data_6w69_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 6w69 _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 . . . . . . . . . . . . . 1.1 p . . . . . 0 N--CA 1.456 -0.155 0 N-CA-C 109.618 -0.512 . . . . 108.25 109.618 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -162.62 122.84 2.38 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 109.276 -0.638 . . . . 111.39 109.276 179.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 42.8 t -125.27 142.46 51.48 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.46 -0.57 . . . . 88.41 109.46 -177.592 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 58.0 t80 -141.19 142.03 34.04 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.103 -0.702 . . . . 61.02 109.103 178.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 19.5 m -141.24 116.65 10.13 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 108.841 -0.8 . . . . 64.25 108.841 179.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 59.4 tp -88.33 105.66 17.72 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 107.695 -1.224 . . . . 62.5 107.695 170.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -61.86 -37.88 86.18 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.55 -0.46 . . . . 93.9 111.469 -177.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -79.05 -1.45 35.75 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 113.273 0.842 . . . . 79.49 113.273 -174.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 65.1 t60 -65.82 -49.69 67.31 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 118.622 0.647 . . . . 65.86 111.772 -171.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 72.2 p -58.76 -32.8 69.61 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.334 -0.546 . . . . 71.36 111.774 -176.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 52.6 mttt -67.41 -43.81 80.33 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.204 -0.598 . . . . 96.35 111.271 175.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -63.38 -51.19 66.87 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.628 -0.429 . . . . 63.32 111.068 -179.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.6 -31.03 71.78 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 120.508 -0.477 . . . . 49.36 111.578 -179.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -64.66 -34.96 79.52 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.249 -0.581 . . . . 49.02 111.291 173.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -66.1 -42.96 94.21 Favored Glycine 0 C--N 1.334 0.436 0 C-N-CA 120.041 -1.076 . . . . 49.04 112.497 176.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 63.3 mt -66.82 -37.57 79.71 Favored 'Isoleucine or valine' 0 C--O 1.238 0.473 0 O-C-N 122.241 -0.564 . . . . 46.62 110.43 177.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 65.5 mtm -60.64 -38.84 86.14 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.166 -0.614 . . . . 47.9 111.04 175.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -68.1 -32.95 73.62 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 120.157 -0.617 . . . . 45.26 111.504 176.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -67.03 -43.1 83.63 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.42 -0.512 . . . . 64.08 111.18 177.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 15.0 mt -62.38 -31.89 72.61 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.691 -0.404 . . . . 52.0 111.594 178.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ARG . . . . . 0.417 ' NH1' ' O ' ' A' ' 202' ' ' HOH . 64.6 ttp85 -67.89 -47.98 67.32 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.479 -0.488 . . . . 48.34 110.939 176.381 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 73.8 mt -62.31 -36.71 83.01 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.668 -0.413 . . . . 43.83 111.124 179.532 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 22.7 m -77.2 -3.91 42.0 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 112.665 0.617 . . . . 49.62 112.665 174.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 83.7 mt-30 56.2 43.49 26.56 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.457 0.646 . . . . 52.4 111.349 -179.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -109.01 137.94 46.14 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 123.194 0.598 . . . . 66.77 109.745 177.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 56.7 mt 65.81 16.11 10.34 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.674 1.19 . . . . 44.58 113.042 177.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 97.8 m -78.78 141.96 37.37 Favored 'General case' 0 C--O 1.234 0.283 0 O-C-N 121.89 -0.506 . . . . 43.05 110.737 -179.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 26.8 p-10 -126.68 6.53 6.79 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 113.058 0.762 . . . . 42.67 113.058 -178.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 11.4 p -146.36 140.91 21.02 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 N-CA-C 108.673 -0.862 . . . . 45.19 108.673 177.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 99.2 m -120.39 120.28 35.5 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 108.396 -0.964 . . . . 51.22 108.396 175.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 29.2 mt -92.0 110.89 22.26 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 108.598 -0.89 . . . . 50.31 108.598 178.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' GLN . . . . . . . . . . . . . 93.4 mt-30 -97.34 109.66 22.37 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 108.013 -1.106 . . . . 74.94 108.013 177.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 82.1 t -104.8 118.13 51.62 Favored 'Isoleucine or valine' 0 C--O 1.238 0.463 0 N-CA-C 108.511 -0.922 . . . . 53.41 108.511 -171.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 26.6 tptp -123.77 113.12 18.15 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 107.706 -1.22 . . . . 72.4 107.706 177.07 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -127.99 110.98 13.04 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 109.665 -0.494 . . . . 86.69 109.665 -173.317 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 55.75 -127.89 2.08 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 124.16 0.984 . . . . 85.31 108.574 172.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 20.9 p30 -97.89 -0.33 45.2 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 119.5 1.045 . . . . 86.04 112.857 178.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.01 151.07 97.54 Favored Pre-proline 0 N--CA 1.452 -0.355 0 CA-C-N 118.168 0.44 . . . . 75.78 110.266 178.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -65.98 145.9 81.03 Favored 'Trans proline' 0 C--O 1.234 0.325 0 CA-C-O 121.727 0.636 . . . . 53.39 111.743 -179.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -67.61 153.33 43.93 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.056 -0.975 . . . . 56.78 110.845 -179.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -141.4 146.31 36.43 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.626 -0.715 . . . . 50.93 109.652 -179.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLN . . . . . . . . . . . . . 67.1 mt-30 -112.89 138.97 48.94 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.369 -0.832 . . . . 77.0 109.957 177.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -133.57 115.95 15.33 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 108.408 -0.96 . . . . 49.61 108.408 174.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 71.0 mtp -87.33 143.09 27.42 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.346 -0.612 . . . . 64.58 109.346 173.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -156.28 -177.66 6.75 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.874 -0.787 . . . . 43.92 108.874 -176.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 36.9 m80 -108.14 125.6 51.8 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 108.374 -0.973 . . . . 39.08 108.374 177.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LYS . . . . . 0.429 ' NZ ' ' OE1' ' A' ' 121' ' ' GLU . 98.7 mttt -58.31 -37.52 75.25 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.539 -0.464 . . . . 51.96 111.558 -176.696 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 14.7 p -69.31 -31.11 48.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 C-N-CA 119.993 -0.683 . . . . 45.77 110.957 -176.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 85.8 t -74.31 -45.71 46.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 O-C-N 121.673 -0.642 . . . . 44.94 110.368 177.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 43.9 mt -63.31 -35.21 79.6 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.346 -0.541 . . . . 