data_6ro5_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 6ro5 _Structure_validation_residue.Date_analyzed 2019-06-14 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 ' 1' ' ' LYS . . . . . . . . . . . . . 80.1 tttt . . . . . 0 C--O 1.233 0.204 0 N-CA-C 112.273 0.471 . . . . 44.62 112.273 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 89.3 t -96.58 110.78 25.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.393 0 N-CA-C 107.379 -1.341 . . . . 41.64 107.379 172.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 29.9 m-85 -75.75 149.82 37.92 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.511 0.672 . . . . 41.99 111.315 179.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -82.39 157.08 36.14 Favored Glycine 0 N--CA 1.444 -0.781 0 C-N-CA 120.474 -0.87 . . . . 43.48 111.412 162.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 12.7 ttt180 -47.86 -62.02 1.67 Allowed 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.295 0.569 . . . . 66.83 111.76 -176.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 67.5 m -72.07 -30.38 65.08 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 119.891 -0.724 . . . . 52.05 111.875 -176.102 -72.27 -54.698 -81.312 104.014 2.035 103.89 -45.772 -54.84 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 74.0 tt0 -60.29 -42.87 96.41 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 120.36 -0.536 . . . . 60.82 111.134 175.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 30.9 tp -67.26 -46.31 74.08 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 120.1 -0.64 . . . . 42.95 111.05 179.029 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.97 -47.64 71.14 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 120.47 -0.492 . . . . 42.88 111.238 179.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.65 -42.98 94.02 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.558 -0.457 . . . . 44.56 111.262 178.247 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.16 -46.72 82.82 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.274 -0.571 . . . . 40.09 111.134 178.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 29.7 mtt -59.44 -42.12 91.18 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.158 -0.617 . . . . 49.17 111.013 178.234 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 69.7 tttt -65.33 -41.74 93.62 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.294 -0.563 . . . . 46.62 111.195 178.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.7 mtp180 -61.14 -26.49 67.72 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.433 -0.507 . . . . 63.82 111.767 176.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 63.3 m-70 -95.74 9.49 40.22 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 113.056 0.762 . . . . 49.52 113.056 -176.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.8 14.25 58.29 Favored Glycine 0 N--CA 1.448 -0.545 0 N-CA-C 115.925 1.13 . . . . 41.41 115.925 170.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 13.9 mt -84.01 -19.71 34.04 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 118.691 1.246 . . . . 36.49 113.974 -177.043 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 53.8 t0 -65.7 114.0 4.67 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 118.888 0.767 . . . . 62.12 109.974 -176.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.4 m120 67.01 17.33 10.49 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 123.169 0.587 . . . . 56.98 112.392 -177.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 43.8 t80 -62.84 125.78 25.12 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 119.689 -0.804 . . . . 38.8 108.874 173.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 27.4 mmm180 55.81 26.12 9.21 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.305 -0.407 . . . . 62.65 111.468 -174.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 79.99 15.91 78.0 Favored Glycine 0 N--CA 1.446 -0.661 0 N-CA-C 115.622 1.009 . . . . 38.35 115.622 175.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -102.51 113.18 26.32 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 118.496 1.148 . . . . 35.95 108.516 178.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 89.2 p -62.05 161.13 11.3 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.961 0.886 . . . . 41.27 110.612 -179.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 46.0 tp -56.76 -37.29 70.84 Favored 'General case' 0 C--O 1.239 0.515 0 CA-C-N 114.833 -1.076 . . . . 39.21 111.716 -171.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -61.4 -31.31 76.91 Favored Glycine 0 C--N 1.333 0.365 0 C-N-CA 120.36 -0.924 . . . . 32.93 113.437 -177.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 61.0 m-80 -58.53 -42.6 88.16 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 119.713 -0.795 . . . . 42.46 110.781 175.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 86.0 m95 -72.75 -35.9 67.59 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 121.097 -0.241 . . . . 33.78 111.175 -176.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 85.7 t -67.73 -46.8 81.88 Favored 'Isoleucine or valine' 0 C--O 1.239 0.508 0 CA-C-O 121.265 0.555 . . . . 30.86 110.084 177.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 51.1 t -56.98 -49.36 75.98 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-O 120.99 0.424 . . . . 29.87 111.163 177.878 179.717 -90.74 -91.229 105.818 2.03 103.812 -75.979 -53.807 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -58.95 -46.03 89.03 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 119.991 -0.684 . . . . 28.33 111.113 -178.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.75 -38.83 89.41 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.494 -0.482 . . . . 34.35 111.628 -177.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LYS . . . . . 0.551 ' NZ ' ' OD1' ' A' ' 37' ' ' ASN . 50.0 tptt -57.52 -49.82 75.07 Favored 'General case' 0 C--O 1.239 0.533 0 C-N-CA 120.565 -0.454 . . . . 39.8 111.415 178.693 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 27.7 m-85 -79.79 -24.25 41.59 Favored 'General case' 0 C--O 1.237 0.42 0 N-CA-C 112.882 0.697 . . . . 38.57 112.882 -176.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -78.97 -49.49 12.68 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 118.341 0.519 . . . . 36.55 111.253 178.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 80.7 p -124.44 -5.86 7.65 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 114.298 1.222 . . . . 33.01 114.298 -169.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ASN . . . . . 0.551 ' OD1' ' NZ ' ' A' ' 33' ' ' LYS . 6.0 t-20 60.52 33.2 20.55 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 118.786 0.721 . . . . 44.42 110.946 -170.724 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 22.8 m-85 65.95 16.73 10.59 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 112.883 0.697 . . . . 38.75 112.883 179.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 40.7 t-20 -103.27 113.09 26.29 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 108.618 -0.882 . . . . 33.07 108.618 -175.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 39.7 p -61.58 -21.15 64.06 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 112.753 0.649 . . . . 38.29 112.753 -179.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -94.84 14.07 22.66 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 113.004 0.742 . . . . 34.18 113.004 -175.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.09 136.13 49.92 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.358 0.599 . . . . 31.73 111.124 -178.174 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 76.6 p -137.67 144.56 41.88 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 108.767 -0.827 . . . . 34.09 108.767 173.317 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 64.5 m-80 -148.87 129.43 13.99 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.376 -0.972 . . . . 40.34 108.376 175.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ARG . . . . . 0.537 ' NH2' ' O ' ' A' ' 49' ' ' GLY . 0.0 OUTLIER -81.71 132.62 35.3 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 123.598 0.561 . . . . 57.72 110.009 178.615 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ASN . . . . . 0.646 ' OD1' ' ND2' ' A' ' 59' ' ' ASN . 30.6 m120 -87.36 166.99 14.44 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.836 0.827 . . . . 47.91 110.091 177.393 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.1 p -64.18 -30.34 71.41 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 115.605 -0.725 . . . . 60.37 111.885 -178.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 48.2 p30 -80.2 5.0 15.73 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 113.275 0.843 . . . . 57.22 113.275 -176.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLY . . . . . 0.537 ' O ' ' NH2' ' A' ' 45' ' ' ARG . . . 92.26 -14.48 64.48 Favored Glycine 0 N--CA 1.442 -0.926 0 CA-C-O 119.162 -0.799 . . . . 41.73 114.95 -177.021 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 87.2 p -73.46 175.45 6.98 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 118.331 1.065 . . . . 37.59 110.231 173.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 56.6 m -139.99 141.62 36.36 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.568 -0.742 . . . . 40.49 109.605 -177.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ASP . . . . . 0.597 ' OD1' ' ND2' ' A' ' 59' ' ' ASN . 77.7 m-20 -95.52 141.03 29.53 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 109.853 -0.425 . . . . 34.76 109.853 173.85 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' TYR . . . . . . . . . . . . . 97.0 m-85 -130.05 129.73 44.01 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.249 -0.432 . . . . 32.36 111.626 -171.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 93.55 -169.75 30.44 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-O 123.228 1.46 . . . . 28.86 116.083 161.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 8.9 tp -66.88 -19.48 25.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 CA-C-N 113.13 -1.535 . . . . 35.32 111.16 -176.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 43.2 mt -115.98 9.0 14.76 Favored 'General case' 0 C--O 1.236 0.348 0 O-C-N 121.714 -0.616 . . . . 33.57 112.275 -177.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 23.7 mm-40 50.13 58.16 5.78 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 122.194 0.997 . . . . 31.19 111.036 173.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 51.8 mt -81.21 138.13 20.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 CA-C-N 114.56 -1.2 . . . . 31.73 109.36 -178.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ASN . . . . . 0.646 ' ND2' ' OD1' ' A' ' 46' ' ' ASN . 10.6 t-20 -95.85 137.49 34.84 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.854 -0.612 . . . . 48.68 112.12 -163.644 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 88.4 p -75.51 -9.53 58.65 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 113.117 0.784 . . . . 35.02 113.117 179.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ARG . . . . . 0.709 ' NH2' ' O ' ' A' ' 301' ' ' HOH . 25.3 tpt180 -61.77 -37.66 85.13 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.1 -0.64 . . . . 67.59 111.174 177.466 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 53.4 m95 -119.15 -37.55 3.18 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 113.959 1.096 . . . . 65.27 113.959 -175.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' TRP . . . . . . . . . . . . . 87.5 m95 -107.87 -32.49 7.58 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 115.07 1.507 . . . . 39.72 115.07 -151.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 28.5 p -137.09 170.14 16.61 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.887 0.851 . . . . 33.59 109.231 -178.963 61.306 88.074 93.06 102.392 2.029 103.067 -63.772 -59.727 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -112.23 125.92 54.68 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.408 -0.815 . . . . 42.67 109.243 -178.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 55.2 p30 -125.77 15.26 8.07 Favored 'General case' 0 C--O 1.239 0.546 0 N-CA-C 112.522 0.564 . . . . 39.51 112.522 173.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 59.77 21.37 55.1 Favored Glycine 0 C--N 1.335 0.479 0 N-CA-C 114.986 0.755 . . . . 46.81 114.986 175.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 28.5 ptt180 -139.41 0.42 1.87 Allowed 'General case' 0 C--O 1.235 0.337 0 CA-C-N 118.699 1.249 . . . . 40.2 111.516 176.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 8.2 m -128.63 75.46 79.64 Favored Pre-proline 0 C--O 1.239 0.52 0 N-CA-C 107.112 -1.44 . . . . 46.01 107.112 174.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' PRO . . . . . 0.545 ' O ' ' O5 ' ' A' ' 216' ' ' QEB . 19.4 Cg_endo -60.12 149.84 82.57 Favored 'Trans proline' 0 C--N 1.332 -0.31 0 CA-C-O 121.759 0.65 . . . . 49.16 111.663 -177.218 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 66.69 15.74 64.73 Favored Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 119.423 -1.37 . . . . 51.28 114.369 -178.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 24.9 p -98.7 171.0 8.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.832 0.825 . . . . 44.08 109.713 174.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 78.3 mtp180 -117.15 175.52 5.56 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.181 -0.918 . . . . 66.86 109.071 177.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 44.1 t-20 -139.52 61.88 1.54 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 122.706 1.241 . . . . 39.94 108.348 -174.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 99.1 mt -62.98 -28.19 69.93 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.566 -0.743 . . . . 47.61 112.453 -169.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 95.0 m -83.75 -6.25 59.39 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 119.565 -0.854 . . . . 39.19 112.578 175.389 -68.84 170.306 86.358 105.257 2.023 103.716 49.898 -169.286 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 64.8 m-80 53.84 54.37 9.93 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.703 0.763 . . . . 56.06 111.139 177.162 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 35.1 pt -147.65 147.6 28.08 Favored Pre-proline 0 C--O 1.237 0.436 0 N-CA-C 109.263 -0.643 . . . . 40.46 109.263 179.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -63.05 138.37 67.22 Favored 'Trans proline' 0 C--N 1.328 -0.537 0 N-CA-C 109.758 -0.901 . . . . 39.62 109.758 166.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' CYS . . . . . . . . . . . . . 84.9 m -56.65 -23.77 43.76 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 119.657 -0.817 . . . . 33.08 111.783 178.689 -59.727 -63.772 93.06 103.067 2.029 102.392 88.074 61.306 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 80.7 p -68.59 -28.83 67.28 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.391 -0.524 . . . . 35.8 112.007 -177.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.21 -22.59 64.91 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 120.27 -0.572 . . . . 40.11 111.957 176.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 47.7 mt -77.94 -3.22 40.77 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 123.673 0.789 . . . . 34.21 113.087 178.381 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 49.5 mt -104.73 0.58 28.44 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 118.598 0.635 . . . . 40.89 112.694 177.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 20.9 t -63.6 157.67 23.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 122.008 0.908 . . . . 52.28 110.947 -178.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 23.8 p -65.63 -26.65 67.91 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.341 -0.845 . . . . 45.06 111.149 169.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ASP . . . . . 0.403 ' OD1' ' OG1' ' A' ' 89' ' ' THR . 22.9 t0 -83.82 121.67 27.64 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 108.544 -0.91 . . . . 57.21 108.544 174.854 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 27.7 pt -88.76 8.33 2.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 CA-C-O 120.595 0.236 . . . . 40.8 110.86 -169.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' THR . . . . . 0.403 ' OG1' ' OD1' ' A' ' 87' ' ' ASP . 85.4 m -54.89 -50.18 69.37 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 119.991 -0.684 . . . . 45.68 111.156 -177.514 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -59.15 -43.41 92.05 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.557 -0.457 . . . . 39.88 111.28 -176.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 15.8 m -68.27 -41.0 81.72 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.095 -0.642 . . . . 34.45 111.648 -179.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 74.7 t -63.55 -49.9 80.56 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 C-N-CA 120.325 -0.55 . . . . 35.41 110.563 -179.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -57.81 -40.78 80.77 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 119.717 -0.793 . . . . 51.46 111.211 -179.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.2 t -71.15 -40.71 71.17 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.119 -0.633 . . . . 32.05 111.063 179.052 -169.286 49.898 86.358 103.716 2.023 105.257 170.306 -68.84 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.77 -38.2 81.18 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 119.926 -0.71 . . . . 32.13 111.095 175.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -59.36 -39.37 83.03 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 119.631 -0.828 . . . . 35.85 111.25 176.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 25.7 mttm -69.75 -38.26 76.74 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 120.471 -0.492 . . . . 47.7 111.351 179.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 86.1 mt -64.91 -47.7 87.19 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 CA-C-O 121.174 0.511 . . . . 34.27 110.463 179.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 3.2 p -71.36 -12.11 15.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 O-C-N 121.848 -0.532 . . . . 42.4 112.234 -172.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 19.3 m -94.1 -6.22 45.53 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 113.314 0.857 . . . . 