 Favored Glycine 0 CA--C 1.52 0.387 0 N-CA-C 115.52 0.968 . . . . 93.11 115.52 -175.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.744 HD23 ' OD1' ' A' ' 113' ' ' ASN . 0.7 OUTLIER -78.05 146.67 35.15 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 119.242 1.521 . . . . 93.74 112.011 -174.767 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 10.8 mmt85 -85.42 92.98 8.63 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 115.047 -0.979 . . . . 93.47 108.526 164.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 10.9 mp0 -63.45 139.57 58.78 Favored 'General case' 0 C--O 1.235 0.29 0 CA-C-O 121.519 0.676 . . . . 94.41 111.168 178.192 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 67.4 mt-30 -97.78 96.23 8.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 115.228 -0.896 . . . . 95.03 109.009 -173.291 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 84.14 -114.97 3.99 Favored Glycine 0 N--CA 1.45 -0.399 0 N-CA-C 116.006 1.162 . . . . 90.76 116.006 172.474 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 50.4 tpp -110.69 104.09 12.73 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 123.337 0.655 . . . . 79.88 109.893 -163.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -87.01 133.36 33.59 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 116.147 -0.479 . . . . 74.07 110.141 176.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 55.4 t -94.88 135.58 28.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 N-CA-C 108.901 -0.777 . . . . 68.78 108.901 169.485 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 55.7 t -125.15 122.87 64.08 Favored 'Isoleucine or valine' 0 C--O 1.238 0.453 0 N-CA-C 108.524 -0.917 . . . . 66.81 108.524 178.417 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 14.9 m -84.85 127.57 34.21 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 109.409 -0.589 . . . . 68.67 109.409 176.409 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 40.9 mm -117.34 123.83 72.27 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 N-CA-C 109.436 -0.579 . . . . 68.53 109.436 -176.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -113.37 156.42 23.47 Favored 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 123.765 0.826 . . . . 84.28 109.804 -178.186 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 74.74 12.33 82.88 Favored Glycine 0 N--CA 1.449 -0.499 0 N-CA-C 116.354 1.301 . . . . 73.35 116.354 167.203 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 8.5 tt -135.65 139.04 47.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 N-CA-C 107.316 -1.364 . . . . 71.67 107.316 171.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HIS . . . . . 0.589 ' CD2' ' HD2' ' A' ' 131' ' ' LYS . 72.1 t60 -70.9 146.53 93.23 Favored Pre-proline 0 C--N 1.328 -0.347 0 C-N-CA 120.148 -0.621 . . . . 69.06 110.981 -177.887 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -47.5 -45.85 22.0 Favored 'Trans proline' 0 C--O 1.238 0.519 0 N-CA-C 114.893 1.074 . . . . 66.39 114.893 172.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' LYS . . . . . 0.589 ' HD2' ' CD2' ' A' ' 129' ' ' HIS . 8.7 mttt -66.95 -29.36 69.21 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 118.782 -1.167 . . . . 70.04 111.575 -176.849 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' VAL . . . . . 0.538 HG13 ' HA ' ' A' ' 155' ' ' VAL . 20.6 t -71.34 -52.12 28.98 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 C-N-CA 120.341 -0.543 . . . . 63.24 110.563 178.382 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 6.7 tpt -50.19 -49.76 51.47 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-O 120.855 0.36 . . . . 67.02 111.792 173.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -52.41 -48.34 65.76 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 120.863 0.363 . . . . 65.19 111.665 177.454 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 81.7 mtt180 -68.31 -29.83 68.68 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.19 -0.604 . . . . 81.26 111.566 -176.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 82.5 mt -73.41 -46.53 48.13 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.43 -0.508 . . . . 57.77 110.654 178.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 96.2 mt -52.12 -47.84 42.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 CA-C-O 121.1 0.476 . . . . 56.92 110.679 171.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 18.8 mt-10 -58.77 -39.39 80.88 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 120.254 -0.578 . . . . 63.91 111.297 178.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -63.16 -44.56 95.17 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 120.107 -0.637 . . . . 60.22 110.835 178.029 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -56.4 -34.42 66.71 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 112.019 0.377 . . . . 55.73 112.019 179.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 33.9 m-85 -97.59 -14.27 21.1 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 113.622 0.971 . . . . 55.29 113.622 -174.481 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 56.1 p -126.81 -13.7 5.78 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 114.473 1.286 . . . . 57.45 114.473 -172.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . 73.5 2.07 4.17 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 126.957 2.103 . . . . 60.19 112.365 -176.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 34.7 m -126.82 157.38 39.4 Favored 'General case' 0 C--O 1.233 0.236 0 N-CA-C 109.133 -0.691 . . . . 63.49 109.133 -177.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 18.8 tt -148.78 144.58 18.48 Favored 'Isoleucine or valine' 0 C--O 1.234 0.284 0 N-CA-C 108.325 -0.991 . . . . 71.68 108.325 176.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 1.4 t -140.57 144.26 35.77 Favored 'General case' 0 C--O 1.234 0.263 0 N-CA-C 109.551 -0.537 . . . . 83.81 109.551 -176.