51.88 111.161 178.035 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -70.52 -26.65 63.67 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.686 -0.406 . . . . 41.32 111.877 -179.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 81.5 p -77.95 -11.17 59.88 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 113.095 0.776 . . . . 63.69 113.095 -177.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 9.4 m -120.66 -9.12 9.42 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 113.365 0.876 . . . . 53.87 113.365 179.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 3.2 t -138.95 109.64 7.75 Favored Pre-proline 0 C--O 1.238 0.469 0 CA-C-N 118.513 0.597 . . . . 49.43 110.313 -177.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -59.92 -26.36 82.12 Favored 'Trans proline' 0 C--O 1.237 0.461 0 CA-C-N 118.519 0.507 . . . . 43.76 113.248 175.031 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 48.3 t -66.45 -44.77 90.35 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 C-N-CA 120.47 -0.492 . . . . 43.15 110.367 174.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -67.23 -33.76 76.02 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.304 -0.558 . . . . 44.87 111.604 175.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -64.77 -49.36 71.05 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.529 -0.468 . . . . 57.4 111.173 -179.045 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -65.7 -33.93 77.03 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.363 -0.535 . . . . 56.26 111.165 177.361 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 27.6 ttm -64.52 -31.52 72.76 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 111.878 0.325 . . . . 58.32 111.878 179.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -102.01 -23.62 14.08 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 113.828 1.047 . . . . 54.14 113.828 -173.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 75.7 p -90.66 88.51 7.13 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 107.85 -1.167 . . . . 73.28 107.85 177.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -108.05 -0.45 21.21 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 113.257 0.836 . . . . 119.65 113.257 -178.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 70.43 13.34 70.8 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.206 -0.997 . . . . 121.58 114.683 -174.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -113.31 140.54 47.92 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 118.152 0.976 . . . . 122.12 109.413 178.006 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.1 mmt-85 -78.67 107.31 11.26 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 108.886 -0.783 . . . . 119.52 108.886 176.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.03 157.05 38.12 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 121.852 0.834 . . . . 114.19 110.242 176.381 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -117.69 37.58 3.89 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.504 -0.771 . . . . 121.74 111.518 -178.563 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 123.19 -133.19 8.89 Favored Glycine 0 CA--C 1.525 0.661 0 CA-C-O 121.326 0.404 . . . . 109.45 112.277 171.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 53.4 tpp -73.42 119.19 17.31 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.248 -0.476 . . . . 75.73 110.693 -170.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' GLU . . . . . 0.429 ' OE1' ' NZ ' ' A' ' 97' ' ' LYS . 66.1 tt0 -101.8 137.32 40.26 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.581 -0.526 . . . . 71.21 109.581 172.829 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 68.0 t -101.86 131.23 50.23 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 108.399 -0.963 . . . . 62.32 108.399 177.407 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 54.2 t -122.24 122.19 65.78 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 N-CA-C 108.067 -1.086 . . . . 59.47 108.067 179.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 29.7 m -85.54 123.91 31.5 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 108.626 -0.879 . . . . 79.22 108.626 174.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 9.2 mt -114.93 130.47 69.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 N-CA-C 108.658 -0.867 . . . . 59.95 108.658 -176.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -119.77 158.05 27.35 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.461 0.648 . . . . 86.24 110.439 -173.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 66.56 28.71 73.89 Favored Glycine 0 C--N 1.331 0.28 0 N-CA-C 115.498 0.959 . . . . 57.07 115.498 169.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ILE . . . . . . . . . . . . . 10.3 tt -152.78 136.85 8.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 108.132 -1.062 . . . . 61.41 108.132 172.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 -68.01 145.79 97.91 Favored Pre-proline 0 C--O 1.236 0.387 0 CA-C-N 116.121 -0.49 . . . . 66.94 110.271 -175.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -58.45 -35.11 99.07 Favored 'Trans proline' 0 C--O 1.237 0.475 0 N-CA-C 114.117 0.776 . . . . 54.59 114.117 -179.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -68.79 -28.48 66.81 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 119.399 -0.92 . . . . 101.34 111.644 179.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 69.0 t -76.09 -40.89 37.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 C-N-CA 120.774 -0.371 . . . . 52.26 110.854 178.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' MET . . . . . . . . . . . . . 44.5 tpp -61.83 -38.44 88.16 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.489 -0.485 . . . . 61.77 110.865 174.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -62.16 -42.45 99.28 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.682 -0.407 . . . . 66.29 111.217 177.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 84.2 mtt180 -67.79 -33.84 75.6 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.46 -0.496 . . . . 113.2 111.691 -179.78 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 64.6 mt -68.55 -43.23 77.1 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 119.941 -0.704 . . . . 47.38 111.245 175.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' ILE . . . . . . . . . . . . . 72.5 mt -59.0 -40.15 79.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 CA-C-O 120.963 0.411 . . . . 50.37 110.324 176.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.67 -39.15 90.37 Favored 'General case' 0 C--O 1.237 0.407 0 O-C-N 122.098 -0.376 . . . . 70.68 111.34 178.414 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 92.2 t80 -67.9 -38.36 82.86 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.079 -0.648 . . . . 50.37 111.461 -179.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -61.8 -33.9 74.95 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.197 -0.601 . . . . 58.34 111.238 179.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -89.14 -38.22 14.47 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 112.856 0.687 . . . . 48.79 112.856 -177.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 29.4 p -109.97 -15.09 14.14 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 114.514 1.302 . . . . 50.93 114.514 -171.017 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . 67.91 16.83 9.64 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 124.808 1.243 . . . . 51.01 112.749 -175.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 68.8 m -129.47 145.54 51.42 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 109.169 -0.678 . . . . 55.55 109.169 174.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 20.3 tt -143.29 138.35 26.41 Favored 'Isoleucine or valine' 0 C--O 1.235 0.324 0 N-CA-C 108.434 -0.95 . . . . 61.75 108.434 178.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -133.2 151.1 51.95 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 109.391 -0.596 . . . . 85.88 109.391 -176.792 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 3.9 ptt? -168.89 149.03 4.32 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.755 -0.657 . . . . 82.21 109.461 -172.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -70.46 155.78 53.11 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.175 -1.012 . . . . 73.75 111.218 168.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -60.32 -26.39 66.52 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.361 -0.535 . . . . 95.36 112.037 -174.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -87.12 6.15 34.2 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 112.674 0.62 . . . . 105.11 112.674 179.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' CYS . . . . . . . . . . . . . 5.6 m -112.97 -10.15 13.54 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 113.258 0.836 . . . . 