44.99 113.314 178.413 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 20.4 p-10 -78.53 9.91 3.61 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 113.233 0.827 . . . . 68.43 113.233 -171.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 106.23 -19.41 37.42 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-O 119.034 -0.87 . . . . 48.91 114.958 174.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 96.4 m-20 -98.9 1.62 45.85 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-N 118.529 1.164 . . . . 77.86 113.091 178.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 57.42 -147.16 36.12 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 119.873 -1.156 . . . . 35.15 110.536 178.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 52.1 mtp -80.51 3.77 20.51 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 113.048 0.759 . . . . 30.4 113.048 -178.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -65.24 -17.97 64.93 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-N 118.961 0.801 . . . . 34.75 112.173 174.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -54.06 -26.81 28.75 Favored 'General case' 0 C--O 1.238 0.456 0 N-CA-C 111.865 0.32 . . . . 34.62 111.865 172.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 20.5 m-90 -96.91 112.74 24.36 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 108.527 -0.916 . . . . 32.3 108.527 -179.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 39.4 t -61.73 -41.45 90.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 116.079 -0.509 . . . . 38.45 110.763 -177.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -62.5 -42.98 99.87 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 119.775 -0.77 . . . . 28.81 111.209 -179.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' TRP . . . . . . . . . . . . . 90.9 t90 -59.51 -48.05 83.14 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 120.296 -0.562 . . . . 30.93 111.163 175.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 33.1 ttp-105 -56.32 -37.81 70.44 Favored 'General case' 0 C--O 1.239 0.525 0 CA-C-O 120.788 0.328 . . . . 59.55 111.662 -177.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -98.21 -19.61 17.76 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 114.158 1.169 . . . . 37.42 114.158 -170.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 69.9 mtp180 -132.3 -9.46 3.32 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 114.977 1.473 . . . . 36.49 114.977 -172.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' CYS . . . . . . . . . . . . . 56.2 m -118.53 -47.01 2.56 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 119.211 0.914 . . . . 34.22 112.826 179.087 -53.807 -75.979 -91.229 103.812 2.03 105.818 -90.74 179.717 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -48.37 124.76 8.46 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-O 120.934 0.397 . . . . 37.54 110.736 176.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 87.58 -10.41 69.81 Favored Glycine 0 N--CA 1.448 -0.533 0 N-CA-C 115.496 0.959 . . . . 53.77 115.496 175.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 3.3 p -91.47 176.62 6.49 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 118.54 1.17 . . . . 44.6 109.968 179.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -81.9 78.88 8.56 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 122.566 1.174 . . . . 70.56 108.252 174.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 27.0 m -67.59 -17.32 22.34 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 CA-C-N 115.138 -0.937 . . . . 42.04 112.364 -175.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -64.72 -24.62 67.63 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 119.91 -0.716 . . . . 95.13 112.162 177.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -59.2 -19.89 49.27 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 112.2 0.445 . . . . 49.11 112.2 175.661 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -76.25 -11.09 59.86 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 112.982 0.734 . . . . 45.94 112.982 179.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 36.5 pt -121.02 3.57 6.5 Favored 'Isoleucine or valine' 0 C--O 1.238 0.473 0 N-CA-C 112.64 0.608 . . . . 50.5 112.64 178.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' ARG . . . . . . . . . . . . . 8.3 mtt180 -61.94 142.78 57.24 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 118.783 0.72 . . . . 61.83 110.27 176.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 84.99 -26.04 5.67 Favored Glycine 0 N--CA 1.442 -0.919 0 N-CA-C 114.733 0.653 . . . . 64.35 114.733 -177.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 58.5 m -67.6 136.27 54.19 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 118.088 0.944 . . . . 58.59 110.589 -179.548 -54.84 -45.772 -81.312 103.89 2.035 104.014 -54.698 -72.27 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -84.14 82.95 8.14 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 122.406 1.098 . . . . 72.93 108.425 178.285 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 3.6 mt . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 115.344 -0.844 . . . . 68.13 111.767 -175.775 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 59.2 tttp . . . . . 0 C--O 1.233 0.208 0 CA-C-O 120.62 0.248 . . . . 45.52 111.151 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 95.2 t -102.21 104.88 17.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 N-CA-C 107.653 -1.24 . . . . 45.99 107.653 175.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -72.65 145.75 47.05 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.661 0.743 . . . . 37.9 111.287 179.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' GLY . . . . . . . . . . . . . . . -71.72 159.77 53.88 Favored Glycine 0 N--CA 1.444 -0.8 0 C-N-CA 120.207 -0.997 . . . . 43.27 111.124 162.38 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' ARG . . . . . . . . . . . . . 62.4 ttp85 -58.84 -56.33 23.66 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.015 0.436 . . . . 52.39 111.199 -177.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' CYS . . . . . . . . . . . . . 68.5 m -69.96 -29.07 66.09 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 119.661 -0.815 . . . . 42.1 111.696 -179.911 -71.936 -51.299 -72.145 103.746 2.027 104.143 -51.527 -59.072 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 73.0 tt0 -63.69 -41.55 98.12 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 120.063 -0.655 . . . . 52.13 111.241 178.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 56.8 tp -72.11 -41.3 67.42 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 119.823 -0.751 . . . . 38.97 111.074 178.247 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.66 -44.94 70.07 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.118 -0.633 . . . . 36.88 110.871 175.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.42 -47.91 83.62 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-O 120.86 0.362 . . . . 37.6 111.33 175.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.29 -46.16 91.46 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-O 121.039 0.447 . . . . 36.67 111.167 -178.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 27.2 mtt -61.36 -39.13 89.48 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.146 -0.621 . . . . 35.97 111.127 178.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' LYS . . . . . 0.485 ' NZ ' ' OD2' ' B' ' 18' ' ' ASP . 43.4 tptt -59.14 -51.28 70.7 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.393 -0.523 . . . . 56.48 110.646 175.288 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' ARG . . . . . . . . . . . . . 11.4 tpt180 -55.05 -35.43 64.49 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.366 -0.534 . . . . 71.32 111.116 177.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' HIS . . . . . . . . . . . . . 48.4 m-70 -85.74 2.84 43.87 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 113.134 0.79 . . . . 51.14 113.134 179.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.96 36.27 11.53 Favored Glycine 0 C--O 1.237 0.282 0 N-CA-C 116.109 1.204 . . . . 42.85 116.109 168.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 92.7 mt -98.15 -9.02 26.45 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 118.086 0.943 . . . . 33.46 113.336 178.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' ASP . . . . . 0.485 ' OD2' ' NZ ' ' B' ' 13' ' ' LYS . 38.3 t0 -68.85 108.42 3.45 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 108.765 -0.828 . . . . 42.98 108.765 179.999 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 1.6 t30 68.89 24.88 6.27 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 123.195 0.598 . . . . 53.96 112.286 -179.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' TYR . . . . . . . . . . . . . 61.8 t80 -67.72 121.12 15.27 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 108.789 -0.819 . . . . 44.15 108.789 172.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' ARG . . . . . . . . . . . . . 22.4 mmm180 51.0 40.53 25.65 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 120.767 0.318 . . . . 41.15 111.708 -177.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 79.59 9.49 86.8 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 115.467 0.947 . . . . 36.13 115.467 -178.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -103.33 108.87 20.28 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 118.669 1.235 . . . . 29.97 108.714 -177.333 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' SER . . . . . . . . . . . . . 92.8 p -66.05 155.32 37.06 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.745 0.783 . . . . 35.14 110.663 -179.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 33.7 tp -50.66 -39.24 50.3 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.118 -0.946 . . . . 30.87 112.415 -169.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' GLY . . . . . . . . . . . . . . . -57.37 -27.83 58.52 Favored Glycine 0 C--N 1.336 0.546 0 C-N-CA 120.243 -0.98 . . . . 31.13 113.247 -176.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' ASN . . . . . . . . . . . . . 60.6 m-80 -64.32 -40.8 96.64 Favored 'General case' 0 C--O 1.237 0.442 0 O-C-N 122.354 -0.498 . . . . 33.16 111.463 178.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' TRP . . . . . . . . . . . . . 79.8 m95 -74.44 -38.43 63.02 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.874 -0.33 . . . . 29.06 111.665 -177.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 95.3 t -65.55 -43.84 94.09 Favored 'Isoleucine or valine' 0 C--O 1.24 0.578 0 C-N-CA 120.188 -0.605 . . . . 30.56 110.169 176.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' CYS . . . . . . . . . . . . . 53.0 t -58.34 -48.04 81.84 Favored 'General case' 0 C--O 1.237 0.421 0 O-C-N 122.143 -0.348 . . . . 28.47 110.845 177.784 -178.861 -89.521 -94.422 104.744 2.024 102.334 -73.409 -57.453 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.74 -45.8 92.37 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.171 -0.612 . . . . 26.26 111.387 -178.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.99 -41.49 92.17 Favored 'General case' 0 C--O 1.238 0.472 0 C-N-CA 120.214 -0.594 . . . . 27.03 111.166 179.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 51.5 tptt -54.56 -52.7 61.26 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.396 -0.522 . . . . 55.59 111.386 178.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -82.4 -22.38 35.39 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 113.107 0.78 . . . . 40.09 113.107 -174.496 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 53.8 mm-40 -76.7 -44.15 34.72 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.093 -0.643 . . . . 32.86 111.649 176.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 60.1 p -132.58 -4.27 3.31 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 114.44 1.274 . . . . 31.27 114.44 -170.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 18.4 t30 59.28 36.49 23.63 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 119.593 1.088 . . . . 60.89 110.572 -171.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 64.54 18.75 11.53 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.387 1.075 . . . . 33.58 113.793 179.02 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -102.24 118.39 36.79 Favored 'General case' 0 C--O 1.234 0.277 0 O-C-N 121.181 -0.95 . . . . 36.71 109.458 -176.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' THR . . . . . . . . . . . . . 72.3 p -68.97 -22.71 64.09 Favored 'General case' 0 C--O 1.239 0.513 0 C-N-CA 120.361 -0.536 . . . . 37.65 111.92 -177.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -89.9 11.76 19.39 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 112.978 0.733 . . . . 37.57 112.978 -176.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.04 134.88 48.73 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 121.584 0.707 . . . . 35.47 111.135 -178.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 52.2 p -134.37 149.27 50.81 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 108.725 -0.843 . . . . 38.32 108.725 169.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' ASN . . . . . . . . . . . . . 49.5 m-80 -146.0 120.44 9.67 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 109.136 -0.69 . . . . 34.94 109.136 177.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 16.2 tpp85 -78.87 130.13 35.31 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.828 -0.624 . . . . 45.89 109.981 179.047 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -93.06 157.52 16.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.531 0.681 . . . . 47.83 110.316 175.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 17.3 p -66.44 -23.67 66.33 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.609 -0.723 . . . . 61.43 112.312 -177.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 53.0 p30 -76.14 -5.0 44.68 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 112.664 0.616 . . . . 52.64 112.664 173.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.54 -14.19 60.8 Favored Glycine 0 N--CA 1.446 -0.698 0 CA-C-O 119.078 -0.846 . . . . 44.1 114.842 -179.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 99.7 p -74.01 171.71 12.98 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 118.453 1.126 . . . . 37.07 109.837 173.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' THR . . . . . . . . . . . . . 49.9 m -135.2 141.55 45.88 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.41 -0.814 . . . . 37.04 109.204 -177.242 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 59.6 m-20 -98.09 140.59 32.19 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 109.567 -0.531 . . . . 44.69 109.567 173.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -129.49 136.41 49.84 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.468 -0.333 . . . . 33.77 111.645 -173.318 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 94.58 -174.89 33.82 Favored Glycine 0 CA--C 1.518 0.264 0 CA-C-O 123.157 1.42 . . . . 29.46 115.173 164.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 46.7 pt -59.37 -33.26 50.62 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-N 113.83 -1.185 . . . . 38.03 111.282 -179.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 67.0 mt -106.59 10.6 31.09 Favored 'General case' 0 C--O 1.233 0.224 0 O-C-N 121.61 -0.681 . . . . 35.02 112.788 -179.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' GLN . . . . . 0.487 ' O ' ' H2 ' ' B' ' 211' ' ' ACT . 29.4 mm-40 50.66 54.21 11.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.865 0.841 . . . . 31.93 111.95 171.853 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' ILE . . . . . . . . . . . . . 50.4 mt -76.64 135.54 26.51 Favored 'Isoleucine or valine' 0 C--O 1.24 0.553 0 CA-C-N 115.068 -0.969 . . . . 33.45 109.446 -179.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' ASN . . . . . . . . . . . . . 7.5 t-20 -95.66 137.56 34.55 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 112.599 0.592 . . . . 50.07 112.599 -163.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 84.1 p -73.06 -14.93 61.5 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.467 -0.788 . . . . 35.39 112.734 -178.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' ARG . . . . . . . . . . . . . 52.3 tpt85 -55.21 -30.69 60.47 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.46 -0.496 . . . . 68.2 111.839 176.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' TRP . . . . . . . . . . . . . 98.8 m95 -132.65 -38.01 1.03 Allowed 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 113.973 1.101 . . . . 62.68 113.973 -171.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' TRP . . . . . . . . . . . . . 74.1 m95 -106.94 -20.25 13.38 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 114.629 1.344 . . . . 37.79 114.629 -155.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' CYS . . . . . . . . . . . . . 30.3 p -147.51 161.78 40.39 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-O 121.719 0.771 . . . . 32.95 109.086 -177.149 63.286 88.45 92.183 102.667 2.033 106.656 -63.916 -61.108 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -103.38 126.34 50.48 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.032 -0.985 . . . . 45.73 109.901 178.242 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 55.7 p30 -123.63 3.83 8.93 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 113.021 0.748 . . . . 41.0 113.021 170.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' GLY . . . . . . . . . . . . . . . 68.95 11.2 62.93 Favored Glycine 0 C--N 1.334 0.454 0 N-CA-C 115.847 1.099 . . . . 37.83 115.847 177.084 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 4.9 ptm85 -138.14 21.54 2.8 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 118.532 1.166 . . . . 57.73 112.214 -179.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' THR . . . . . . . . . . . . . 11.6 m -124.37 85.27 55.79 Favored Pre-proline 0 C--O 1.243 0.749 0 N-CA-C 108.149 -1.056 . . . . 39.64 108.149 177.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_exo -61.31 135.74 59.81 Favored 'Trans proline' 0 C--N 1.333 -0.26 0 C-N-CA 120.44 0.76 . . . . 50.44 112.282 -173.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . 78.66 8.76 87.54 Favored Glycine 0 N--CA 1.447 -0.613 0 N-CA-C 115.151 0.82 . . . . 47.62 115.151 178.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' SER . . . . . . . . . . . . . 