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 1.1 ptt? -165.66 157.18 14.23 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 109.034 -0.728 . . . . 84.45 109.034 -173.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -81.13 154.44 35.2 Favored Glycine 0 N--CA 1.448 -0.524 0 C-N-CA 120.321 -0.942 . . . . 85.15 111.945 174.058 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -56.26 -14.89 3.15 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 113.762 1.023 . . . . 86.82 113.762 -169.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 82.6 mttt -100.7 -9.67 21.61 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 118.906 0.775 . . . . 89.98 112.98 177.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' CYS . . . . . . . . . . . . . 16.1 m -82.1 -20.12 38.75 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 113.132 0.79 . . . . 96.8 113.132 171.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 75.9 t -53.65 -30.73 18.88 Favored 'Isoleucine or valine' 0 C--O 1.237 0.424 0 N-CA-C 112.058 0.392 . . . . 79.67 112.058 -170.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 20.1 tp -76.45 -44.79 34.16 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 119.512 -0.875 . . . . 73.19 111.492 -175.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 47.9 m80 -66.04 -29.25 69.56 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 120.282 -0.567 . . . . 79.86 112.068 178.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' VAL . . . . . 0.538 ' HA ' HG13 ' A' ' 132' ' ' VAL . 44.8 t -72.61 -38.4 58.92 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 C-N-CA 120.491 -0.484 . . . . 68.95 110.922 -179.83 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' MET . . . . . . . . . . . . . 12.1 ttp -63.25 -42.88 99.23 Favored 'General case' 0 C--O 1.236 0.357 0 C-N-CA 119.902 -0.719 . . . . 71.08 110.858 175.136 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 4.7 m-80 -50.19 -52.83 32.34 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 120.977 0.417 . . . . 65.65 110.657 173.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -63.47 -41.33 99.32 Favored Glycine 0 C--N 1.336 0.534 0 C-N-CA 120.282 -0.961 . . . . 62.48 112.689 177.846 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -64.41 -39.92 94.78 Favored 'General case' 0 C--O 1.236 0.375 0 O-C-N 122.264 -0.551 . . . . 60.44 111.473 178.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 74.6 t -62.53 -43.53 98.48 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 C-N-CA 120.476 -0.49 . . . . 59.93 110.323 173.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 16.1 ttt -63.04 -31.43 72.57 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 112.095 0.406 . . . . 74.42 112.095 -177.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -107.75 13.87 26.06 Favored 'General case' 0 C--O 1.237 0.431 0 N-CA-C 112.638 0.607 . . . . 63.24 112.638 178.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 51.04 47.16 25.37 Favored 'General case' 0 N--CA 1.463 0.196 0 C-N-CA 123.969 0.908 . . . . 60.78 112.213 171.926 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 39.5 mt -91.79 86.96 2.44 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 N-CA-C 104.595 -2.372 . . . . 64.68 104.595 173.203 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -61.72 -30.04 70.5 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 112.956 0.724 . . . . 68.66 112.956 -168.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -65.85 -41.12 92.07 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 119.7 -0.8 . . . . 66.96 110.784 175.663 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 79.9 t -77.54 -38.46 26.07 Favored 'Isoleucine or valine' 0 C--O 1.237 0.396 0 C-N-CA 120.572 -0.451 . . . . 69.01 110.427 -174.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 53.3 t -55.29 -51.98 50.32 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 CA-C-O 121.142 0.496 . . . . 70.32 110.361 174.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 5.5 ttm180 -59.29 -35.27 73.47 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 122.155 -0.34 . . . . 81.28 111.072 -178.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -76.11 -44.9 36.45 Favored 'General case' 0 C--O 1.237 0.425 0 C-N-CA 120.567 -0.453 . . . . 73.37 111.141 -177.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' CYS . . . . . . . . . . . . . 88.7 m -64.12 -31.49 72.7 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.573 -0.451 . . . . 75.45 111.168 177.688 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -67.68 -45.04 76.33 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 120.958 -0.297 . . . . 76.68 110.832 175.762 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -55.15 -42.07 72.61 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 121.208 -0.197 . . . . 81.13 111.497 176.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' PHE . . . . . . . . . . . . . 86.2 t80 -66.29 -50.39 63.83 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.56 -0.456 . . . . 83.15 111.999 -176.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 25.1 mt -59.0 -41.23 87.19 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.445 -0.502 . . . . 77.65 112.128 -179.085 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 81.1 t -63.66 -38.74 83.06 Favored 'Isoleucine or valine' 0 C--O 1.238 0.449 0 C-N-CA 120.533 -0.467 . . . . 80.19 111.369 178.228 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 41.7 mt-30 -70.07 -19.77 63.26 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 119.016 -1.074 . . . . 88.15 113.415 178.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' GLN . . . . . . . . . . . . . 19.5 mt-30 -78.11 27.47 0.19 Allowed 'General case' 0 C--O 1.235 0.337 0 CA-C-N 118.884 0.765 . . . . 83.44 112.25 173.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 36.0 mt . . . . . 0 C--N 1.329 -0.294 0 CA-C-O 120.751 0.31 . . . . 80.7 110.613 -172.681 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_