96.46 113.258 173.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 71.6 t -56.16 -33.99 38.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 CA-C-N 118.275 0.488 . . . . 61.0 111.278 -177.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 18.9 tp -68.97 -42.26 76.81 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.192 -0.603 . . . . 65.49 111.368 179.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 10.9 m80 -70.99 -34.91 71.84 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.488 -0.485 . . . . 88.5 111.713 -178.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 53.7 t -65.25 -38.76 83.42 Favored 'Isoleucine or valine' 0 C--O 1.238 0.481 0 CA-C-O 120.985 0.421 . . . . 60.07 110.301 177.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' MET . . . . . . . . . . . . . 27.5 ttt -62.39 -41.64 98.81 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 120.546 -0.462 . . . . 66.7 111.072 176.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -58.49 -46.71 86.11 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 120.82 0.343 . . . . 65.44 111.216 178.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -67.1 -33.16 82.51 Favored Glycine 0 C--N 1.335 0.512 0 C-N-CA 119.993 -1.099 . . . . 43.89 112.984 176.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -72.55 -39.04 67.8 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 117.298 0.549 . . . . 51.1 111.344 179.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 70.6 t -62.95 -40.34 88.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.467 0 C-N-CA 120.426 -0.509 . . . . 48.46 110.13 173.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 35.8 ttm -62.9 -33.98 76.45 Favored 'General case' 0 C--O 1.236 0.354 0 O-C-N 122.056 -0.403 . . . . 90.76 111.867 -177.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' TYR . . . . . . . . . . . . . 90.9 m-85 -108.89 12.15 25.64 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 112.592 0.59 . . . . 49.99 112.592 -179.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 55.8 44.69 25.65 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.95 0.881 . . . . 76.48 111.653 170.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 15.6 mt -92.37 85.23 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 N-CA-C 105.523 -2.029 . . . . 53.54 105.523 173.102 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -56.9 -37.68 71.75 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 115.258 -0.883 . . . . 74.02 112.227 -169.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 3.9 m -58.58 -46.47 86.89 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 111.688 0.255 . . . . 64.44 111.688 -171.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 1.6 m -87.57 -21.63 7.1 Favored 'Isoleucine or valine' 0 C--O 1.24 0.566 0 C-N-CA 120.584 -0.446 . . . . 53.9 112.15 -177.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 22.8 t -56.08 -48.16 79.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 CA-C-O 121.321 0.581 . . . . 60.03 109.901 167.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 20.4 ttm-85 -65.8 -38.69 89.68 Favored 'General case' 0 C--O 1.236 0.381 0 O-C-N 122.173 -0.33 . . . . 75.09 111.203 179.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -68.27 -45.18 73.83 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.638 -0.425 . . . . 59.57 111.266 -179.542 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' CYS . . . . . . . . . . . . . 99.7 m -66.09 -33.99 77.04 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.269 -0.572 . . . . 58.39 111.538 176.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -65.55 -39.97 92.3 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.187 -0.605 . . . . 57.4 111.029 174.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -66.55 -41.25 88.94 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.314 -0.555 . . . . 86.69 111.48 -179.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' PHE . . . . . . . . . . . . . 84.8 t80 -66.08 -40.92 91.22 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.349 -0.54 . . . . 75.33 111.512 -178.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 19.7 mt -66.97 -28.28 68.14 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.532 -0.467 . . . . 58.99 112.028 -179.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 50.9 t -75.1 -39.43 43.62 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 C-N-CA 120.279 -0.568 . . . . 63.13 110.812 -176.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -84.46 2.62 40.05 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 112.928 0.714 . . . . 100.58 112.928 178.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -74.07 0.98 12.07 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 118.275 0.489 . . . . 92.45 112.237 162.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 12.0 mt . . . . . 0 C--N 1.329 -0.319 0 CA-C-O 120.899 0.38 . . . . 81.67 111.052 -174.21 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . 0.417 ' O ' ' NH1' ' A' ' 71' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.1 p . . . . . 0 N--CA 1.456 -0.155 0 N-CA-C 109.618 -0.512 . . . . 108.25 109.618 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -162.62 122.84 2.38 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 109.276 -0.638 . . . . 111.39 109.276 179.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 42.8 t -125.27 142.46 51.48 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.46 -0.57 . . . . 88.41 109.46 -177.592 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 58.0 t80 -141.19 142.03 34.04 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.103 -0.702 . . . . 61.02 109.103 178.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 19.5 m -141.24 116.65 10.13 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 108.841 -0.8 . . . . 64.25 108.841 179.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LEU . . . . . 0.437 HD23 ' HB2' ' A' ' 59' ' ' HIS . 59.4 tp -88.33 105.66 17.72 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 107.695 -1.224 . . . . 62.5 107.695 170.019 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -61.86 -37.88 86.18 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.55 -0.46 . . . . 93.9 111.469 -177.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -79.05 -1.45 35.75 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 113.273 0.842 . . . . 79.49 113.273 -174.642 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' HIS . . . . . 0.437 ' HB2' HD23 ' A' ' 56' ' ' LEU . 65.1 t60 -65.82 -49.69 67.31 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 118.622 0.647 . . . . 65.86 111.772 -171.194 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 72.2 p -58.76 -32.8 69.61 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.334 -0.546 . . . . 71.36 111.774 -176.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 52.6 mttt -67.41 -43.81 80.33 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.204 -0.598 . . . . 96.35 111.271 175.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -63.38 -51.19 66.87 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.628 -0.429 . . . . 63.32 111.068 -179.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.6 -31.03 71.78 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 120.508 -0.477 . . . . 49.36 111.578 -179.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -64.66 -34.96 79.52 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.249 -0.581 . . . . 49.02 111.291 173.152 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -66.1 -42.96 94.21 Favored Glycine 0 C--N 1.334 0.436 0 C-N-CA 120.041 -1.076 . . . . 49.04 112.497 176.588 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 63.3 mt -66.82 -37.57 79.71 Favored 'Isoleucine or valine' 0 C--O 1.238 0.473 0 O-C-N 122.241 -0.564 . . . . 46.62 110.43 177.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 65.5 mtm -60.64 -38.84 86.14 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.166 -0.614 . . . . 47.9 111.04 175.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -68.1 -32.95 73.62 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 120.157 -0.617 . . . . 45.26 111.504 176.586 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -67.03 -43.1 83.63 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.42 -0.512 . . . . 64.08 111.18 177.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 15.0 mt -62.38 -31.89 72.61 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.691 -0.404 . . . . 52.0 111.594 178.299 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 64.6 ttp85 -67.89 -47.98 67.32 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.479 -0.488 . . . . 48.34 110.939 176.381 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 73.8 mt -62.31 -36.71 83.01 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.668 -0.413 . . . . 