81.0 p -89.0 170.4 10.69 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 118.354 1.077 . . . . 48.9 110.332 179.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 8.4 mmm180 -107.04 178.56 4.52 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.325 -0.852 . . . . 72.65 109.691 177.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -141.01 60.52 1.51 Allowed 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 107.861 -1.163 . . . . 41.57 107.861 179.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 97.4 mt -66.81 -27.25 67.41 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 115.682 -0.69 . . . . 46.71 112.508 -169.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' CYS . . . . . . . . . . . . . 63.7 m -83.7 -6.1 59.35 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 119.505 -0.878 . . . . 40.44 112.416 173.702 -73.305 169.068 87.936 105.126 2.03 102.428 47.946 -171.153 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 62.0 m-80 53.55 50.88 16.28 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 122.191 0.996 . . . . 64.68 111.838 177.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' ILE . . . . . . . . . . . . . 24.2 pt -139.0 154.57 72.69 Favored Pre-proline 0 C--O 1.24 0.594 0 CA-C-N 115.335 -0.848 . . . . 36.96 109.076 174.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -67.62 139.51 48.81 Favored 'Trans proline' 0 C--N 1.326 -0.627 0 N-CA-C 109.644 -0.945 . . . . 39.94 109.644 163.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 76.3 m -56.71 -30.32 63.36 Favored 'General case' 0 C--O 1.239 0.501 0 C-N-CA 118.931 -1.107 . . . . 33.7 111.83 179.795 -61.108 -63.916 92.183 106.656 2.033 102.667 88.45 63.286 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' SER . . . . . . . . . . . . . 93.6 p -59.11 -26.35 64.61 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.383 -0.527 . . . . 39.36 112.416 178.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.18 -26.82 68.56 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 119.815 -0.754 . . . . 38.51 111.42 176.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 48.8 mt -75.13 -3.79 34.88 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 113.18 0.807 . . . . 38.29 113.18 178.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' LEU . . . . . . . . . . . . . 59.6 mt -103.67 0.93 31.28 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 113.281 0.845 . . . . 41.95 113.281 -178.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 30.7 t -69.38 158.48 35.02 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 122.016 0.912 . . . . 50.35 111.031 -178.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 53.1 p -68.39 -27.92 66.64 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.362 -0.835 . . . . 53.91 111.186 173.401 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' ASP . . . . . 0.469 ' OD1' ' OG1' ' B' ' 89' ' ' THR . 8.4 t0 -79.92 122.27 26.48 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 108.648 -0.871 . . . . 57.91 108.648 172.182 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' ILE . . . . . . . . . . . . . 42.1 pt -87.4 9.23 2.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.4 0 CA-C-N 116.715 -0.22 . . . . 39.78 111.048 -170.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' THR . . . . . 0.469 ' OG1' ' OD1' ' B' ' 87' ' ' ASP . 58.4 m -52.15 -51.82 55.58 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.711 -0.396 . . . . 42.2 111.743 -176.351 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' ALA . . . . . . . . . . . . . . . -65.51 -39.69 92.14 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 120.062 -0.655 . . . . 36.57 111.563 -174.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' SER . . . . . . . . . . . . . 75.1 m -67.35 -38.11 84.3 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 119.96 -0.696 . . . . 37.31 111.005 179.885 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 22.7 t -68.41 -48.39 72.99 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 C-N-CA 120.649 -0.421 . . . . 33.27 110.465 -178.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -63.62 -38.11 89.88 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 120.155 -0.618 . . . . 48.01 111.401 -179.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' CYS . . . . . . . . . . . . . 35.1 t -66.83 -41.16 87.92 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 119.845 -0.742 . . . . 37.92 111.078 176.425 -171.153 47.946 87.936 102.428 2.03 105.126 169.068 -73.305 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.48 -33.06 74.86 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 111.694 0.257 . . . . 31.41 111.694 179.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -62.67 -39.87 95.3 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 119.957 -0.697 . . . . 45.92 110.94 174.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -64.23 -45.65 87.26 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 119.84 -0.744 . . . . 53.53 111.014 174.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' ILE . . . . . . . . . . . . . 65.7 mt -57.8 -48.75 82.94 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 CA-C-O 121.05 0.453 . . . . 34.76 110.621 -179.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' VAL . . . . . . . . . . . . . 9.4 p -72.94 -6.29 7.82 Favored 'Isoleucine or valine' 0 C--O 1.238 0.467 0 N-CA-C 112.942 0.719 . . . . 38.81 112.942 -174.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' SER . . . . . . . . . . . . . 60.4 m -104.73 5.56 33.49 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 113.5 0.926 . . . . 48.91 113.5 -178.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 55.2 p30 -88.15 -20.88 25.02 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 113.925 1.083 . . . . 83.91 113.925 -170.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' GLY . . . . . . . . . . . . . . . 148.25 -31.3 1.29 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.429 -0.891 . . . . 58.61 115.121 -179.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -104.23 -1.14 27.53 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 113.499 0.926 . . . . 76.83 113.499 -178.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' GLY . . . . . . . . . . . . . . . 61.49 -151.47 43.23 Favored Glycine 0 C--O 1.236 0.231 0 C-N-CA 118.972 -1.585 . . . . 31.18 111.587 176.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 81.4 mtp -75.39 -2.16 27.25 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 117.674 -1.61 . . . . 28.76 113.197 -176.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' ASN . . . . . . . . . . . . . 72.3 m-80 -59.26 -18.24 35.58 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-N 119.084 0.856 . . . . 41.03 111.954 172.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -58.98 -25.75 63.87 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 120.591 -0.444 . . . . 32.62 111.722 174.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 22.6 m-90 -94.15 109.92 21.67 Favored 'General case' 0 C--O 1.237 0.442 0 N-CA-C 108.721 -0.844 . . . . 30.53 108.721 175.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 61.9 t -58.45 -42.88 85.46 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 CA-C-N 116.017 -0.538 . . . . 43.74 110.222 -177.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.21 -36.85 85.42 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 120.624 -0.43 . . . . 31.04 111.365 -177.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' TRP . . . . . . . . . . . . . 88.7 t90 -61.58 -46.35 90.23 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 119.074 -1.05 . . . . 30.44 110.695 174.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' ARG . . . . . . . . . . . . . 29.7 ttp-105 -62.45 -40.05 95.35 Favored 'General case' 0 C--O 1.239 0.548 0 C-N-CA 119.829 -0.748 . . . . 53.07 111.455 -176.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -87.69 -23.66 24.12 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 113.857 1.058 . . . . 35.46 113.857 -173.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' ARG . . . . . . . . . . . . . 64.6 mtp180 -127.97 -11.81 5.33 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 114.402 1.26 . . . . 37.45 114.402 -169.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' CYS . . . . . . . . . . . . . 64.5 m -119.31 -45.28 2.54 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 119.176 0.898 . . . . 34.85 112.772 179.634 -57.453 -73.409 -94.422 102.334 2.024 104.744 -89.521 -178.861 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 75.8 tttt -52.97 133.26 38.29 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 120.963 0.411 . . . . 34.87 110.769 -177.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . 69.92 5.89 54.12 Favored Glycine 0 N--CA 1.447 -0.62 0 N-CA-C 115.468 0.947 . . . . 42.95 115.468 177.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' THR . . . . . . . . . . . . . 69.8 p -97.12 175.67 6.22 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.774 1.287 . . . . 39.74 109.473 171.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 14.0 t0 -82.02 79.57 8.5 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 122.464 1.126 . . . . 55.12 108.138 176.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 17.9 m -70.62 -15.75 19.21 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 CA-C-N 115.271 -0.877 . . . . 38.54 113.027 -178.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 -61.89 -28.43 69.51 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 119.564 -0.854 . . . . 64.31 111.612 174.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.57 -27.15 62.41 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.174 -0.611 . . . . 45.01 112.002 178.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' TRP . . . . . . . . . . . . . 91.7 m95 -69.17 -17.8 63.85 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 112.942 0.719 . . . . 43.77 112.942 -177.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' ILE . . . . . . . . . . . . . 40.0 pt -119.5 4.72 6.75 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.181 0 CA-C-N 118.54 0.609 . . . . 45.49 112.293 179.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' ARG . . . . . . . . . . . . . 4.4 tmm_? -60.0 136.8 58.12 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 120.337 -0.545 . . . . 59.17 110.189 176.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 80.09 -1.71 78.88 Favored Glycine 0 N--CA 1.447 -0.61 0 N-CA-C 115.3 0.88 . . . . 53.43 115.3 178.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' CYS . . . . . . . . . . . . . 79.6 m -90.53 130.47 36.57 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 118.584 1.192 . . . . 43.87 110.431 -177.058 -59.072 -51.527 -72.145 104.143 2.027 103.746 -51.299 -71.936 1 1 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' ARG . . . . . . . . . . . . . 14.5 ttp85 -81.86 113.83 20.06 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 107.551 -1.277 . . . . 75.15 107.551 164.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 60.0 mt . . . . . 0 C--N 1.327 -0.398 0 CA-C-N 116.536 -0.302 . . . . 71.3 110.71 -175.915 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' QEB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' QEB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' QEB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' QEB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' QEB . . . . . 0.545 ' O5 ' ' O ' ' A' ' 70' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' QEB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' RRE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 202' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 203' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 204' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 205' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 206' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 207' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 208' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 209' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 210' ' ' RRE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 211' ' ' ACT . . . . . 0.487 ' H2 ' ' O ' ' B' ' 57' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . 0.709 ' O ' ' NH2' ' A' ' 61' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' LYS . . . . . 0.402 ' O ' HG23 ' A' ' 40' ' ' THR . 80.1 tttt . . . . . 0 C--O 1.233 0.204 0 N-CA-C 112.273 0.471 . . . . 44.62 112.273 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 89.3 t -96.58 110.78 25.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.393 0 N-CA-C 107.379 -1.341 . . . . 41.64 107.379 172.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 29.9 m-85 -75.75 149.82 37.92 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.511 0.672 . . . . 41.99 111.315 179.129 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -82.39 157.08 36.14 Favored Glycine 0 N--CA 1.444 -0.781 0 C-N-CA 120.474 -0.87 . . . . 43.48 111.412 162.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 12.7 ttt180 -47.86 -62.02 1.67 Allowed 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.295 0.569 . . . . 66.83 111.76 -176.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 67.5 m -72.07 -30.38 65.08 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 119.891 -0.724 . . . . 52.05 111.875 -176.102 -72.27 -54.698 -81.312 104.014 2.035 103.89 -45.772 -54.84 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 74.0 tt0 -60.29 -42.87 96.41 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 120.36 -0.536 . . . . 60.82 111.134 175.312 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LEU . . . . . 0.501 HD22 HD11 ' A' ' 55' ' ' ILE . 30.9 tp -67.26 -46.31 74.08 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 120.1 -0.64 . . . . 42.95 111.05 179.029 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.97 -47.64 71.14 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 120.47 -0.492 . . . . 42.88 111.238 179.682 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.65 -42.98 94.02 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.558 -0.457 . . . . 44.56 111.262 178.247 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.16 -46.72 82.82 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.274 -0.571 . . . . 40.09 111.134 178.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 29.7 mtt -59.44 -42.12 91.18 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.158 -0.617 . . . . 49.17 111.013 178.234 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 69.7 tttt -65.33 -41.74 93.62 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.294 -0.563 . . . . 46.62 111.195 178.483 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.7 mtp180 -61.14 -26.49 67.72 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.433 -0.507 . . . . 63.82 111.767 176.686 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' HIS . . . . . 0.622 ' HB3' HG11 ' A' ' 92' ' ' VAL . 63.3 m-70 -95.74 9.49 40.22 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 113.056 0.762 . . . . 49.52 113.056 -176.839 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.8 14.25 58.29 Favored Glycine 0 N--CA 1.448 -0.545 0 N-CA-C 115.925 1.13 . . . . 41.41 115.925 170.299 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 13.9 mt -84.01 -19.71 34.04 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 118.691 1.246 . . . . 36.49 113.974 -177.043 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 53.8 t0 -65.7 114.0 4.67 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 118.888 0.767 . . . . 62.12 109.974 -176.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.4 m120 67.01 17.33 10.49 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 123.169 0.587 . . . . 56.98 112.392 -177.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' TYR . . . . . 0.506 ' CD1' ' HG2' ' A' ' 21' ' ' ARG . 43.8 t80 -62.84 125.78 25.12 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 119.689 -0.804 . . . . 38.8 108.874 173.366 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ARG . . . . . 0.506 ' HG2' ' CD1' ' A' ' 20' ' ' TYR . 27.4 mmm180 55.81 26.12 9.21 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.305 -0.407 . . . . 62.65 111.468 -174.991 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 79.99 15.91 78.0 Favored Glycine 0 N--CA 1.446 -0.661 0 N-CA-C 115.622 1.009 . . . . 38.35 115.622 175.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -102.51 113.18 26.32 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 118.496 1.148 . . . . 35.95 108.516 178.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 89.2 p -62.05 161.13 11.3 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.961 0.886 . . . . 41.27 110.612 -179.216 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 46.0 tp -56.76 -37.29 70.84 Favored 'General case' 0 C--O 1.239 0.515 0 CA-C-N 114.833 -1.076 . . . . 39.21 111.716 -171.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -61.4 -31.31 76.91 Favored Glycine 0 C--N 1.333 0.365 0 C-N-CA 120.36 -0.924 . . . . 32.93 113.437 -177.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 61.0 m-80 -58.53 -42.6 88.16 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 119.713 -0.795 . . . . 42.46 110.781 175.973 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 86.0 m95 -72.75 -35.9 67.59 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 121.097 -0.241 . . . . 33.78 111.175 -176.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 85.7 t -67.73 -46.8 81.88 Favored 'Isoleucine or valine' 0 C--O 1.239 0.508 0 CA-C-O 121.265 0.555 . . . . 30.86 110.084 177.378 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 51.1 t -56.98 -49.36 75.98 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-O 120.99 0.424 . . . . 29.87 111.163 177.878 179.717 -90.74 -91.229 105.818 2.03 103.812 -75.979 -53.807 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -58.95 -46.03 89.03 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 119.991 -0.684 . . . . 28.33 111.113 -178.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.75 -38.83 89.41 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.494 -0.482 . . . . 34.35 111.628 -177.973 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.0 tptt -57.52 -49.82 75.07 Favored 'General case' 0 C--O 1.239 0.533 0 C-N-CA 120.565 -0.454 . . . . 39.8 111.415 178.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 27.7 m-85 -79.79 -24.25 41.59 Favored 'General case' 0 C--O 1.237 0.42 0 N-CA-C 112.882 0.697 . . . . 