43.83 111.124 179.532 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 22.7 m -77.2 -3.91 42.0 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 112.665 0.617 . . . . 49.62 112.665 174.119 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 83.7 mt-30 56.2 43.49 26.56 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.457 0.646 . . . . 52.4 111.349 -179.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -109.01 137.94 46.14 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 123.194 0.598 . . . . 66.77 109.745 177.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 56.7 mt 65.81 16.11 10.34 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.674 1.19 . . . . 44.58 113.042 177.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 97.8 m -78.78 141.96 37.37 Favored 'General case' 0 C--O 1.234 0.283 0 O-C-N 121.89 -0.506 . . . . 43.05 110.737 -179.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 26.8 p-10 -126.68 6.53 6.79 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 113.058 0.762 . . . . 42.67 113.058 -178.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 11.4 p -146.36 140.91 21.02 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 N-CA-C 108.673 -0.862 . . . . 45.19 108.673 177.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 99.2 m -120.39 120.28 35.5 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 108.396 -0.964 . . . . 51.22 108.396 175.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' LEU . . . . . 0.501 HD12 HD11 ' A' ' 137' ' ' ILE . 29.2 mt -92.0 110.89 22.26 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 108.598 -0.89 . . . . 50.31 108.598 178.765 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' GLN . . . . . 0.482 ' HG2' ' HG2' ' A' ' 92' ' ' GLN . 27.1 mt-30 -97.34 109.66 22.37 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 108.013 -1.106 . . . . 74.94 108.013 177.369 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 82.1 t -104.8 118.13 51.62 Favored 'Isoleucine or valine' 0 C--O 1.238 0.463 0 N-CA-C 108.511 -0.922 . . . . 53.41 108.511 -171.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LYS . . . . . 0.477 ' HD3' ' HB2' ' A' ' 90' ' ' ALA . 26.6 tptp -123.77 113.12 18.15 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 107.706 -1.22 . . . . 72.4 107.706 177.07 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -127.99 110.98 13.04 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 109.665 -0.494 . . . . 86.69 109.665 -173.317 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 55.75 -127.89 2.08 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 124.16 0.984 . . . . 85.31 108.574 172.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 20.9 p30 -97.89 -0.33 45.2 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 119.5 1.045 . . . . 86.04 112.857 178.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.01 151.07 97.54 Favored Pre-proline 0 N--CA 1.452 -0.355 0 CA-C-N 118.168 0.44 . . . . 75.78 110.266 178.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -65.98 145.9 81.03 Favored 'Trans proline' 0 C--O 1.234 0.325 0 CA-C-O 121.727 0.636 . . . . 53.39 111.743 -179.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ALA . . . . . 0.477 ' HB2' ' HD3' ' A' ' 84' ' ' LYS . . . -67.61 153.33 43.93 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.056 -0.975 . . . . 56.78 110.845 -179.279 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ALA . . . . . 0.443 ' HB3' ' HB3' ' A' ' 130' ' ' PRO . . . -141.4 146.31 36.43 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.626 -0.715 . . . . 50.93 109.652 -179.949 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLN . . . . . 0.482 ' HG2' ' HG2' ' A' ' 82' ' ' GLN . 67.1 mt-30 -112.89 138.97 48.94 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.369 -0.832 . . . . 77.0 109.957 177.98 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -133.57 115.95 15.33 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 108.408 -0.96 . . . . 49.61 108.408 174.396 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 71.0 mtp -87.33 143.09 27.42 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.346 -0.612 . . . . 64.58 109.346 173.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -156.28 -177.66 6.75 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.874 -0.787 . . . . 43.92 108.874 -176.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 36.9 m80 -108.14 125.6 51.8 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 108.374 -0.973 . . . . 39.08 108.374 177.973 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -58.31 -37.52 75.25 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.539 -0.464 . . . . 51.96 111.558 -176.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 14.7 p -69.31 -31.11 48.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 C-N-CA 119.993 -0.683 . . . . 45.77 110.957 -176.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 85.8 t -74.31 -45.71 46.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 O-C-N 121.673 -0.642 . . . . 44.94 110.368 177.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 43.9 mt -63.31 -35.21 79.6 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.346 -0.541 . . . . 51.88 111.161 178.035 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -70.52 -26.65 63.67 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.686 -0.406 . . . . 41.32 111.877 -179.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 81.5 p -77.95 -11.17 59.88 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 113.095 0.776 . . . . 63.69 113.095 -177.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 9.4 m -120.66 -9.12 9.42 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 113.365 0.876 . . . . 53.87 113.365 179.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 3.2 t -138.95 109.64 7.75 Favored Pre-proline 0 C--O 1.238 0.469 0 CA-C-N 118.513 0.597 . . . . 49.43 110.313 -177.051 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -59.92 -26.36 82.12 Favored 'Trans proline' 0 C--O 1.237 0.461 0 CA-C-N 118.519 0.507 . . . . 43.76 113.248 175.031 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 48.3 t -66.45 -44.77 90.35 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 C-N-CA 120.47 -0.492 . . . . 43.15 110.367 174.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -67.23 -33.76 76.02 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.304 -0.558 . . . . 44.87 111.604 175.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -64.77 -49.36 71.05 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.529 -0.468 . . . . 57.4 111.173 -179.045 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -65.7 -33.93 77.03 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.363 -0.535 . . . . 56.26 111.165 177.361 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 27.6 ttm -64.52 -31.52 72.76 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 111.878 0.325 . . . . 58.32 111.878 179.062 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -102.01 -23.62 14.08 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 113.828 1.047 . . . . 54.14 113.828 -173.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 75.7 p -90.66 88.51 7.13 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 107.85 -1.167 . . . . 73.28 107.85 177.026 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -108.05 -0.45 21.21 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 113.257 0.836 . . . . 119.65 113.257 -178.444 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 70.43 13.34 70.8 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.206 -0.997 . . . . 121.58 114.683 -174.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -113.31 140.54 47.92 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 118.152 0.976 . . . . 122.12 109.413 178.006 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.1 mmt-85 -78.67 107.31 11.26 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 108.886 -0.783 . . . . 119.52 108.886 176.467 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.03 157.05 38.12 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 121.852 0.834 . . . . 114.19 110.242 176.381 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -117.69 37.58 3.89 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.504 -0.771 . . . . 121.74 111.518 -178.563 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 123.19 -133.19 8.89 Favored Glycine 0 CA--C 1.525 0.661 0 CA-C-O 121.326 0.404 . . . . 109.45 112.277 171.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 53.4 tpp -73.42 119.19 17.31 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.248 -0.476 . . . . 75.73 110.693 -170.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 66.1 tt0 -101.8 137.32 40.26 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.581 -0.526 . . . . 71.21 109.581 172.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 68.0 t -101.86 131.23 50.23 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 108.399 -0.963 . . . . 62.32 108.399 177.407 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 54.2 t -122.24 122.19 65.78 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 N-CA-C 108.067 -1.086 . . . . 59.47 108.067 179.584 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 29.7 m -85.54 123.91 31.5 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 108.626 -0.879 . . . . 79.22 108.626 174.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 9.2 mt -114.93 130.47 69.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 N-CA-C 108.658 -0.867 . . . . 59.95 108.658 -176.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -119.77 158.05 27.35 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.461 0.648 . . . . 86.24 110.439 -173.108 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 66.56 28.71 73.89 Favored Glycine 0 C--N 1.331 0.28 0 N-CA-C 115.498 0.959 . . . . 57.07 115.498 169.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ILE . . . . . 0.471 HD13 ' HE1' ' A' ' 133' ' ' MET . 10.3 tt -152.78 136.85 8.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 108.132 -1.062 . . . . 61.41 108.132 172.362 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 -68.01 145.79 97.91 Favored Pre-proline 0 C--O 1.236 0.387 0 CA-C-N 116.121 -0.49 . . . . 66.94 110.271 -175.474 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' PRO . . . . . 0.443 ' HB3' ' HB3' ' A' ' 91' ' ' ALA . 82.7 Cg_exo -58.45 -35.11 99.07 Favored 'Trans proline' 0 C--O 1.237 0.475 0 N-CA-C 114.117 0.776 . . . . 54.59 114.117 -179.495 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -68.79 -28.48 66.81 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 119.399 -0.92 . . . . 101.34 111.644 179.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 69.0 t -76.09 -40.89 37.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 C-N-CA 120.774 -0.371 . . . . 52.26 110.854 178.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' MET . . . . . 0.471 ' HE1' HD13 ' A' ' 128' ' ' ILE . 44.5 tpp -61.83 -38.44 88.16 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.489 -0.485 . . . . 61.77 110.865 174.747 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -62.16 -42.45 99.28 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.682 -0.407 . . . . 66.29 111.217 177.801 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 84.2 mtt180 -67.79 -33.84 75.6 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.46 -0.496 . . . . 113.2 111.691 -179.78 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 64.6 mt -68.55 -43.23 77.1 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 119.941 -0.704 . . . . 47.38 111.245 175.187 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' ILE . . . . . 0.501 HD11 HD12 ' A' ' 81' ' ' LEU . 72.5 mt -59.0 -40.15 79.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 CA-C-O 120.963 0.411 . . . . 50.37 110.324 176.197 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.67 -39.15 90.37 Favored 'General case' 0 C--O 1.237 0.407 0 O-C-N 122.098 -0.376 . . . . 70.68 111.34 178.414 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 92.2 t80 -67.9 -38.36 82.86 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.079 -0.648 . . . . 50.37 111.461 -179.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -61.8 -33.9 74.95 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.197 -0.601 . . . . 58.34 111.238 179.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -89.14 -38.22 14.47 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 112.856 0.687 . . . . 48.79 112.856 -177.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 29.4 p -109.97 -15.09 14.14 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 114.514 1.302 . . . . 50.93 114.514 -171.017 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . 67.91 16.83 9.64 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 124.808 1.243 . . . . 51.01 112.749 -175.564 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 68.8 m -129.47 145.54 51.42 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 109.169 -0.678 . . . . 55.55 109.169 174.749 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 20.3 tt -143.29 138.35 26.41 Favored 'Isoleucine or valine' 0 C--O 1.235 0.324 0 N-CA-C 108.434 -0.95 . . . . 61.75 108.434 178.756 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -133.2 151.1 51.95 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 109.391 -0.596 . . . . 85.88 109.391 -176.792 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 3.9 ptt? -168.89 149.03 4.32 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.755 -0.657 . . . . 82.21 109.461 -172.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -70.46 155.78 53.11 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.175 -1.012 . . . . 73.75 111.218 168.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -60.32 -26.39 66.52 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.361 -0.535 . . . . 95.36 112.037 -174.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -87.12 6.15 34.2 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 112.674 0.62 . . . . 105.11 112.674 179.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' CYS . . . . . . . . . . . . . 5.6 m -112.97 -10.15 13.54 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 113.258 0.836 . . . . 96.46 113.258 173.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' VAL . . . . . 0.448 HG11 ' HD2' ' A' ' 174' ' ' PHE . 71.6 t -56.16 -33.99 38.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 CA-C-N 118.275 0.488 . . . . 61.0 111.278 -177.57 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 18.9 tp -68.97 -42.26 76.81 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.192 -0.603 . . . . 65.49 111.368 179.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 10.9 m80 -70.99 -34.91 71.84 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.488 -0.485 . . . . 88.5 111.713 -178.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 53.7 t -65.25 -38.76 83.42 Favored 'Isoleucine or valine' 0 C--O 1.238 0.481 0 CA-C-O 120.985 0.421 . . . . 60.07 110.301 177.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' MET . . . . . . . . . . . . . 27.5 ttt -62.39 -41.64 98.81 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 120.546 -0.462 . . . . 66.7 111.072 176.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -58.49 -46.71 86.11 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 120.82 0.343 . . . . 65.44 111.216 178.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -67.1 -33.16 82.51 Favored Glycine 0 C--N 1.335 0.512 0 C-N-CA 119.993 -1.099 . . . . 43.89 112.984 176.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -72.55 -39.04 67.8 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 117.298 0.549 . . . . 51.1 111.344 179.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 70.6 t -62.95 -40.34 88.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.467 0 C-N-CA 120.426 -0.509 . . . . 48.46 110.13 173.129 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 35.8 ttm -62.9 -33.98 76.45 Favored 'General case' 0 C--O 1.236 0.354 0 O-C-N 122.056 -0.403 . . . . 90.76 111.867 -177.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 162' ' ' TYR . . . . . . . . . . . . . 90.9 m-85 -108.89 12.15 25.64 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 112.592 0.59 . . . . 49.99 112.592 -179.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 163' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 55.8 44.69 25.65 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.95 0.881 . . . . 76.48 111.653 170.582 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 15.6 mt -92.37 85.23 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 N-CA-C 105.523 -2.029 . . . . 53.54 105.523 173.102 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -56.9 -37.68 71.75 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 115.258 -0.883 . . . . 74.02 112.227 -169.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 3.9 m -58.58 -46.47 86.89 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 111.688 0.255 . . . . 64.44 111.688 -171.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 1.6 m -87.57 -21.63 7.1 Favored 'Isoleucine or valine' 0 C--O 1.24 0.566 0 C-N-CA 120.584 -0.446 . . . . 53.9 112.15 -177.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 22.8 t -56.08 -48.16 79.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 CA-C-O 121.321 0.581 . . . . 60.03 109.901 167.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 20.4 ttm-85 -65.8 -38.69 89.68 Favored 'General case' 0 C--O 1.236 0.381 0 O-C-N 122.173 -0.33 . . . . 75.09 111.203 179.214 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -68.27 -45.18 73.83 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.638 -0.425 . . . . 