38.57 112.882 -176.467 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -78.97 -49.49 12.68 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 118.341 0.519 . . . . 36.55 111.253 178.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 80.7 p -124.44 -5.86 7.65 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 114.298 1.222 . . . . 33.01 114.298 -169.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 60.52 33.2 20.55 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 118.786 0.721 . . . . 44.42 110.946 -170.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' PHE . . . . . 0.576 ' HA ' HD11 ' A' ' 55' ' ' ILE . 22.8 m-85 65.95 16.73 10.59 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 112.883 0.697 . . . . 38.75 112.883 179.42 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 40.7 t-20 -103.27 113.09 26.29 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 108.618 -0.882 . . . . 33.07 108.618 -175.396 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' THR . . . . . 0.402 HG23 ' O ' ' A' ' 1' ' ' LYS . 39.7 p -61.58 -21.15 64.06 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 112.753 0.649 . . . . 38.29 112.753 -179.479 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -94.84 14.07 22.66 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 113.004 0.742 . . . . 34.18 113.004 -175.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.09 136.13 49.92 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.358 0.599 . . . . 31.73 111.124 -178.174 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 76.6 p -137.67 144.56 41.88 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 108.767 -0.827 . . . . 34.09 108.767 173.317 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 64.5 m-80 -148.87 129.43 13.99 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.376 -0.972 . . . . 40.34 108.376 175.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ARG . . . . . 0.537 ' NH2' ' O ' ' A' ' 49' ' ' GLY . 0.0 OUTLIER -81.71 132.62 35.3 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 123.598 0.561 . . . . 57.72 110.009 178.615 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ASN . . . . . 0.639 ' OD1' ' ND2' ' A' ' 59' ' ' ASN . 30.6 m120 -87.36 166.99 14.44 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.836 0.827 . . . . 47.91 110.091 177.393 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.1 p -64.18 -30.34 71.41 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 115.605 -0.725 . . . . 60.37 111.885 -178.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 48.2 p30 -80.2 5.0 15.73 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 113.275 0.843 . . . . 57.22 113.275 -176.255 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLY . . . . . 0.537 ' O ' ' NH2' ' A' ' 45' ' ' ARG . . . 92.26 -14.48 64.48 Favored Glycine 0 N--CA 1.442 -0.926 0 CA-C-O 119.162 -0.799 . . . . 41.73 114.95 -177.021 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 87.2 p -73.46 175.45 6.98 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 118.331 1.065 . . . . 37.59 110.231 173.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 56.6 m -139.99 141.62 36.36 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.568 -0.742 . . . . 40.49 109.605 -177.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ASP . . . . . 0.597 ' OD1' ' ND2' ' A' ' 59' ' ' ASN . 77.7 m-20 -95.52 141.03 29.53 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 109.853 -0.425 . . . . 34.76 109.853 173.85 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' TYR . . . . . 0.413 ' CD2' ' HB3' ' A' ' 80' ' ' CYS . 97.0 m-85 -130.05 129.73 44.01 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.249 -0.432 . . . . 32.36 111.626 -171.507 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 93.55 -169.75 30.44 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-O 123.228 1.46 . . . . 28.86 116.083 161.764 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ILE . . . . . 0.576 HD11 ' HA ' ' A' ' 38' ' ' PHE . 8.9 tp -66.88 -19.48 25.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 CA-C-N 113.13 -1.535 . . . . 35.38 111.16 -176.83 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 43.2 mt -115.98 9.0 14.76 Favored 'General case' 0 C--O 1.236 0.348 0 O-C-N 121.714 -0.616 . . . . 33.57 112.275 -177.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 23.7 mm-40 50.13 58.16 5.78 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 122.194 0.997 . . . . 31.19 111.036 173.101 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 51.8 mt -81.21 138.13 20.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 CA-C-N 114.56 -1.2 . . . . 31.73 109.36 -178.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ASN . . . . . 0.639 ' ND2' ' OD1' ' A' ' 46' ' ' ASN . 10.6 t-20 -95.85 137.49 34.84 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.854 -0.612 . . . . 48.68 112.12 -163.644 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 88.4 p -75.51 -9.53 58.65 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 113.117 0.784 . . . . 35.02 113.117 179.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ARG . . . . . 0.709 ' NH2' ' O ' ' A' ' 301' ' ' HOH . 25.3 tpt180 -61.77 -37.66 85.13 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.1 -0.64 . . . . 67.59 111.174 177.466 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 53.4 m95 -119.15 -37.55 3.18 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 113.959 1.096 . . . . 65.27 113.959 -175.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' TRP . . . . . 0.454 ' CE2' HG12 ' A' ' 98' ' ' ILE . 87.5 m95 -107.87 -32.49 7.58 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 115.07 1.507 . . . . 39.72 115.07 -151.705 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 28.5 p -137.09 170.14 16.61 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.887 0.851 . . . . 33.59 109.231 -178.963 61.306 88.074 93.06 102.392 2.029 103.067 -63.772 -59.727 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -112.23 125.92 54.68 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.408 -0.815 . . . . 42.67 109.243 -178.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 55.2 p30 -125.77 15.26 8.07 Favored 'General case' 0 C--O 1.239 0.546 0 N-CA-C 112.522 0.564 . . . . 39.51 112.522 173.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 59.77 21.37 55.1 Favored Glycine 0 C--N 1.335 0.479 0 N-CA-C 114.986 0.755 . . . . 46.81 114.986 175.286 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 28.5 ptt180 -139.41 0.42 1.87 Allowed 'General case' 0 C--O 1.235 0.337 0 CA-C-N 118.699 1.249 . . . . 40.2 111.516 176.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' THR . . . . . 0.442 HG22 ' HB3' ' A' ' 72' ' ' SER . 8.2 m -128.63 75.46 79.64 Favored Pre-proline 0 C--O 1.239 0.52 0 N-CA-C 107.112 -1.44 . . . . 46.01 107.112 174.776 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' PRO . . . . . 0.594 ' HG2' ' O5 ' ' A' ' 216' ' ' QEB . 19.4 Cg_endo -60.12 149.84 82.57 Favored 'Trans proline' 0 C--N 1.332 -0.31 0 CA-C-O 121.759 0.65 . . . . 49.16 111.663 -177.218 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 66.69 15.74 64.73 Favored Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 119.423 -1.37 . . . . 51.28 114.369 -178.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' SER . . . . . 0.442 ' HB3' HG22 ' A' ' 69' ' ' THR . 24.9 p -98.7 171.0 8.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.832 0.825 . . . . 44.08 109.713 174.461 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 78.3 mtp180 -117.15 175.52 5.56 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.181 -0.918 . . . . 66.86 109.071 177.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 44.1 t-20 -139.52 61.88 1.54 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 122.706 1.241 . . . . 39.94 108.348 -174.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 99.1 mt -62.98 -28.19 69.93 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.566 -0.743 . . . . 47.61 112.453 -169.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 95.0 m -83.75 -6.25 59.39 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 119.565 -0.854 . . . . 39.19 112.578 175.389 -68.84 170.306 86.358 105.257 2.023 103.716 49.898 -169.286 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 64.8 m-80 53.84 54.37 9.93 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.703 0.763 . . . . 56.06 111.139 177.162 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 35.1 pt -147.65 147.6 28.08 Favored Pre-proline 0 C--O 1.237 0.436 0 N-CA-C 109.263 -0.643 . . . . 40.46 109.263 179.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -63.05 138.37 67.22 Favored 'Trans proline' 0 C--N 1.328 -0.537 0 N-CA-C 109.758 -0.901 . . . . 39.62 109.758 166.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' CYS . . . . . 0.413 ' HB3' ' CD2' ' A' ' 53' ' ' TYR . 84.9 m -56.65 -23.77 43.76 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 119.657 -0.817 . . . . 33.08 111.783 178.689 -59.727 -63.772 93.06 103.067 2.029 102.392 88.074 61.306 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 80.7 p -68.59 -28.83 67.28 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.391 -0.524 . . . . 35.8 112.007 -177.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.21 -22.59 64.91 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 120.27 -0.572 . . . . 40.11 111.957 176.686 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 47.7 mt -77.94 -3.22 40.77 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 123.673 0.789 . . . . 34.21 113.087 178.381 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 49.5 mt -104.73 0.58 28.44 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 118.598 0.635 . . . . 40.89 112.694 177.415 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 20.9 t -63.6 157.67 23.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 122.008 0.908 . . . . 52.28 110.947 -178.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 23.8 p -65.63 -26.65 67.91 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.341 -0.845 . . . . 45.06 111.149 169.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -83.82 121.67 27.64 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 108.544 -0.91 . . . . 57.21 108.544 174.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 27.7 pt -88.76 8.33 2.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 CA-C-O 120.595 0.236 . . . . 40.8 110.86 -169.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 85.4 m -54.89 -50.18 69.37 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 119.991 -0.684 . . . . 45.68 111.156 -177.514 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -59.15 -43.41 92.05 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.557 -0.457 . . . . 39.88 111.28 -176.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 15.8 m -68.27 -41.0 81.72 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.095 -0.642 . . . . 34.45 111.648 -179.258 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' VAL . . . . . 0.622 HG11 ' HB3' ' A' ' 15' ' ' HIS . 74.7 t -63.55 -49.9 80.56 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 C-N-CA 120.325 -0.55 . . . . 35.41 110.563 -179.561 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -57.81 -40.78 80.77 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 119.717 -0.793 . . . . 51.46 111.211 -179.323 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.2 t -71.15 -40.71 71.17 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.119 -0.633 . . . . 32.05 111.063 179.052 -169.286 49.898 86.358 103.716 2.023 105.257 170.306 -68.84 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.77 -38.2 81.18 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 119.926 -0.71 . . . . 32.13 111.095 175.999 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -59.36 -39.37 83.03 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 119.631 -0.828 . . . . 35.85 111.25 176.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 25.7 mttm -69.75 -38.26 76.74 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 120.471 -0.492 . . . . 47.7 111.351 179.051 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ILE . . . . . 0.454 HG12 ' CE2' ' A' ' 63' ' ' TRP . 86.1 mt -64.91 -47.7 87.19 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 CA-C-O 121.174 0.511 . . . . 34.27 110.463 179.796 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 99' ' ' VAL . . . . . 0.462 HG13 ' HG3' ' A' ' 21' ' ' ARG . 3.2 p -71.36 -12.11 15.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 O-C-N 121.848 -0.532 . . . . 42.4 112.234 -172.692 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 19.3 m -94.1 -6.22 45.53 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 113.314 0.857 . . . . 44.99 113.314 178.413 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 20.4 p-10 -78.53 9.91 3.61 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 113.233 0.827 . . . . 68.43 113.233 -171.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 106.23 -19.41 37.42 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-O 119.034 -0.87 . . . . 48.91 114.958 174.078 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 96.4 m-20 -98.9 1.62 45.85 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-N 118.529 1.164 . . . . 77.86 113.091 178.378 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 57.42 -147.16 36.12 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 119.873 -1.156 . . . . 35.15 110.536 178.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 52.1 mtp -80.51 3.77 20.51 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 113.048 0.759 . . . . 30.4 113.048 -178.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -65.24 -17.97 64.93 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-N 118.961 0.801 . . . . 34.75 112.173 174.414 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -54.06 -26.81 28.75 Favored 'General case' 0 C--O 1.238 0.456 0 N-CA-C 111.865 0.32 . . . . 34.62 111.865 172.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 20.5 m-90 -96.91 112.74 24.36 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 108.527 -0.916 . . . . 32.3 108.527 -179.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 39.4 t -61.73 -41.45 90.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 116.079 -0.509 . . . . 38.45 110.763 -177.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -62.5 -42.98 99.87 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 119.775 -0.77 . . . . 28.81 111.209 -179.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' TRP . . . . . 0.48 ' CD1' ' HB2' ' A' ' 115' ' ' CYS . 90.9 t90 -59.51 -48.05 83.14 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 120.296 -0.562 . . . . 30.93 111.163 175.805 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 33.1 ttp-105 -56.32 -37.81 70.44 Favored 'General case' 0 C--O 1.239 0.525 0 CA-C-O 120.788 0.328 . . . . 59.55 111.662 -177.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -98.21 -19.61 17.76 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 114.158 1.169 . . . . 37.42 114.158 -170.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 69.9 mtp180 -132.3 -9.46 3.32 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 114.977 1.473 . . . . 36.49 114.977 -172.656 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' CYS . . . . . 0.48 ' HB2' ' CD1' ' A' ' 111' ' ' TRP . 56.2 m -118.53 -47.01 2.56 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 119.211 0.914 . . . . 34.22 112.826 179.087 -53.807 -75.979 -91.229 103.812 2.03 105.818 -90.74 179.717 2 2 . 1 . 001 ecloud build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -48.37 124.76 8.46 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-O 120.934 0.397 . . . . 37.54 110.736 176.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 87.58 -10.41 69.81 Favored Glycine 0 N--CA 1.448 -0.533 0 N-CA-C 115.496 0.959 . . . . 53.77 115.496 175.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 3.3 p -91.47 176.62 6.49 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 118.54 1.17 . . . . 44.6 109.968 179.605 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -81.9 78.88 8.56 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 122.566 1.174 . . . . 70.56 108.252 174.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 27.0 m -67.59 -17.32 22.34 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 CA-C-N 115.138 -0.937 . . . . 42.04 112.364 -175.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -64.72 -24.62 67.63 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 119.91 -0.716 . . . . 95.13 112.162 177.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ALA . . . . . 0.451 ' HA ' ' HG3' ' A' ' 125' ' ' ARG . . . -59.2 -19.89 49.27 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 112.2 0.445 . . . . 49.11 112.2 175.661 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 123' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -76.25 -11.09 59.86 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 112.982 0.734 . . . . 45.94 112.982 179.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 36.5 pt -121.02 3.57 6.5 Favored 'Isoleucine or valine' 0 C--O 1.238 0.473 0 N-CA-C 112.64 0.608 . . . . 50.5 112.64 178.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' ARG . . . . . 0.451 ' HG3' ' HA ' ' A' ' 122' ' ' ALA . 8.3 mtt180 -61.94 142.78 57.24 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 118.783 0.72 . . . . 61.83 110.27 176.449 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 84.99 -26.04 5.67 Favored Glycine 0 N--CA 1.442 -0.919 0 N-CA-C 114.733 0.653 . . . . 64.35 114.733 -177.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 58.5 m -67.6 136.27 54.19 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 118.088 0.944 . . . . 58.59 110.589 -179.548 -54.84 -45.772 -81.312 103.89 2.035 104.014 -54.698 -72.27 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -84.14 82.95 8.14 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 122.406 1.098 . . . . 72.93 108.425 178.285 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 3.6 mt . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 115.344 -0.844 . . . . 68.13 111.767 -175.775 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 59.2 tttp . . . . . 0 C--O 1.233 0.208 0 CA-C-O 120.62 0.248 . . . . 45.52 111.151 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 95.2 t -102.21 104.88 17.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 N-CA-C 107.653 -1.24 . . . . 45.99 107.653 175.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 3' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -72.65 145.75 47.05 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.661 0.743 . . . . 37.9 111.287 179.605 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' GLY . . . . . . . . . . . . . . . -71.72 159.77 53.88 Favored Glycine 0 N--CA 1.444 -0.8 0 C-N-CA 120.207 -0.997 . . . . 43.27 111.124 162.38 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' ARG . . . . . . . . . . . . . 62.4 ttp85 -58.84 -56.33 23.66 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.015 0.436 . . . . 52.39 111.199 -177.456 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' CYS . . . . . . . . . . . . . 68.5 m -69.96 -29.07 66.09 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 119.661 -0.815 . . . . 42.1 111.696 -179.911 -71.936 -51.299 -72.145 103.746 2.027 104.143 -51.527 -59.072 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 73.0 tt0 -63.69 -41.55 98.12 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 120.063 -0.655 . . . . 52.13 111.241 178.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 56.8 tp -72.11 -41.3 67.42 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 119.823 -0.751 . . . . 38.97 111.074 178.247 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.66 -44.94 70.07 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.118 -0.633 . . . . 36.88 110.871 175.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.42 -47.91 83.62 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-O 120.86 0.362 . . . . 37.6 111.33 175.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.29 -46.16 91.46 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-O 121.039 0.447 . . . . 36.67 111.167 -178.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 27.2 mtt -61.36 -39.13 89.48 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.146 -0.621 . . . . 35.97 111.127 178.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' LYS . . . . . . . . . . . . . 43.4 tptt -59.14 -51.28 70.7 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.393 -0.523 . . . . 56.48 110.646 175.288 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' ARG . . . . . . . . . . . . . 11.4 tpt180 -55.05 -35.43 64.49 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.366 -0.534 . . . . 71.32 111.116 177.9 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' HIS . . . . . 0.476 ' HB3' HG11 ' B' ' 92' ' ' VAL . 48.4 m-70 -85.74 2.84 43.87 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 113.134 0.79 . . . . 51.14 113.134 179.991 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.96 36.27 11.53 Favored Glycine 0 C--O 1.237 0.282 0 N-CA-C 116.109 1.204 . . . . 42.85 116.109 168.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 92.7 mt -98.15 -9.02 26.45 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 118.086 0.943 . . . . 33.46 113.336 178.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 38.3 t0 -68.85 108.42 3.45 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 108.765 -0.828 . . . . 42.98 108.765 179.999 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 1.6 t30 68.89 24.88 6.27 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 123.195 0.598 . . . . 53.96 112.286 -179.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' TYR . . . . . . . . . . . . . 61.8 t80 -67.72 121.12 15.27 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 108.789 -0.819 . . . . 44.15 108.789 172.085 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' ARG . . . . . 0.401 ' O ' ' HG2' ' B' ' 21' ' ' ARG . 22.4 mmm180 51.0 40.53 25.65 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 120.767 0.318 . . . . 43.63 111.708 -177.965 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 79.59 9.49 86.8 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 115.467 0.947 . . . . 36.13 115.467 -178.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -103.33 108.87 20.28 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 118.669 1.235 . . . . 29.97 108.714 -177.333 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' SER . . . . . . . . . . . . . 92.8 p -66.05 155.32 37.06 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.745 0.783 . . . . 35.14 110.663 -179.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 33.7 tp -50.66 -39.24 50.3 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.118 -0.946 . . . . 30.87 112.415 -169.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' GLY . . . . . . . . . . . . . . . -57.37 -27.83 58.52 Favored Glycine 0 C--N 1.336 0.546 0 C-N-CA 120.243 -0.98 . . . . 31.13 113.247 -176.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' ASN . . . . . . . . . . . . . 60.6 m-80 -64.32 -40.8 96.64 Favored 'General case' 0 C--O 1.237 0.442 0 O-C-N 122.354 -0.498 . . . . 33.16 111.463 178.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' TRP . . . . . . . . . . . . . 79.8 m95 -74.44 -38.43 63.02 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.874 -0.33 . . . . 29.06 111.665 -177.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 95.3 t -65.55 -43.84 94.09 Favored 'Isoleucine or valine' 0 C--O 1.24 0.578 0 C-N-CA 120.188 -0.605 . . . . 30.56 110.169 176.055 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' CYS . . . . . 0.45 ' HB2' ' CD1' ' B' ' 123' ' ' TRP . 53.0 t -58.34 -48.04 81.84 Favored 'General case' 0 C--O 1.237 0.421 0 O-C-N 122.143 -0.348 . . . . 28.47 110.845 177.784 -178.861 -89.521 -94.422 104.744 2.024 102.334 -73.409 -57.453 2 2 . 1 . 001 ecloud build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.74 -45.8 92.37 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.171 -0.612 . . . . 26.26 111.387 -178.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.99 -41.49 92.17 Favored 'General case' 0 C--O 1.238 0.472 0 C-N-CA 120.214 -0.594 . . . . 27.03 111.166 179.644 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 51.5 tptt -54.56 -52.7 61.26 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.396 -0.522 . . . . 55.59 111.386 178.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -82.4 -22.38 35.39 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 113.107 0.78 . . . . 40.09 113.107 -174.496 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 53.8 mm-40 -76.7 -44.15 34.72 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.093 -0.643 . . . . 32.86 111.649 176.379 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 60.1 p -132.58 -4.27 3.31 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 114.44 1.274 . . . . 31.27 114.44 -170.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 18.4 t30 59.28 36.49 23.63 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 119.593 1.088 . . . . 60.89 110.572 -171.521 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 64.54 18.75 11.53 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.387 1.075 . . . . 33.58 113.793 179.02 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -102.24 118.39 36.79 Favored 'General case' 0 C--O 1.234 0.277 0 O-C-N 121.181 -0.95 . . . . 36.71 109.458 -176.606 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' THR . . . . . 0.482 HG22 ' CG2' ' B' ' 55' ' ' ILE . 72.3 p -68.97 -22.71 64.09 Favored 'General case' 0 C--O 1.239 0.513 0 C-N-CA 120.361 -0.536 . . . . 37.65 111.92 -177.971 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -89.9 11.76 19.39 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 112.978 0.733 . . . . 37.57 112.978 -176.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.04 134.88 48.73 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 121.584 0.707 . . . . 35.47 111.135 -178.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 52.2 p -134.37 149.27 50.81 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 108.725 -0.843 . . . . 38.32 108.725 169.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' ASN . . . . . . . . . . . . . 49.5 m-80 -146.0 120.44 9.67 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 109.136 -0.69 . . . . 36.73 109.136 177.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 16.2 tpp85 -78.87 130.13 35.31 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.828 -0.624 . . . . 45.89 109.981 179.047 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -93.06 157.52 16.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.531 0.681 . . . . 47.83 110.316 175.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 17.3 p -66.44 -23.67 66.33 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.609 -0.723 . . . . 61.43 112.312 -177.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 53.0 p30 -76.14 -5.0 44.68 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 112.664 0.616 . . . . 52.64 112.664 173.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.54 -14.19 60.8 Favored Glycine 0 N--CA 1.446 -0.698 0 CA-C-O 119.078 -0.846 . . . . 44.1 114.842 -179.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 99.7 p -74.01 171.71 12.98 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 118.453 1.126 . . . . 37.07 109.837 173.789 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' THR . . . . . . . . . . . . . 49.9 m -135.2 141.55 45.88 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.41 -0.814 . . . . 37.04 109.204 -177.242 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 59.6 m-20 -98.09 140.59 32.19 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 109.567 -0.531 . . . . 44.69 109.567 173.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -129.49 136.41 49.84 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.468 -0.333 . . . . 33.77 111.645 -173.318 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 94.58 -174.89 33.82 Favored Glycine 0 CA--C 1.518 0.264 0 CA-C-O 123.157 1.42 . . . . 29.46 115.173 164.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' ILE . . . . . 0.482 ' CG2' HG22 ' B' ' 40' ' ' THR . 46.7 pt -59.37 -33.26 50.62 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-N 113.83 -1.185 . . . . 38.03 111.282 -179.568 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 67.0 mt -106.59 10.6 31.09 Favored 'General case' 0 C--O 1.233 0.224 0 O-C-N 121.61 -0.681 . . . . 35.02 112.788 -179.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' GLN . . . . . 0.511 ' O ' ' H1 ' ' B' ' 211' ' ' ACT . 29.4 mm-40 50.66 54.21 11.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.865 0.841 . . . . 31.93 111.95 171.853 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 58' ' ' ILE . . . . . . . . . . . . . 50.4 mt -76.64 135.54 26.51 Favored 'Isoleucine or valine' 0 C--O 1.24 0.553 0 CA-C-N 115.068 -0.969 . . . . 33.45 109.446 -179.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' ASN . . . . . 0.415 ' OD1' ' HB3' ' B' ' 61' ' ' ARG . 7.5 t-20 -95.66 137.56 34.55 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 112.599 0.592 . . . . 50.07 112.599 -163.807 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 84.1 p -73.06 -14.93 61.5 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.467 -0.788 . . . . 35.39 112.734 -178.011 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' ARG . . . . . 0.426 ' HG3' ' CD1' ' B' ' 62' ' ' TRP . 52.3 tpt85 -55.21 -30.69 60.47 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.46 -0.496 . . . . 68.2 111.839 176.375 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 62' ' ' TRP . . . . . 0.426 ' CD1' ' HG3' ' B' ' 61' ' ' ARG . 98.8 m95 -132.65 -38.01 1.03 Allowed 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 113.973 1.101 . . . . 62.68 113.973 -171.071 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 63' ' ' TRP . . . . . 0.454 ' O ' ' HB2' ' B' ' 76' ' ' CYS . 74.1 m95 -106.94 -20.25 13.38 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 114.629 1.344 . . . . 37.79 114.629 -155.809 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 64' ' ' CYS . . . . . . . . . . . . . 30.3 p -147.51 161.78 40.39 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-O 121.719 0.771 . . . . 32.95 109.086 -177.149 63.286 88.45 92.183 102.667 2.033 106.656 -63.916 -61.108 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -103.38 126.34 50.48 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.032 -0.985 . . . . 45.73 109.901 178.242 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 55.7 p30 -123.63 3.83 8.93 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 113.021 0.748 . . . . 41.0 113.021 170.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' GLY . . . . . . . . . . . . . . . 68.95 11.2 62.93 Favored Glycine 0 C--N 1.334 0.454 0 N-CA-C 115.847 1.099 . . . . 37.83 115.847 177.084 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 4.9 ptm85 -138.14 21.54 2.8 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 118.532 1.166 . . . . 57.73 112.214 -179.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' THR . . . . . . . . . . . . . 11.6 m -124.37 85.27 55.79 Favored Pre-proline 0 C--O 1.243 0.749 0 N-CA-C 108.149 -1.056 . . . . 39.64 108.149 177.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_exo -61.31 135.74 59.81 Favored 'Trans proline' 0 C--N 1.333 -0.26 0 C-N-CA 120.44 0.76 . . . . 50.44 112.282 -173.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . 78.66 8.76 87.54 Favored Glycine 0 N--CA 1.447 -0.613 0 N-CA-C 115.151 0.82 . . . . 47.62 115.151 178.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' SER . . . . . . . . . . . . . 81.0 p -89.0 170.4 10.69 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 118.354 1.077 . . . . 48.9 110.332 179.686 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 8.4 mmm180 -107.04 178.56 4.52 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.325 -0.852 . . . . 72.65 109.691 177.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -141.01 60.52 1.51 Allowed 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 107.861 -1.163 . . . . 41.57 107.861 179.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 97.4 mt -66.81 -27.25 67.41 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 115.682 -0.69 . . . . 46.71 112.508 -169.077 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' CYS . . . . . 0.454 ' HB2' ' O ' ' B' ' 63' ' ' TRP . 63.7 m -83.7 -6.1 59.35 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 119.505 -0.878 . . . . 40.44 112.416 173.702 -73.305 169.068 87.936 105.126 2.03 102.428 47.946 -171.153 2 2 . 1 . 001 ecloud build full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 62.0 m-80 53.55 50.88 16.28 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 122.191 0.996 . . . . 64.68 111.838 177.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' ILE . . . . . 0.401 HD11 HD21 ' B' ' 83' ' ' LEU . 24.2 pt -139.0 154.57 72.69 Favored Pre-proline 0 C--O 1.24 0.594 0 CA-C-N 115.335 -0.848 . . . . 36.96 109.076 174.922 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -67.62 139.51 48.81 Favored 'Trans proline' 0 C--N 1.326 -0.627 0 N-CA-C 109.644 -0.945 . . . . 39.94 109.644 163.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 76.3 m -56.71 -30.32 63.36 Favored 'General case' 0 C--O 1.239 0.501 0 C-N-CA 118.931 -1.107 . . . . 33.7 111.83 179.795 -61.108 -63.916 92.183 106.656 2.033 102.667 88.45 63.286 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' SER . . . . . . . . . . . . . 93.6 p -59.11 -26.35 64.61 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.383 -0.527 . . . . 39.36 112.416 178.26 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.18 -26.82 68.56 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 119.815 -0.754 . . . . 38.51 111.42 176.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' LEU . . . . . 0.401 HD21 HD11 ' B' ' 78' ' ' ILE . 48.8 mt -75.13 -3.79 34.88 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 113.18 0.807 . . . . 38.29 113.18 178.746 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 84' ' ' LEU . . . . . . . . . . . . . 59.6 mt -103.67 0.93 31.28 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 113.281 0.845 . . . . 41.95 113.281 -178.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 30.7 t -69.38 158.48 35.02 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 122.016 0.912 . . . . 50.35 111.031 -178.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 53.1 p -68.39 -27.92 66.64 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.362 -0.835 . . . . 53.91 111.186 173.401 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -79.92 122.27 26.48 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 108.648 -0.871 . . . . 57.91 108.648 172.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' ILE . . . . . 0.628 HG12 ' O4 ' ' B' ' 210' ' ' RRE . 42.1 pt -87.4 9.23 2.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.4 0 CA-C-N 116.715 -0.22 . . . . 39.78 111.048 -170.086 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 89' ' ' THR . . . . . . . . . . . . . 58.4 m -52.15 -51.82 55.58 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.711 -0.396 . . . . 42.2 111.743 -176.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' ALA . . . . . . . . . . . . . . . -65.51 -39.69 92.14 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 120.062 -0.655 . . . . 36.57 111.563 -174.764 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' SER . . . . . . . . . . . . . 75.1 m -67.35 -38.11 84.3 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 119.96 -0.696 . . . . 37.31 111.005 179.885 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' VAL . . . . . 0.476 HG11 ' HB3' ' B' ' 15' ' ' HIS . 22.7 t -68.41 -48.39 72.99 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 C-N-CA 120.649 -0.421 . . . . 33.27 110.465 -178.367 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 93' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -63.62 -38.11 89.88 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 120.155 -0.618 . . . . 48.01 111.401 -179.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' CYS . . . . . . . . . . . . . 35.1 t -66.83 -41.16 87.92 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 119.845 -0.742 . . . . 37.92 111.078 176.425 -171.153 47.946 87.936 102.428 2.03 105.126 169.068 -73.305 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.48 -33.06 74.86 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 111.694 0.257 . . . . 31.41 111.694 179.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -62.67 -39.87 95.3 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 119.957 -0.697 . . . . 45.92 110.94 174.077 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -64.23 -45.65 87.26 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 119.84 -0.744 . . . . 