59.57 111.266 -179.542 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 171' ' ' CYS . . . . . . . . . . . . . 99.7 m -66.09 -33.99 77.04 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.269 -0.572 . . . . 58.39 111.538 176.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -65.55 -39.97 92.3 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.187 -0.605 . . . . 57.4 111.029 174.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -66.55 -41.25 88.94 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.314 -0.555 . . . . 86.69 111.48 -179.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 174' ' ' PHE . . . . . 0.448 ' HD2' HG11 ' A' ' 152' ' ' VAL . 84.8 t80 -66.08 -40.92 91.22 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.349 -0.54 . . . . 75.33 111.512 -178.396 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 19.7 mt -66.97 -28.28 68.14 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.532 -0.467 . . . . 58.99 112.028 -179.058 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 50.9 t -75.1 -39.43 43.62 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 C-N-CA 120.279 -0.568 . . . . 63.13 110.812 -176.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -84.46 2.62 40.05 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 112.928 0.714 . . . . 100.58 112.928 178.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 178' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -74.07 0.98 12.07 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 118.275 0.489 . . . . 92.45 112.237 162.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 12.0 mt . . . . . 0 C--N 1.329 -0.319 0 CA-C-O 120.899 0.38 . . . . 81.67 111.052 -174.21 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.1 p . . . . . 0 N--CA 1.456 -0.155 0 N-CA-C 109.618 -0.512 . . . . 108.25 109.618 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 65.2 t80 -162.62 122.84 2.38 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 109.276 -0.638 . . . . 111.39 109.276 179.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 42.8 t -125.27 142.46 51.48 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.46 -0.57 . . . . 88.41 109.46 -177.592 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 58.0 t80 -141.19 142.03 34.04 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 109.103 -0.702 . . . . 61.02 109.103 178.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' THR . . . . . . . . . . . . . 19.5 m -141.24 116.65 10.13 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 108.841 -0.8 . . . . 64.25 108.841 179.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.437 HD23 ' HB2' ' A' ' 59' ' ' HIS . 59.4 tp -88.33 105.66 17.72 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 107.695 -1.224 . . . . 62.5 107.695 170.019 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -61.86 -37.88 86.18 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 120.55 -0.46 . . . . 93.9 111.469 -177.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 14.7 t70 -79.05 -1.45 35.75 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 113.273 0.842 . . . . 79.49 113.273 -174.642 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.437 ' HB2' HD23 ' A' ' 56' ' ' LEU . 65.1 t60 -65.82 -49.69 67.31 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 118.622 0.647 . . . . 65.86 111.772 -171.194 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' THR . . . . . . . . . . . . . 72.2 p -58.76 -32.8 69.61 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.334 -0.546 . . . . 71.36 111.774 -176.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 52.6 mttt -67.41 -43.81 80.33 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.204 -0.598 . . . . 96.35 111.271 175.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 77.9 mt-30 -63.38 -51.19 66.87 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.628 -0.429 . . . . 63.32 111.068 -179.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.6 -31.03 71.78 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 120.508 -0.477 . . . . 49.36 111.578 -179.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -64.66 -34.96 79.52 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.249 -0.581 . . . . 49.02 111.291 173.152 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -66.1 -42.96 94.21 Favored Glycine 0 C--N 1.334 0.436 0 C-N-CA 120.041 -1.076 . . . . 49.04 112.497 176.588 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ILE . . . . . . . . . . . . . 63.3 mt -66.82 -37.57 79.71 Favored 'Isoleucine or valine' 0 C--O 1.238 0.473 0 O-C-N 122.241 -0.564 . . . . 46.62 110.43 177.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' MET . . . . . . . . . . . . . 65.5 mtm -60.64 -38.84 86.14 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.166 -0.614 . . . . 47.9 111.04 175.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ASN . . . . . . . . . . . . . 64.8 t30 -68.1 -32.95 73.62 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 120.157 -0.617 . . . . 45.26 111.504 176.586 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 94.6 mt-10 -67.03 -43.1 83.63 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.42 -0.512 . . . . 64.08 111.18 177.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 15.0 mt -62.38 -31.89 72.61 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.691 -0.404 . . . . 52.0 111.594 178.299 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 64.6 ttp85 -67.89 -47.98 67.32 Favored 'General case' 0 C--O 1.237 0.4 0 C-N-CA 120.479 -0.488 . . . . 48.34 110.939 176.381 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 73.8 mt -62.31 -36.71 83.01 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.668 -0.413 . . . . 43.83 111.124 179.532 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 22.7 m -77.2 -3.91 42.0 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 112.665 0.617 . . . . 49.62 112.665 174.119 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' GLN . . . . . . . . . . . . . 83.7 mt-30 56.2 43.49 26.56 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-O 121.457 0.646 . . . . 52.4 111.349 -179.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLN . . . . . . . . . . . . . 85.7 mt-30 -109.01 137.94 46.14 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 123.194 0.598 . . . . 66.77 109.745 177.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 56.7 mt 65.81 16.11 10.34 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.674 1.19 . . . . 44.58 113.042 177.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 97.8 m -78.78 141.96 37.37 Favored 'General case' 0 C--O 1.234 0.283 0 O-C-N 121.89 -0.506 . . . . 43.05 110.737 -179.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 26.8 p-10 -126.68 6.53 6.79 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 113.058 0.762 . . . . 42.67 113.058 -178.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 11.4 p -146.36 140.91 21.02 Favored 'Isoleucine or valine' 0 C--O 1.235 0.319 0 N-CA-C 108.673 -0.862 . . . . 45.19 108.673 177.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' THR . . . . . . . . . . . . . 99.2 m -120.39 120.28 35.5 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 108.396 -0.964 . . . . 51.22 108.396 175.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.501 HD12 HD11 ' A' ' 137' ' ' ILE . 29.2 mt -92.0 110.89 22.26 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 108.598 -0.89 . . . . 50.31 108.598 178.765 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' GLN . . . . . 0.482 ' HG2' ' HG2' ' A' ' 92' ' ' GLN . 93.4 mt-30 -97.34 109.66 22.37 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 108.013 -1.106 . . . . 74.94 108.013 177.369 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 82.1 t -104.8 118.13 51.62 Favored 'Isoleucine or valine' 0 C--O 1.238 0.463 0 N-CA-C 108.511 -0.922 . . . . 53.41 108.511 -171.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.477 ' HD3' ' HB2' ' A' ' 90' ' ' ALA . 26.6 tptp -123.77 113.12 18.15 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 107.706 -1.22 . . . . 72.4 107.706 177.07 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' TYR . . . . . . . . . . . . . 74.0 t80 -127.99 110.98 13.04 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 109.665 -0.494 . . . . 86.69 109.665 -173.317 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' GLN . . . . . . . . . . . . . 1.4 mt-30 55.75 -127.89 2.08 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 124.16 0.984 . . . . 85.31 108.574 172.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 20.9 p30 -97.89 -0.33 45.2 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 119.5 1.045 . . . . 86.04 112.857 178.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ALA . . . . . . . . . . . . . . . -67.01 151.07 97.54 Favored Pre-proline 0 N--CA 1.452 -0.355 0 CA-C-N 118.168 0.44 . . . . 75.78 110.266 178.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 39.0 Cg_endo -65.98 145.9 81.03 Favored 'Trans proline' 0 C--O 1.234 0.325 0 CA-C-O 121.727 0.636 . . . . 53.39 111.743 -179.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ALA . . . . . 0.477 ' HB2' ' HD3' ' A' ' 84' ' ' LYS . . . -67.61 153.33 43.93 Favored 'General case' 0 C--O 1.234 0.263 0 CA-C-N 115.056 -0.975 . . . . 56.78 110.845 -179.279 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ALA . . . . . 0.443 ' HB3' ' HB3' ' A' ' 130' ' ' PRO . . . -141.4 146.31 36.43 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-N 115.626 -0.715 . . . . 50.93 109.652 -179.949 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.482 ' HG2' ' HG2' ' A' ' 82' ' ' GLN . 67.1 mt-30 -112.89 138.97 48.94 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 115.369 -0.832 . . . . 77.0 109.957 177.98 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' PHE . . . . . . . . . . . . . 72.8 m-85 -133.57 115.95 15.33 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 108.408 -0.96 . . . . 49.61 108.408 174.396 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' MET . . . . . . . . . . . . . 71.0 mtp -87.33 143.09 27.42 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 109.346 -0.612 . . . . 64.58 109.346 173.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -156.28 -177.66 6.75 Favored 'General case' 0 C--N 1.33 -0.27 0 N-CA-C 108.874 -0.787 . . . . 43.92 108.874 -176.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' HIS . . . . . . . . . . . . . 36.9 m80 -108.14 125.6 51.8 Favored 'General case' 0 C--O 1.236 0.386 0 N-CA-C 108.374 -0.973 . . . . 39.08 108.374 177.973 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 98.7 mttt -58.31 -37.52 75.25 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.539 -0.464 . . . . 51.96 111.558 -176.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 14.7 p -69.31 -31.11 48.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.425 0 C-N-CA 119.993 -0.683 . . . . 45.77 110.957 -176.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 85.8 t -74.31 -45.71 46.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 O-C-N 121.673 -0.642 . . . . 44.94 110.368 177.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 43.9 mt -63.31 -35.21 79.6 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.346 -0.541 . . . . 51.88 111.161 178.035 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -70.52 -26.65 63.67 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.686 -0.406 . . . . 41.32 111.877 -179.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 81.5 p -77.95 -11.17 59.88 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 113.095 0.776 . . . . 63.69 113.095 -177.506 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 9.4 m -120.66 -9.12 9.42 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 113.365 0.876 . . . . 53.87 113.365 179.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 3.2 t -138.95 109.64 7.75 Favored Pre-proline 0 C--O 1.238 0.469 0 CA-C-N 118.513 0.597 . . . . 49.43 110.313 -177.051 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -59.92 -26.36 82.12 Favored 'Trans proline' 0 C--O 1.237 0.461 0 CA-C-N 118.519 0.507 . . . . 43.76 113.248 175.031 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 48.3 t -66.45 -44.77 90.35 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 C-N-CA 120.47 -0.492 . . . . 43.15 110.367 174.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -67.23 -33.76 76.02 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.304 -0.558 . . . . 44.87 111.604 175.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -64.77 -49.36 71.05 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.529 -0.468 . . . . 57.4 111.173 -179.045 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -65.7 -33.93 77.03 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.363 -0.535 . . . . 56.26 111.165 177.361 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' MET . . . . . . . . . . . . . 27.6 ttm -64.52 -31.52 72.76 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 111.878 0.325 . . . . 58.32 111.878 179.062 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' PHE . . . . . . . . . . . . . 20.2 m-85 -102.01 -23.62 14.08 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 113.828 1.047 . . . . 54.14 113.828 -173.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 75.7 p -90.66 88.51 7.13 Favored 'General case' 0 N--CA 1.464 0.231 0 N-CA-C 107.85 -1.167 . . . . 73.28 107.85 177.026 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 73.6 m-20 -108.05 -0.45 21.21 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 113.257 0.836 . . . . 119.65 113.257 -178.444 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . 70.43 13.34 70.8 Favored Glycine 0 N--CA 1.448 -0.551 0 C-N-CA 120.206 -0.997 . . . . 121.58 114.683 -174.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -113.31 140.54 47.92 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 118.152 0.976 . . . . 122.12 109.413 178.006 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' ARG . . . . . . . . . . . . . 2.1 mmt-85 -78.67 107.31 11.26 Favored 'General case' 0 C--O 1.235 0.295 0 N-CA-C 108.886 -0.783 . . . . 119.52 108.886 176.467 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -73.03 157.05 38.12 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-O 121.852 0.834 . . . . 114.19 110.242 176.381 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -117.69 37.58 3.89 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-N 115.504 -0.771 . . . . 121.74 111.518 -178.563 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 123.19 -133.19 8.89 Favored Glycine 0 CA--C 1.525 0.661 0 CA-C-O 121.326 0.404 . . . . 109.45 112.277 171.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 53.4 tpp -73.42 119.19 17.31 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 115.248 -0.476 . . . . 75.73 110.693 -170.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' GLU . . . . . . . . . . . . . 66.1 tt0 -101.8 137.32 40.26 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 109.581 -0.526 . . . . 71.21 109.581 172.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' VAL . . . . . . . . . . . . . 68.0 t -101.86 131.23 50.23 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 108.399 -0.963 . . . . 62.32 108.399 177.407 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 54.2 t -122.24 122.19 65.78 Favored 'Isoleucine or valine' 0 C--O 1.238 0.46 0 N-CA-C 108.067 -1.086 . . . . 59.47 108.067 179.584 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' SER . . . . . . . . . . . . . 29.7 m -85.54 123.91 31.5 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 108.626 -0.879 . . . . 79.22 108.626 174.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' ILE . . . . . . . . . . . . . 9.2 mt -114.93 130.47 69.36 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 N-CA-C 108.658 -0.867 . . . . 59.95 108.658 -176.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -119.77 158.05 27.35 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-O 121.461 0.648 . . . . 86.24 110.439 -173.108 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' GLY . . . . . . . . . . . . . . . 66.56 28.71 73.89 Favored Glycine 0 C--N 1.331 0.28 0 N-CA-C 115.498 0.959 . . . . 57.07 115.498 169.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ILE . . . . . 0.471 HD13 ' HE1' ' A' ' 133' ' ' MET . 10.3 tt -152.78 136.85 8.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 N-CA-C 108.132 -1.062 . . . . 61.41 108.132 172.362 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HIS . . . . . . . . . . . . . 45.6 t-80 -68.01 145.79 97.91 Favored Pre-proline 0 C--O 1.236 0.387 0 CA-C-N 116.121 -0.49 . . . . 66.94 110.271 -175.474 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' PRO . . . . . 0.443 ' HB3' ' HB3' ' A' ' 91' ' ' ALA . 82.7 Cg_exo -58.45 -35.11 99.07 Favored 'Trans proline' 0 C--O 1.237 0.475 0 N-CA-C 114.117 0.776 . . . . 54.59 114.117 -179.495 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 78.2 tttt -68.79 -28.48 66.81 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 119.399 -0.92 . . . . 101.34 111.644 179.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' VAL . . . . . . . . . . . . . 69.0 t -76.09 -40.89 37.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.394 0 C-N-CA 120.774 -0.371 . . . . 52.26 110.854 178.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' MET . . . . . 0.471 ' HE1' HD13 ' A' ' 128' ' ' ILE . 44.5 tpp -61.83 -38.44 88.16 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 120.489 -0.485 . . . . 61.77 110.865 174.747 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -62.16 -42.45 99.28 Favored 'General case' 0 C--O 1.237 0.42 0 C-N-CA 120.682 -0.407 . . . . 