53.53 111.014 174.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' ILE . . . . . . . . . . . . . 65.7 mt -57.8 -48.75 82.94 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 CA-C-O 121.05 0.453 . . . . 34.76 110.621 -179.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' VAL . . . . . . . . . . . . . 9.4 p -72.94 -6.29 7.82 Favored 'Isoleucine or valine' 0 C--O 1.238 0.467 0 N-CA-C 112.942 0.719 . . . . 38.81 112.942 -174.086 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' SER . . . . . 0.4 ' HA ' ' NH1' ' B' ' 21' ' ' ARG . 60.4 m -104.73 5.56 33.49 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 113.5 0.926 . . . . 48.91 113.5 -178.897 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 55.2 p30 -88.15 -20.88 25.02 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 113.925 1.083 . . . . 83.91 113.925 -170.85 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' GLY . . . . . . . . . . . . . . . 148.25 -31.3 1.29 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.429 -0.891 . . . . 58.61 115.121 -179.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -104.23 -1.14 27.53 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 113.499 0.926 . . . . 76.83 113.499 -178.272 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 104' ' ' GLY . . . . . . . . . . . . . . . 61.49 -151.47 43.23 Favored Glycine 0 C--O 1.236 0.231 0 C-N-CA 118.972 -1.585 . . . . 31.18 111.587 176.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 81.4 mtp -75.39 -2.16 27.25 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 117.674 -1.61 . . . . 28.76 113.197 -176.638 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' ASN . . . . . . . . . . . . . 72.3 m-80 -59.26 -18.24 35.58 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-N 119.084 0.856 . . . . 41.03 111.954 172.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -58.98 -25.75 63.87 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 120.591 -0.444 . . . . 32.62 111.722 174.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 22.6 m-90 -94.15 109.92 21.67 Favored 'General case' 0 C--O 1.237 0.442 0 N-CA-C 108.721 -0.844 . . . . 30.53 108.721 175.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 61.9 t -58.45 -42.88 85.46 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 CA-C-N 116.017 -0.538 . . . . 43.74 110.222 -177.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.21 -36.85 85.42 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 120.624 -0.43 . . . . 31.04 111.365 -177.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 111' ' ' TRP . . . . . 0.441 ' CD1' ' HB2' ' B' ' 115' ' ' CYS . 88.7 t90 -61.58 -46.35 90.23 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 119.074 -1.05 . . . . 30.44 110.695 174.149 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 112' ' ' ARG . . . . . . . . . . . . . 29.7 ttp-105 -62.45 -40.05 95.35 Favored 'General case' 0 C--O 1.239 0.548 0 C-N-CA 119.829 -0.748 . . . . 53.07 111.455 -176.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -87.69 -23.66 24.12 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 113.857 1.058 . . . . 35.46 113.857 -173.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' ARG . . . . . . . . . . . . . 64.6 mtp180 -127.97 -11.81 5.33 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 114.402 1.26 . . . . 37.45 114.402 -169.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 115' ' ' CYS . . . . . 0.441 ' HB2' ' CD1' ' B' ' 111' ' ' TRP . 64.5 m -119.31 -45.28 2.54 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 119.176 0.898 . . . . 34.85 112.772 179.634 -57.453 -73.409 -94.422 102.334 2.024 104.744 -89.521 -178.861 2 2 . 1 . 001 ecloud build full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 75.8 tttt -52.97 133.26 38.29 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 120.963 0.411 . . . . 34.87 110.769 -177.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . 69.92 5.89 54.12 Favored Glycine 0 N--CA 1.447 -0.62 0 N-CA-C 115.468 0.947 . . . . 42.95 115.468 177.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 118' ' ' THR . . . . . . . . . . . . . 69.8 p -97.12 175.67 6.22 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.774 1.287 . . . . 39.74 109.473 171.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 14.0 t0 -82.02 79.57 8.5 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 122.464 1.126 . . . . 55.12 108.138 176.573 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 17.9 m -70.62 -15.75 19.21 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 CA-C-N 115.271 -0.877 . . . . 38.54 113.027 -178.454 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 121' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 -61.89 -28.43 69.51 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 119.564 -0.854 . . . . 64.31 111.612 174.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.57 -27.15 62.41 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.174 -0.611 . . . . 45.01 112.002 178.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 123' ' ' TRP . . . . . 0.45 ' CD1' ' HB2' ' B' ' 30' ' ' CYS . 91.7 m95 -69.17 -17.8 63.85 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 112.942 0.719 . . . . 43.77 112.942 -177.419 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 124' ' ' ILE . . . . . . . . . . . . . 40.0 pt -119.5 4.72 6.75 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.181 0 CA-C-N 118.54 0.609 . . . . 45.49 112.293 179.591 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 125' ' ' ARG . . . . . 0.52 ' HD2' ' C ' ' B' ' 125' ' ' ARG . 4.4 tmm_? -60.0 136.8 58.12 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 120.337 -0.545 . . . . 59.17 110.189 176.591 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 126' ' ' GLY . . . . . 0.456 ' N ' ' HD2' ' B' ' 125' ' ' ARG . . . 80.09 -1.71 78.88 Favored Glycine 0 N--CA 1.447 -0.61 0 N-CA-C 115.3 0.88 . . . . 53.43 115.3 178.265 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 127' ' ' CYS . . . . . . . . . . . . . 79.6 m -90.53 130.47 36.57 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 118.584 1.192 . . . . 43.87 110.431 -177.058 -59.072 -51.527 -72.145 104.143 2.027 103.746 -51.299 -71.936 1 1 . 1 . 001 ecloud build full ' B' B ' 128' ' ' ARG . . . . . . . . . . . . . 14.5 ttp85 -81.86 113.83 20.06 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 107.551 -1.277 . . . . 75.15 107.551 164.366 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 60.0 mt . . . . . 0 C--N 1.327 -0.398 0 CA-C-N 116.536 -0.302 . . . . 71.3 110.71 -175.915 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' QEB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' QEB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' QEB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' QEB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' QEB . . . . . 0.594 ' O5 ' ' HG2' ' A' ' 70' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 217' ' ' QEB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' RRE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 201' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 202' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 203' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 204' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 205' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 206' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 207' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 208' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 209' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 210' ' ' RRE . . . . . 0.628 ' O4 ' HG12 ' B' ' 88' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 211' ' ' ACT . . . . . 0.511 ' H1 ' ' O ' ' B' ' 57' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . 0.709 ' O ' ' NH2' ' A' ' 61' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.402 ' O ' HG23 ' A' ' 40' ' ' THR . 80.1 tttt . . . . . 0 C--O 1.233 0.204 0 N-CA-C 112.273 0.471 . . . . 44.62 112.273 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 89.3 t -96.58 110.78 25.37 Favored 'Isoleucine or valine' 0 C--O 1.236 0.393 0 N-CA-C 107.379 -1.341 . . . . 41.64 107.379 172.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 29.9 m-85 -75.75 149.82 37.92 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-O 121.511 0.672 . . . . 41.99 111.315 179.129 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . -82.39 157.08 36.14 Favored Glycine 0 N--CA 1.444 -0.781 0 C-N-CA 120.474 -0.87 . . . . 43.48 111.412 162.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ARG . . . . . . . . . . . . . 12.7 ttt180 -47.86 -62.02 1.67 Allowed 'General case' 0 C--O 1.235 0.303 0 CA-C-O 121.295 0.569 . . . . 66.83 111.76 -176.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 67.5 m -72.07 -30.38 65.08 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 119.891 -0.724 . . . . 52.05 111.875 -176.102 -72.27 -54.698 -81.312 104.014 2.035 103.89 -45.772 -54.84 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 74.0 tt0 -60.29 -42.87 96.41 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 120.36 -0.536 . . . . 60.82 111.134 175.312 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LEU . . . . . 0.501 HD22 HD11 ' A' ' 55' ' ' ILE . 30.9 tp -67.26 -46.31 74.08 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 120.1 -0.64 . . . . 42.95 111.05 179.029 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.97 -47.64 71.14 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 120.47 -0.492 . . . . 42.88 111.238 179.682 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -59.65 -42.98 94.02 Favored 'General case' 0 C--O 1.236 0.391 0 C-N-CA 120.558 -0.457 . . . . 44.56 111.262 178.247 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -64.16 -46.72 82.82 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.274 -0.571 . . . . 40.09 111.134 178.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' MET . . . . . . . . . . . . . 29.7 mtt -59.44 -42.12 91.18 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.158 -0.617 . . . . 49.17 111.013 178.234 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 69.7 tttt -65.33 -41.74 93.62 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.294 -0.563 . . . . 46.62 111.195 178.483 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 3.7 mtp180 -61.14 -26.49 67.72 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.433 -0.507 . . . . 63.82 111.767 176.686 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' HIS . . . . . 0.622 ' HB3' HG11 ' A' ' 92' ' ' VAL . 63.3 m-70 -95.74 9.49 40.22 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 113.056 0.762 . . . . 49.52 113.056 -176.839 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 90.8 14.25 58.29 Favored Glycine 0 N--CA 1.448 -0.545 0 N-CA-C 115.925 1.13 . . . . 41.41 115.925 170.299 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 13.9 mt -84.01 -19.71 34.04 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 118.691 1.246 . . . . 36.49 113.974 -177.043 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ASP . . . . . . . . . . . . . 53.8 t0 -65.7 114.0 4.67 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-N 118.888 0.767 . . . . 62.12 109.974 -176.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 1.4 m120 67.01 17.33 10.49 Favored 'General case' 0 C--O 1.235 0.292 0 C-N-CA 123.169 0.587 . . . . 56.98 112.392 -177.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.506 ' CD1' ' HG2' ' A' ' 21' ' ' ARG . 43.8 t80 -62.84 125.78 25.12 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 119.689 -0.804 . . . . 38.8 108.874 173.366 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.506 ' HG2' ' CD1' ' A' ' 20' ' ' TYR . 27.4 mmm180 55.81 26.12 9.21 Favored 'General case' 0 C--O 1.233 0.213 0 CA-C-N 116.305 -0.407 . . . . 62.65 111.468 -174.991 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLY . . . . . . . . . . . . . . . 79.99 15.91 78.0 Favored Glycine 0 N--CA 1.446 -0.661 0 N-CA-C 115.622 1.009 . . . . 38.35 115.622 175.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' TYR . . . . . . . . . . . . . 82.7 m-85 -102.51 113.18 26.32 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 118.496 1.148 . . . . 35.95 108.516 178.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 89.2 p -62.05 161.13 11.3 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.961 0.886 . . . . 41.27 110.612 -179.216 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 46.0 tp -56.76 -37.29 70.84 Favored 'General case' 0 C--O 1.239 0.515 0 CA-C-N 114.833 -1.076 . . . . 39.21 111.716 -171.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -61.4 -31.31 76.91 Favored Glycine 0 C--N 1.333 0.365 0 C-N-CA 120.36 -0.924 . . . . 32.93 113.437 -177.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 61.0 m-80 -58.53 -42.6 88.16 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 119.713 -0.795 . . . . 42.46 110.781 175.973 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' TRP . . . . . . . . . . . . . 86.0 m95 -72.75 -35.9 67.59 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 121.097 -0.241 . . . . 33.78 111.175 -176.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 85.7 t -67.73 -46.8 81.88 Favored 'Isoleucine or valine' 0 C--O 1.239 0.508 0 CA-C-O 121.265 0.555 . . . . 30.86 110.084 177.378 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' CYS . . . . . . . . . . . . . 51.1 t -56.98 -49.36 75.98 Favored 'General case' 0 C--O 1.238 0.459 0 CA-C-O 120.99 0.424 . . . . 29.87 111.163 177.878 179.717 -90.74 -91.229 105.818 2.03 103.812 -75.979 -53.807 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -58.95 -46.03 89.03 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 119.991 -0.684 . . . . 28.33 111.113 -178.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -61.75 -38.83 89.41 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 120.494 -0.482 . . . . 34.35 111.628 -177.973 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 50.0 tptt -57.52 -49.82 75.07 Favored 'General case' 0 C--O 1.239 0.533 0 C-N-CA 120.565 -0.454 . . . . 39.8 111.415 178.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 27.7 m-85 -79.79 -24.25 41.59 Favored 'General case' 0 C--O 1.237 0.42 0 N-CA-C 112.882 0.697 . . . . 38.57 112.882 -176.467 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 65.6 mm-40 -78.97 -49.49 12.68 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 118.341 0.519 . . . . 36.55 111.253 178.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 80.7 p -124.44 -5.86 7.65 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 114.298 1.222 . . . . 33.01 114.298 -169.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ASN . . . . . . . . . . . . . 6.0 t-20 60.52 33.2 20.55 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 118.786 0.721 . . . . 44.42 110.946 -170.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.576 ' HA ' HD11 ' A' ' 55' ' ' ILE . 22.8 m-85 65.95 16.73 10.59 Favored 'General case' 0 C--O 1.236 0.35 0 N-CA-C 112.883 0.697 . . . . 38.75 112.883 179.42 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 40.7 t-20 -103.27 113.09 26.29 Favored 'General case' 0 C--O 1.233 0.228 0 N-CA-C 108.618 -0.882 . . . . 33.07 108.618 -175.396 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' THR . . . . . 0.402 HG23 ' O ' ' A' ' 1' ' ' LYS . 39.7 p -61.58 -21.15 64.06 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 112.753 0.649 . . . . 38.29 112.753 -179.479 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 40.1 mt-30 -94.84 14.07 22.66 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 113.004 0.742 . . . . 34.18 113.004 -175.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.09 136.13 49.92 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 121.358 0.599 . . . . 31.73 111.124 -178.174 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 76.6 p -137.67 144.56 41.88 Favored 'General case' 0 CA--C 1.519 -0.247 0 N-CA-C 108.767 -0.827 . . . . 34.09 108.767 173.317 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ASN . . . . . . . . . . . . . 64.5 m-80 -148.87 129.43 13.99 Favored 'General case' 0 C--N 1.329 -0.322 0 N-CA-C 108.376 -0.972 . . . . 40.34 108.376 175.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.537 ' NH2' ' O ' ' A' ' 49' ' ' GLY . 0.0 OUTLIER -81.71 132.62 35.3 Favored 'General case' 0 C--O 1.236 0.391 0 O-C-N 123.598 0.561 . . . . 57.72 110.009 178.615 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ASN . . . . . 0.639 ' OD1' ' ND2' ' A' ' 59' ' ' ASN . 30.6 m120 -87.36 166.99 14.44 Favored 'General case' 0 C--N 1.327 -0.392 0 CA-C-O 121.836 0.827 . . . . 47.91 110.091 177.393 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 2.1 p -64.18 -30.34 71.41 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 115.605 -0.725 . . . . 60.37 111.885 -178.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 48.2 p30 -80.2 5.0 15.73 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 113.275 0.843 . . . . 57.22 113.275 -176.255 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.537 ' O ' ' NH2' ' A' ' 45' ' ' ARG . . . 92.26 -14.48 64.48 Favored Glycine 0 N--CA 1.442 -0.926 0 CA-C-O 119.162 -0.799 . . . . 41.73 114.95 -177.021 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 87.2 p -73.46 175.45 6.98 Favored 'General case' 0 C--O 1.233 0.225 0 CA-C-N 118.331 1.065 . . . . 37.59 110.231 173.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 56.6 m -139.99 141.62 36.36 Favored 'General case' 0 C--O 1.233 0.214 0 CA-C-N 115.568 -0.742 . . . . 40.49 109.605 -177.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.597 ' OD1' ' ND2' ' A' ' 59' ' ' ASN . 77.7 m-20 -95.52 141.03 29.53 Favored 'General case' 0 C--O 1.234 0.282 0 N-CA-C 109.853 -0.425 . . . . 34.76 109.853 173.85 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.413 ' CD2' ' HB3' ' A' ' 80' ' ' CYS . 97.0 m-85 -130.05 129.73 44.01 Favored 'General case' 0 C--O 1.233 0.221 0 CA-C-N 116.249 -0.432 . . . . 32.36 111.626 -171.507 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 93.55 -169.75 30.44 Favored Glycine 0 N--CA 1.45 -0.399 0 CA-C-O 123.228 1.46 . . . . 28.86 116.083 161.764 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ILE . . . . . 0.576 HD11 ' HA ' ' A' ' 38' ' ' PHE . 8.9 tp -66.88 -19.48 25.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 CA-C-N 113.13 -1.535 . . . . 35.38 111.16 -176.83 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 43.2 mt -115.98 9.0 14.76 Favored 'General case' 0 C--O 1.236 0.348 0 O-C-N 121.714 -0.616 . . . . 33.57 112.275 -177.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLN . . . . . . . . . . . . . 23.7 mm-40 50.13 58.16 5.78 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-O 122.194 0.997 . . . . 31.19 111.036 173.101 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 51.8 mt -81.21 138.13 20.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.482 0 CA-C-N 114.56 -1.2 . . . . 31.73 109.36 -178.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.639 ' ND2' ' OD1' ' A' ' 46' ' ' ASN . 10.6 t-20 -95.85 137.49 34.84 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 115.854 -0.612 . . . . 48.68 112.12 -163.644 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 88.4 p -75.51 -9.53 58.65 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 113.117 0.784 . . . . 35.02 113.117 179.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ARG . . . . . 0.709 ' NH2' ' O ' ' A' ' 301' ' ' HOH . 25.3 tpt180 -61.77 -37.66 85.13 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.1 -0.64 . . . . 67.59 111.174 177.466 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 53.4 m95 -119.15 -37.55 3.18 Favored 'General case' 0 C--N 1.327 -0.391 0 N-CA-C 113.959 1.096 . . . . 65.27 113.959 -175.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' TRP . . . . . 0.454 ' CE2' HG12 ' A' ' 98' ' ' ILE . 87.5 m95 -107.87 -32.49 7.58 Favored 'General case' 0 CA--C 1.515 -0.401 0 N-CA-C 115.07 1.507 . . . . 39.72 115.07 -151.705 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' CYS . . . . . . . . . . . . . 28.5 p -137.09 170.14 16.61 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.887 0.851 . . . . 33.59 109.231 -178.963 61.306 88.074 93.06 102.392 2.029 103.067 -63.772 -59.727 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 24.3 t30 -112.23 125.92 54.68 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-N 115.408 -0.815 . . . . 42.67 109.243 -178.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 55.2 p30 -125.77 15.26 8.07 Favored 'General case' 0 C--O 1.239 0.546 0 N-CA-C 112.522 0.564 . . . . 39.51 112.522 173.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 59.77 21.37 55.1 Favored Glycine 0 C--N 1.335 0.479 0 N-CA-C 114.986 0.755 . . . . 46.81 114.986 175.286 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 28.5 ptt180 -139.41 0.42 1.87 Allowed 'General case' 0 C--O 1.235 0.337 0 CA-C-N 118.699 1.249 . . . . 40.2 111.516 176.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' THR . . . . . 0.442 HG22 ' HB3' ' A' ' 72' ' ' SER . 8.2 m -128.63 75.46 79.64 Favored Pre-proline 0 C--O 1.239 0.52 0 N-CA-C 107.112 -1.44 . . . . 46.01 107.112 174.776 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' PRO . . . . . 0.594 ' HG2' ' O5 ' ' A' ' 216' ' ' QEB . 19.4 Cg_endo -60.12 149.84 82.57 Favored 'Trans proline' 0 C--N 1.332 -0.31 0 CA-C-O 121.759 0.65 . . . . 49.16 111.663 -177.218 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' GLY . . . . . . . . . . . . . . . 66.69 15.74 64.73 Favored Glycine 0 N--CA 1.448 -0.539 0 C-N-CA 119.423 -1.37 . . . . 51.28 114.369 -178.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' SER . . . . . 0.442 ' HB3' HG22 ' A' ' 69' ' ' THR . 24.9 p -98.7 171.0 8.39 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 121.832 0.825 . . . . 44.08 109.713 174.461 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 78.3 mtp180 -117.15 175.52 5.56 Favored 'General case' 0 C--N 1.324 -0.511 0 CA-C-N 115.181 -0.918 . . . . 66.86 109.071 177.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 44.1 t-20 -139.52 61.88 1.54 Allowed 'General case' 0 CA--C 1.53 0.21 0 CA-C-O 122.706 1.241 . . . . 39.94 108.348 -174.798 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 99.1 mt -62.98 -28.19 69.93 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.566 -0.743 . . . . 47.61 112.453 -169.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 95.0 m -83.75 -6.25 59.39 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 119.565 -0.854 . . . . 39.19 112.578 175.389 -68.84 170.306 86.358 105.257 2.023 103.716 49.898 -169.286 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ASN . . . . . . . . . . . . . 64.8 m-80 53.84 54.37 9.93 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-O 121.703 0.763 . . . . 56.06 111.139 177.162 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 35.1 pt -147.65 147.6 28.08 Favored Pre-proline 0 C--O 1.237 0.436 0 N-CA-C 109.263 -0.643 . . . . 40.46 109.263 179.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_endo -63.05 138.37 67.22 Favored 'Trans proline' 0 C--N 1.328 -0.537 0 N-CA-C 109.758 -0.901 . . . . 39.62 109.758 166.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.413 ' HB3' ' CD2' ' A' ' 53' ' ' TYR . 84.9 m -56.65 -23.77 43.76 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 119.657 -0.817 . . . . 33.08 111.783 178.689 -59.727 -63.772 93.06 103.067 2.029 102.392 88.074 61.306 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 80.7 p -68.59 -28.83 67.28 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.391 -0.524 . . . . 35.8 112.007 -177.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -61.21 -22.59 64.91 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 120.27 -0.572 . . . . 40.11 111.957 176.686 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 47.7 mt -77.94 -3.22 40.77 Favored 'General case' 0 C--O 1.234 0.283 0 C-N-CA 123.673 0.789 . . . . 34.21 113.087 178.381 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LEU . . . . . . . . . . . . . 49.5 mt -104.73 0.58 28.44 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 118.598 0.635 . . . . 40.89 112.694 177.415 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' SER . . . . . . . . . . . . . 20.9 t -63.6 157.67 23.22 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 122.008 0.908 . . . . 52.28 110.947 -178.794 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 23.8 p -65.63 -26.65 67.91 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.341 -0.845 . . . . 45.06 111.149 169.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 22.9 t0 -83.82 121.67 27.64 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 108.544 -0.91 . . . . 57.21 108.544 174.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 27.7 pt -88.76 8.33 2.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.436 0 CA-C-O 120.595 0.236 . . . . 40.8 110.86 -169.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 85.4 m -54.89 -50.18 69.37 Favored 'General case' 0 C--O 1.237 0.418 0 C-N-CA 119.991 -0.684 . . . . 45.68 111.156 -177.514 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -59.15 -43.41 92.05 Favored 'General case' 0 C--O 1.237 0.417 0 C-N-CA 120.557 -0.457 . . . . 39.88 111.28 -176.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' SER . . . . . . . . . . . . . 15.8 m -68.27 -41.0 81.72 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.095 -0.642 . . . . 34.45 111.648 -179.258 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' VAL . . . . . 0.622 HG11 ' HB3' ' A' ' 15' ' ' HIS . 74.7 t -63.55 -49.9 80.56 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 C-N-CA 120.325 -0.55 . . . . 35.41 110.563 -179.561 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 91.6 m-20 -57.81 -40.78 80.77 Favored 'General case' 0 C--O 1.237 0.398 0 C-N-CA 119.717 -0.793 . . . . 51.46 111.211 -179.323 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' CYS . . . . . . . . . . . . . 24.2 t -71.15 -40.71 71.17 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.119 -0.633 . . . . 32.05 111.063 179.052 -169.286 49.898 86.358 103.716 2.023 105.257 170.306 -68.84 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -59.77 -38.2 81.18 Favored 'General case' 0 C--O 1.238 0.474 0 C-N-CA 119.926 -0.71 . . . . 32.13 111.095 175.999 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -59.36 -39.37 83.03 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 119.631 -0.828 . . . . 35.85 111.25 176.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 25.7 mttm -69.75 -38.26 76.74 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 120.471 -0.492 . . . . 47.7 111.351 179.051 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ILE . . . . . 0.454 HG12 ' CE2' ' A' ' 63' ' ' TRP . 86.1 mt -64.91 -47.7 87.19 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 CA-C-O 121.174 0.511 . . . . 34.27 110.463 179.796 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' VAL . . . . . 0.462 HG13 ' HG3' ' A' ' 21' ' ' ARG . 3.2 p -71.36 -12.11 15.7 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 O-C-N 121.848 -0.532 . . . . 42.4 112.234 -172.692 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' SER . . . . . . . . . . . . . 19.3 m -94.1 -6.22 45.53 Favored 'General case' 0 C--O 1.234 0.287 0 N-CA-C 113.314 0.857 . . . . 44.99 113.314 178.413 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 20.4 p-10 -78.53 9.91 3.61 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 113.233 0.827 . . . . 68.43 113.233 -171.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . 106.23 -19.41 37.42 Favored Glycine 0 N--CA 1.449 -0.484 0 CA-C-O 119.034 -0.87 . . . . 48.91 114.958 174.078 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 96.4 m-20 -98.9 1.62 45.85 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-N 118.529 1.164 . . . . 77.86 113.091 178.378 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' GLY . . . . . . . . . . . . . . . 57.42 -147.16 36.12 Favored Glycine 0 N--CA 1.45 -0.38 0 C-N-CA 119.873 -1.156 . . . . 35.15 110.536 178.172 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 52.1 mtp -80.51 3.77 20.51 Favored 'General case' 0 C--N 1.328 -0.352 0 N-CA-C 113.048 0.759 . . . . 30.4 113.048 -178.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -65.24 -17.97 64.93 Favored 'General case' 0 C--O 1.24 0.56 0 CA-C-N 118.961 0.801 . . . . 34.75 112.173 174.414 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -54.06 -26.81 28.75 Favored 'General case' 0 C--O 1.238 0.456 0 N-CA-C 111.865 0.32 . . . . 34.62 111.865 172.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' TRP . . . . . . . . . . . . . 20.5 m-90 -96.91 112.74 24.36 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 108.527 -0.916 . . . . 32.3 108.527 -179.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 39.4 t -61.73 -41.45 90.54 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 CA-C-N 116.079 -0.509 . . . . 38.45 110.763 -177.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -62.5 -42.98 99.87 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 119.775 -0.77 . . . . 28.81 111.209 -179.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' TRP . . . . . 0.48 ' CD1' ' HB2' ' A' ' 115' ' ' CYS . 90.9 t90 -59.51 -48.05 83.14 Favored 'General case' 0 C--O 1.239 0.511 0 C-N-CA 120.296 -0.562 . . . . 30.93 111.163 175.805 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 33.1 ttp-105 -56.32 -37.81 70.44 Favored 'General case' 0 C--O 1.239 0.525 0 CA-C-O 120.788 0.328 . . . . 59.55 111.662 -177.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ASN . . . . . . . . . . . . . 89.1 m-20 -98.21 -19.61 17.76 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 114.158 1.169 . . . . 37.42 114.158 -170.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 69.9 mtp180 -132.3 -9.46 3.32 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 114.977 1.473 . . . . 36.49 114.977 -172.656 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' CYS . . . . . 0.48 ' HB2' ' CD1' ' A' ' 111' ' ' TRP . 56.2 m -118.53 -47.01 2.56 Favored 'General case' 0 C--O 1.237 0.411 0 CA-C-N 119.211 0.914 . . . . 34.22 112.826 179.087 -53.807 -75.979 -91.229 103.812 2.03 105.818 -90.74 179.717 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 84.0 tttt -48.37 124.76 8.46 Favored 'General case' 0 C--O 1.233 0.234 0 CA-C-O 120.934 0.397 . . . . 37.54 110.736 176.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . 87.58 -10.41 69.81 Favored Glycine 0 N--CA 1.448 -0.533 0 N-CA-C 115.496 0.959 . . . . 53.77 115.496 175.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 3.3 p -91.47 176.62 6.49 Favored 'General case' 0 N--CA 1.45 -0.433 0 CA-C-N 118.54 1.17 . . . . 44.6 109.968 179.605 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -81.9 78.88 8.56 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 122.566 1.174 . . . . 70.56 108.252 174.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 27.0 m -67.59 -17.32 22.34 Favored 'Isoleucine or valine' 0 C--O 1.236 0.37 0 CA-C-N 115.138 -0.937 . . . . 42.04 112.364 -175.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' GLN . . . . . . . . . . . . . 1.9 tt0 -64.72 -24.62 67.63 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 119.91 -0.716 . . . . 95.13 112.162 177.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ALA . . . . . 0.451 ' HA ' ' HG3' ' A' ' 125' ' ' ARG . . . -59.2 -19.89 49.27 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 112.2 0.445 . . . . 49.11 112.2 175.661 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -76.25 -11.09 59.86 Favored 'General case' 0 C--O 1.235 0.292 0 N-CA-C 112.982 0.734 . . . . 45.94 112.982 179.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' ILE . . . . . . . . . . . . . 36.5 pt -121.02 3.57 6.5 Favored 'Isoleucine or valine' 0 C--O 1.238 0.473 0 N-CA-C 112.64 0.608 . . . . 50.5 112.64 178.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' ARG . . . . . 0.451 ' HG3' ' HA ' ' A' ' 122' ' ' ALA . 8.3 mtt180 -61.94 142.78 57.24 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 118.783 0.72 . . . . 61.83 110.27 176.449 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' GLY . . . . . . . . . . . . . . . 84.99 -26.04 5.67 Favored Glycine 0 N--CA 1.442 -0.919 0 N-CA-C 114.733 0.653 . . . . 64.35 114.733 -177.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' CYS . . . . . . . . . . . . . 58.5 m -67.6 136.27 54.19 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 118.088 0.944 . . . . 58.59 110.589 -179.548 -54.84 -45.772 -81.312 103.89 2.035 104.014 -54.698 -72.27 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -84.14 82.95 8.14 Favored 'General case' 0 N--CA 1.462 0.158 0 CA-C-O 122.406 1.098 . . . . 72.93 108.425 178.285 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' LEU . . . . . . . . . . . . . 3.6 mt . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 115.344 -0.844 . . . . 68.13 111.767 -175.775 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 59.2 tttp . . . . . 0 C--O 1.233 0.208 0 CA-C-O 120.62 0.248 . . . . 45.52 111.151 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 95.2 t -102.21 104.88 17.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.375 0 N-CA-C 107.653 -1.24 . . . . 45.99 107.653 175.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -72.65 145.75 47.05 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-O 121.661 0.743 . . . . 37.9 111.287 179.605 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' GLY . . . . . . . . . . . . . . . -71.72 159.77 53.88 Favored Glycine 0 N--CA 1.444 -0.8 0 C-N-CA 120.207 -0.997 . . . . 43.27 111.124 162.38 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' ARG . . . . . . . . . . . . . 62.4 ttp85 -58.84 -56.33 23.66 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-O 121.015 0.436 . . . . 52.39 111.199 -177.456 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' CYS . . . . . . . . . . . . . 68.5 m -69.96 -29.07 66.09 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 119.661 -0.815 . . . . 42.1 111.696 -179.911 -71.936 -51.299 -72.145 103.746 2.027 104.143 -51.527 -59.072 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' GLU . . . . . . . . . . . . . 73.0 tt0 -63.69 -41.55 98.12 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 120.063 -0.655 . . . . 52.13 111.241 178.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' LEU . . . . . . . . . . . . . 56.8 tp -72.11 -41.3 67.42 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 119.823 -0.751 . . . . 38.97 111.074 178.247 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -53.66 -44.94 70.07 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.118 -0.633 . . . . 36.88 110.871 175.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' ALA . . . . . . . . . . . . . . . -61.42 -47.91 83.62 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-O 120.86 0.362 . . . . 37.6 111.33 175.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' ALA . . . . . . . . . . . . . . . -61.29 -46.16 91.46 Favored 'General case' 0 C--O 1.237 0.428 0 CA-C-O 121.039 0.447 . . . . 36.67 111.167 -178.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' MET . . . . . . . . . . . . . 27.2 mtt -61.36 -39.13 89.48 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.146 -0.621 . . . . 35.97 111.127 178.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' LYS . . . . . . . . . . . . . 43.4 tptt -59.14 -51.28 70.7 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.393 -0.523 . . . . 56.48 110.646 175.288 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' ARG . . . . . . . . . . . . . 11.4 tpt180 -55.05 -35.43 64.49 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 120.366 -0.534 . . . . 71.32 111.116 177.9 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' HIS . . . . . 0.476 ' HB3' HG11 ' B' ' 92' ' ' VAL . 48.4 m-70 -85.74 2.84 43.87 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 113.134 0.79 . . . . 51.14 113.134 179.991 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' GLY . . . . . . . . . . . . . . . 84.96 36.27 11.53 Favored Glycine 0 C--O 1.237 0.282 0 N-CA-C 116.109 1.204 . . . . 42.85 116.109 168.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 92.7 mt -98.15 -9.02 26.45 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 118.086 0.943 . . . . 33.46 113.336 178.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' ASP . . . . . . . . . . . . . 38.3 t0 -68.85 108.42 3.45 Favored 'General case' 0 C--O 1.234 0.259 0 N-CA-C 108.765 -0.828 . . . . 42.98 108.765 179.999 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 1.6 t30 68.89 24.88 6.27 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 123.195 0.598 . . . . 53.96 112.286 -179.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' TYR . . . . . . . . . . . . . 61.8 t80 -67.72 121.12 15.27 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 108.789 -0.819 . . . . 44.15 108.789 172.085 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' ARG . . . . . 