66.29 111.217 177.801 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 84.2 mtt180 -67.79 -33.84 75.6 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.46 -0.496 . . . . 113.2 111.691 -179.78 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' LEU . . . . . . . . . . . . . 64.6 mt -68.55 -43.23 77.1 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 119.941 -0.704 . . . . 47.38 111.245 175.187 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' ILE . . . . . 0.501 HD11 HD12 ' A' ' 81' ' ' LEU . 72.5 mt -59.0 -40.15 79.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.444 0 CA-C-O 120.963 0.411 . . . . 50.37 110.324 176.197 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.67 -39.15 90.37 Favored 'General case' 0 C--O 1.237 0.407 0 O-C-N 122.098 -0.376 . . . . 70.68 111.34 178.414 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' PHE . . . . . . . . . . . . . 92.2 t80 -67.9 -38.36 82.86 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.079 -0.648 . . . . 50.37 111.461 -179.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -61.8 -33.9 74.95 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.197 -0.601 . . . . 58.34 111.238 179.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 -89.14 -38.22 14.47 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 112.856 0.687 . . . . 48.79 112.856 -177.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' THR . . . . . . . . . . . . . 29.4 p -109.97 -15.09 14.14 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 114.514 1.302 . . . . 50.93 114.514 -171.017 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . 67.91 16.83 9.64 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 124.808 1.243 . . . . 51.01 112.749 -175.564 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 68.8 m -129.47 145.54 51.42 Favored 'General case' 0 C--O 1.234 0.271 0 N-CA-C 109.169 -0.678 . . . . 55.55 109.169 174.749 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' ILE . . . . . . . . . . . . . 20.3 tt -143.29 138.35 26.41 Favored 'Isoleucine or valine' 0 C--O 1.235 0.324 0 N-CA-C 108.434 -0.95 . . . . 61.75 108.434 178.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -133.2 151.1 51.95 Favored 'General case' 0 C--O 1.234 0.277 0 N-CA-C 109.391 -0.596 . . . . 85.88 109.391 -176.792 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' MET . . . . . . . . . . . . . 3.9 ptt? -168.89 149.03 4.32 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.755 -0.657 . . . . 82.21 109.461 -172.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . -70.46 155.78 53.11 Favored Glycine 0 N--CA 1.449 -0.464 0 C-N-CA 120.175 -1.012 . . . . 73.75 111.218 168.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -60.32 -26.39 66.52 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.361 -0.535 . . . . 95.36 112.037 -174.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' LYS . . . . . . . . . . . . . 72.6 mmtt -87.12 6.15 34.2 Favored 'General case' 0 C--O 1.235 0.336 0 N-CA-C 112.674 0.62 . . . . 105.11 112.674 179.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' CYS . . . . . . . . . . . . . 5.6 m -112.97 -10.15 13.54 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 113.258 0.836 . . . . 96.46 113.258 173.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' VAL . . . . . 0.448 HG11 ' HD2' ' A' ' 174' ' ' PHE . 71.6 t -56.16 -33.99 38.16 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 CA-C-N 118.275 0.488 . . . . 61.0 111.278 -177.57 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 18.9 tp -68.97 -42.26 76.81 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.192 -0.603 . . . . 65.49 111.368 179.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' HIS . . . . . . . . . . . . . 10.9 m80 -70.99 -34.91 71.84 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.488 -0.485 . . . . 88.5 111.713 -178.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' VAL . . . . . . . . . . . . . 53.7 t -65.25 -38.76 83.42 Favored 'Isoleucine or valine' 0 C--O 1.238 0.481 0 CA-C-O 120.985 0.421 . . . . 60.07 110.301 177.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' MET . . . . . . . . . . . . . 27.5 ttt -62.39 -41.64 98.81 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 120.546 -0.462 . . . . 66.7 111.072 176.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' ASN . . . . . . . . . . . . . 89.9 m-20 -58.49 -46.71 86.11 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-O 120.82 0.343 . . . . 65.44 111.216 178.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' GLY . . . . . . . . . . . . . . . -67.1 -33.16 82.51 Favored Glycine 0 C--N 1.335 0.512 0 C-N-CA 119.993 -1.099 . . . . 43.89 112.984 176.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -72.55 -39.04 67.8 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 117.298 0.549 . . . . 51.1 111.344 179.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' VAL . . . . . . . . . . . . . 70.6 t -62.95 -40.34 88.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.467 0 C-N-CA 120.426 -0.509 . . . . 48.46 110.13 173.129 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' MET . . . . . . . . . . . . . 35.8 ttm -62.9 -33.98 76.45 Favored 'General case' 0 C--O 1.236 0.354 0 O-C-N 122.056 -0.403 . . . . 90.76 111.867 -177.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' TYR . . . . . . . . . . . . . 90.9 m-85 -108.89 12.15 25.64 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 112.592 0.59 . . . . 49.99 112.592 -179.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 55.8 44.69 25.65 Favored 'General case' 0 C--O 1.234 0.252 0 CA-C-O 121.95 0.881 . . . . 76.48 111.653 170.582 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' ILE . . . . . . . . . . . . . 15.6 mt -92.37 85.23 2.1 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 N-CA-C 105.523 -2.029 . . . . 53.54 105.523 173.102 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' ASP . . . . . . . . . . . . . 32.0 m-20 -56.9 -37.68 71.75 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 115.258 -0.883 . . . . 74.02 112.227 -169.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' SER . . . . . . . . . . . . . 3.9 m -58.58 -46.47 86.89 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 111.688 0.255 . . . . 64.44 111.688 -171.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' VAL . . . . . . . . . . . . . 1.6 m -87.57 -21.63 7.1 Favored 'Isoleucine or valine' 0 C--O 1.24 0.566 0 C-N-CA 120.584 -0.446 . . . . 53.9 112.15 -177.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' VAL . . . . . . . . . . . . . 22.8 t -56.08 -48.16 79.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.412 0 CA-C-O 121.321 0.581 . . . . 60.03 109.901 167.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' ARG . . . . . . . . . . . . . 20.4 ttm-85 -65.8 -38.69 89.68 Favored 'General case' 0 C--O 1.236 0.381 0 O-C-N 122.173 -0.33 . . . . 75.09 111.203 179.214 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' ALA . . . . . . . . . . . . . . . -68.27 -45.18 73.83 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.638 -0.425 . . . . 59.57 111.266 -179.542 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' CYS . . . . . . . . . . . . . 99.7 m -66.09 -33.99 77.04 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.269 -0.572 . . . . 58.39 111.538 176.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' ALA . . . . . . . . . . . . . . . -65.55 -39.97 92.3 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.187 -0.605 . . . . 57.4 111.029 174.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -66.55 -41.25 88.94 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.314 -0.555 . . . . 86.69 111.48 -179.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' PHE . . . . . 0.448 ' HD2' HG11 ' A' ' 152' ' ' VAL . 84.8 t80 -66.08 -40.92 91.22 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.349 -0.54 . . . . 75.33 111.512 -178.396 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' LEU . . . . . . . . . . . . . 19.7 mt -66.97 -28.28 68.14 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.532 -0.467 . . . . 58.99 112.028 -179.058 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' VAL . . . . . . . . . . . . . 50.9 t -75.1 -39.43 43.62 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 C-N-CA 120.279 -0.568 . . . . 63.13 110.812 -176.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -84.46 2.62 40.05 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 112.928 0.714 . . . . 100.58 112.928 178.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' GLN . . . . . . . . . . . . . 39.9 mt-30 -74.07 0.98 12.07 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 118.275 0.489 . . . . 92.45 112.237 162.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' LEU . . . . . . . . . . . . . 12.0 mt . . . . . 0 C--N 1.329 -0.319 0 CA-C-O 120.899 0.38 . . . . 81.67 111.052 -174.21 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_