0.401 ' O ' ' HG2' ' B' ' 21' ' ' ARG . 22.4 mmm180 51.0 40.53 25.65 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 120.767 0.318 . . . . 43.63 111.708 -177.965 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' GLY . . . . . . . . . . . . . . . 79.59 9.49 86.8 Favored Glycine 0 N--CA 1.447 -0.619 0 N-CA-C 115.467 0.947 . . . . 36.13 115.467 -178.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -103.33 108.87 20.28 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 118.669 1.235 . . . . 29.97 108.714 -177.333 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' SER . . . . . . . . . . . . . 92.8 p -66.05 155.32 37.06 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-O 121.745 0.783 . . . . 35.14 110.663 -179.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' LEU . . . . . . . . . . . . . 33.7 tp -50.66 -39.24 50.3 Favored 'General case' 0 C--O 1.237 0.442 0 CA-C-N 115.118 -0.946 . . . . 30.87 112.415 -169.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' GLY . . . . . . . . . . . . . . . -57.37 -27.83 58.52 Favored Glycine 0 C--N 1.336 0.546 0 C-N-CA 120.243 -0.98 . . . . 31.13 113.247 -176.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' ASN . . . . . . . . . . . . . 60.6 m-80 -64.32 -40.8 96.64 Favored 'General case' 0 C--O 1.237 0.442 0 O-C-N 122.354 -0.498 . . . . 33.16 111.463 178.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' TRP . . . . . . . . . . . . . 79.8 m95 -74.44 -38.43 63.02 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 120.874 -0.33 . . . . 29.06 111.665 -177.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' VAL . . . . . . . . . . . . . 95.3 t -65.55 -43.84 94.09 Favored 'Isoleucine or valine' 0 C--O 1.24 0.578 0 C-N-CA 120.188 -0.605 . . . . 30.56 110.169 176.055 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' CYS . . . . . 0.45 ' HB2' ' CD1' ' B' ' 123' ' ' TRP . 53.0 t -58.34 -48.04 81.84 Favored 'General case' 0 C--O 1.237 0.421 0 O-C-N 122.143 -0.348 . . . . 28.47 110.845 177.784 -178.861 -89.521 -94.422 104.744 2.024 102.334 -73.409 -57.453 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.74 -45.8 92.37 Favored 'General case' 0 C--O 1.237 0.438 0 C-N-CA 120.171 -0.612 . . . . 26.26 111.387 -178.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -59.99 -41.49 92.17 Favored 'General case' 0 C--O 1.238 0.472 0 C-N-CA 120.214 -0.594 . . . . 27.03 111.166 179.644 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' LYS . . . . . . . . . . . . . 51.5 tptt -54.56 -52.7 61.26 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.396 -0.522 . . . . 55.59 111.386 178.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' PHE . . . . . . . . . . . . . 24.3 m-85 -82.4 -22.38 35.39 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 113.107 0.78 . . . . 40.09 113.107 -174.496 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' GLU . . . . . . . . . . . . . 53.8 mm-40 -76.7 -44.15 34.72 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 120.093 -0.643 . . . . 32.86 111.649 176.379 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' SER . . . . . . . . . . . . . 60.1 p -132.58 -4.27 3.31 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 114.44 1.274 . . . . 31.27 114.44 -170.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' ASN . . . . . . . . . . . . . 18.4 t30 59.28 36.49 23.63 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-N 119.593 1.088 . . . . 60.89 110.572 -171.521 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 64.54 18.75 11.53 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 124.387 1.075 . . . . 33.58 113.793 179.02 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' ASN . . . . . . . . . . . . . 41.9 t30 -102.24 118.39 36.79 Favored 'General case' 0 C--O 1.234 0.277 0 O-C-N 121.181 -0.95 . . . . 36.71 109.458 -176.606 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' THR . . . . . 0.482 HG22 ' CG2' ' B' ' 55' ' ' ILE . 72.3 p -68.97 -22.71 64.09 Favored 'General case' 0 C--O 1.239 0.513 0 C-N-CA 120.361 -0.536 . . . . 37.65 111.92 -177.971 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -89.9 11.76 19.39 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 112.978 0.733 . . . . 37.57 112.978 -176.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.04 134.88 48.73 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-O 121.584 0.707 . . . . 35.47 111.135 -178.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 52.2 p -134.37 149.27 50.81 Favored 'General case' 0 C--O 1.236 0.37 0 N-CA-C 108.725 -0.843 . . . . 38.32 108.725 169.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' ASN . . . . . . . . . . . . . 49.5 m-80 -146.0 120.44 9.67 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 109.136 -0.69 . . . . 36.73 109.136 177.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 16.2 tpp85 -78.87 130.13 35.31 Favored 'General case' 0 C--O 1.235 0.323 0 CA-C-N 115.828 -0.624 . . . . 45.89 109.981 179.047 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -93.06 157.52 16.25 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-O 121.531 0.681 . . . . 47.83 110.316 175.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' THR . . . . . . . . . . . . . 17.3 p -66.44 -23.67 66.33 Favored 'General case' 0 C--O 1.236 0.375 0 CA-C-N 115.609 -0.723 . . . . 61.43 112.312 -177.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 53.0 p30 -76.14 -5.0 44.68 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 112.664 0.616 . . . . 52.64 112.664 173.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' GLY . . . . . . . . . . . . . . . 99.54 -14.19 60.8 Favored Glycine 0 N--CA 1.446 -0.698 0 CA-C-O 119.078 -0.846 . . . . 44.1 114.842 -179.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' SER . . . . . . . . . . . . . 99.7 p -74.01 171.71 12.98 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-N 118.453 1.126 . . . . 37.07 109.837 173.789 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' THR . . . . . . . . . . . . . 49.9 m -135.2 141.55 45.88 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.41 -0.814 . . . . 37.04 109.204 -177.242 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 59.6 m-20 -98.09 140.59 32.19 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 109.567 -0.531 . . . . 44.69 109.567 173.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' TYR . . . . . . . . . . . . . 86.8 m-85 -129.49 136.41 49.84 Favored 'General case' 0 C--O 1.233 0.192 0 CA-C-N 116.468 -0.333 . . . . 33.77 111.645 -173.318 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 94.58 -174.89 33.82 Favored Glycine 0 CA--C 1.518 0.264 0 CA-C-O 123.157 1.42 . . . . 29.46 115.173 164.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' ILE . . . . . 0.482 ' CG2' HG22 ' B' ' 40' ' ' THR . 46.7 pt -59.37 -33.26 50.62 Favored 'Isoleucine or valine' 0 C--O 1.235 0.292 0 CA-C-N 113.83 -1.185 . . . . 38.03 111.282 -179.568 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 67.0 mt -106.59 10.6 31.09 Favored 'General case' 0 C--O 1.233 0.224 0 O-C-N 121.61 -0.681 . . . . 35.02 112.788 -179.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' GLN . . . . . 0.511 ' O ' ' H1 ' ' B' ' 211' ' ' ACT . 29.4 mm-40 50.66 54.21 11.59 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-O 121.865 0.841 . . . . 31.93 111.95 171.853 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' ILE . . . . . . . . . . . . . 50.4 mt -76.64 135.54 26.51 Favored 'Isoleucine or valine' 0 C--O 1.24 0.553 0 CA-C-N 115.068 -0.969 . . . . 33.45 109.446 -179.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' ASN . . . . . 0.415 ' OD1' ' HB3' ' B' ' 61' ' ' ARG . 7.5 t-20 -95.66 137.56 34.55 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 112.599 0.592 . . . . 50.07 112.599 -163.807 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' SER . . . . . . . . . . . . . 84.1 p -73.06 -14.93 61.5 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 115.467 -0.788 . . . . 35.39 112.734 -178.011 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' ARG . . . . . 0.426 ' HG3' ' CD1' ' B' ' 62' ' ' TRP . 52.3 tpt85 -55.21 -30.69 60.47 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.46 -0.496 . . . . 68.2 111.839 176.375 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' TRP . . . . . 0.426 ' CD1' ' HG3' ' B' ' 61' ' ' ARG . 98.8 m95 -132.65 -38.01 1.03 Allowed 'General case' 0 C--N 1.325 -0.465 0 N-CA-C 113.973 1.101 . . . . 62.68 113.973 -171.071 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' TRP . . . . . 0.454 ' O ' ' HB2' ' B' ' 76' ' ' CYS . 74.1 m95 -106.94 -20.25 13.38 Favored 'General case' 0 N--CA 1.451 -0.39 0 N-CA-C 114.629 1.344 . . . . 37.79 114.629 -155.809 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' CYS . . . . . . . . . . . . . 30.3 p -147.51 161.78 40.39 Favored 'General case' 0 C--O 1.237 0.445 0 CA-C-O 121.719 0.771 . . . . 32.95 109.086 -177.149 63.286 88.45 92.183 102.667 2.033 106.656 -63.916 -61.108 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -103.38 126.34 50.48 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.032 -0.985 . . . . 45.73 109.901 178.242 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' ASP . . . . . . . . . . . . . 55.7 p30 -123.63 3.83 8.93 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 113.021 0.748 . . . . 41.0 113.021 170.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' GLY . . . . . . . . . . . . . . . 68.95 11.2 62.93 Favored Glycine 0 C--N 1.334 0.454 0 N-CA-C 115.847 1.099 . . . . 37.83 115.847 177.084 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' ARG . . . . . . . . . . . . . 4.9 ptm85 -138.14 21.54 2.8 Favored 'General case' 0 C--O 1.237 0.415 0 CA-C-N 118.532 1.166 . . . . 57.73 112.214 -179.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' THR . . . . . . . . . . . . . 11.6 m -124.37 85.27 55.79 Favored Pre-proline 0 C--O 1.243 0.749 0 N-CA-C 108.149 -1.056 . . . . 39.64 108.149 177.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_exo -61.31 135.74 59.81 Favored 'Trans proline' 0 C--N 1.333 -0.26 0 C-N-CA 120.44 0.76 . . . . 50.44 112.282 -173.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . 78.66 8.76 87.54 Favored Glycine 0 N--CA 1.447 -0.613 0 N-CA-C 115.151 0.82 . . . . 47.62 115.151 178.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' SER . . . . . . . . . . . . . 81.0 p -89.0 170.4 10.69 Favored 'General case' 0 N--CA 1.452 -0.362 0 CA-C-N 118.354 1.077 . . . . 48.9 110.332 179.686 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 8.4 mmm180 -107.04 178.56 4.52 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.325 -0.852 . . . . 72.65 109.691 177.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 39.3 t30 -141.01 60.52 1.51 Allowed 'General case' 0 CA--C 1.534 0.353 0 N-CA-C 107.861 -1.163 . . . . 41.57 107.861 179.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' LEU . . . . . . . . . . . . . 97.4 mt -66.81 -27.25 67.41 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 115.682 -0.69 . . . . 46.71 112.508 -169.077 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' CYS . . . . . 0.454 ' HB2' ' O ' ' B' ' 63' ' ' TRP . 63.7 m -83.7 -6.1 59.35 Favored 'General case' 0 C--O 1.238 0.464 0 C-N-CA 119.505 -0.878 . . . . 40.44 112.416 173.702 -73.305 169.068 87.936 105.126 2.03 102.428 47.946 -171.153 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' ASN . . . . . . . . . . . . . 62.0 m-80 53.55 50.88 16.28 Favored 'General case' 0 N--CA 1.463 0.199 0 CA-C-O 122.191 0.996 . . . . 64.68 111.838 177.33 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' ILE . . . . . 0.401 HD11 HD21 ' B' ' 83' ' ' LEU . 24.2 pt -139.0 154.57 72.69 Favored Pre-proline 0 C--O 1.24 0.594 0 CA-C-N 115.335 -0.848 . . . . 36.96 109.076 174.922 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -67.62 139.51 48.81 Favored 'Trans proline' 0 C--N 1.326 -0.627 0 N-CA-C 109.644 -0.945 . . . . 39.94 109.644 163.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 76.3 m -56.71 -30.32 63.36 Favored 'General case' 0 C--O 1.239 0.501 0 C-N-CA 118.931 -1.107 . . . . 33.7 111.83 179.795 -61.108 -63.916 92.183 106.656 2.033 102.667 88.45 63.286 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' SER . . . . . . . . . . . . . 93.6 p -59.11 -26.35 64.61 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.383 -0.527 . . . . 39.36 112.416 178.26 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' ALA . . . . . . . . . . . . . . . -62.18 -26.82 68.56 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 119.815 -0.754 . . . . 38.51 111.42 176.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.401 HD21 HD11 ' B' ' 78' ' ' ILE . 48.8 mt -75.13 -3.79 34.88 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 113.18 0.807 . . . . 38.29 113.18 178.746 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' LEU . . . . . . . . . . . . . 59.6 mt -103.67 0.93 31.28 Favored 'General case' 0 C--O 1.237 0.436 0 N-CA-C 113.281 0.845 . . . . 41.95 113.281 -178.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' SER . . . . . . . . . . . . . 30.7 t -69.38 158.48 35.02 Favored 'General case' 0 C--O 1.234 0.276 0 CA-C-O 122.016 0.912 . . . . 50.35 111.031 -178.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' SER . . . . . . . . . . . . . 53.1 p -68.39 -27.92 66.64 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 115.362 -0.835 . . . . 53.91 111.186 173.401 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' ASP . . . . . . . . . . . . . 8.4 t0 -79.92 122.27 26.48 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 108.648 -0.871 . . . . 57.91 108.648 172.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' ILE . . . . . 0.628 HG12 ' O4 ' ' B' ' 210' ' ' RRE . 42.1 pt -87.4 9.23 2.01 Favored 'Isoleucine or valine' 0 C--O 1.237 0.4 0 CA-C-N 116.715 -0.22 . . . . 39.78 111.048 -170.086 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' THR . . . . . . . . . . . . . 58.4 m -52.15 -51.82 55.58 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.711 -0.396 . . . . 42.2 111.743 -176.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' ALA . . . . . . . . . . . . . . . -65.51 -39.69 92.14 Favored 'General case' 0 C--O 1.234 0.267 0 C-N-CA 120.062 -0.655 . . . . 36.57 111.563 -174.764 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' SER . . . . . . . . . . . . . 75.1 m -67.35 -38.11 84.3 Favored 'General case' 0 C--O 1.239 0.515 0 C-N-CA 119.96 -0.696 . . . . 37.31 111.005 179.885 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' VAL . . . . . 0.476 HG11 ' HB3' ' B' ' 15' ' ' HIS . 22.7 t -68.41 -48.39 72.99 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 C-N-CA 120.649 -0.421 . . . . 33.27 110.465 -178.367 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' ASN . . . . . . . . . . . . . 94.9 m-20 -63.62 -38.11 89.88 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 120.155 -0.618 . . . . 48.01 111.401 -179.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' CYS . . . . . . . . . . . . . 35.1 t -66.83 -41.16 87.92 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 119.845 -0.742 . . . . 37.92 111.078 176.425 -171.153 47.946 87.936 102.428 2.03 105.126 169.068 -73.305 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' ALA . . . . . . . . . . . . . . . -66.48 -33.06 74.86 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 111.694 0.257 . . . . 31.41 111.694 179.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -62.67 -39.87 95.3 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 119.957 -0.697 . . . . 45.92 110.94 174.077 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -64.23 -45.65 87.26 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 119.84 -0.744 . . . . 53.53 111.014 174.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' ILE . . . . . . . . . . . . . 65.7 mt -57.8 -48.75 82.94 Favored 'Isoleucine or valine' 0 C--O 1.236 0.356 0 CA-C-O 121.05 0.453 . . . . 34.76 110.621 -179.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' VAL . . . . . . . . . . . . . 9.4 p -72.94 -6.29 7.82 Favored 'Isoleucine or valine' 0 C--O 1.238 0.467 0 N-CA-C 112.942 0.719 . . . . 38.81 112.942 -174.086 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' SER . . . . . 0.4 ' HA ' ' NH1' ' B' ' 21' ' ' ARG . 60.4 m -104.73 5.56 33.49 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 113.5 0.926 . . . . 48.91 113.5 -178.897 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' ASP . . . . . . . . . . . . . 55.2 p30 -88.15 -20.88 25.02 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 113.925 1.083 . . . . 83.91 113.925 -170.85 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' GLY . . . . . . . . . . . . . . . 148.25 -31.3 1.29 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.429 -0.891 . . . . 58.61 115.121 -179.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 88.2 m-20 -104.23 -1.14 27.53 Favored 'General case' 0 C--O 1.237 0.4 0 N-CA-C 113.499 0.926 . . . . 76.83 113.499 -178.272 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' GLY . . . . . . . . . . . . . . . 61.49 -151.47 43.23 Favored Glycine 0 C--O 1.236 0.231 0 C-N-CA 118.972 -1.585 . . . . 31.18 111.587 176.202 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' MET . . . . . . . . . . . . . 81.4 mtp -75.39 -2.16 27.25 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 117.674 -1.61 . . . . 28.76 113.197 -176.638 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' ASN . . . . . . . . . . . . . 72.3 m-80 -59.26 -18.24 35.58 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-N 119.084 0.856 . . . . 41.03 111.954 172.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -58.98 -25.75 63.87 Favored 'General case' 0 C--O 1.235 0.298 0 C-N-CA 120.591 -0.444 . . . . 32.62 111.722 174.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' TRP . . . . . . . . . . . . . 22.6 m-90 -94.15 109.92 21.67 Favored 'General case' 0 C--O 1.237 0.442 0 N-CA-C 108.721 -0.844 . . . . 30.53 108.721 175.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' VAL . . . . . . . . . . . . . 61.9 t -58.45 -42.88 85.46 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 CA-C-N 116.017 -0.538 . . . . 43.74 110.222 -177.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' ALA . . . . . . . . . . . . . . . -64.21 -36.85 85.42 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 120.624 -0.43 . . . . 31.04 111.365 -177.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' TRP . . . . . 0.441 ' CD1' ' HB2' ' B' ' 115' ' ' CYS . 88.7 t90 -61.58 -46.35 90.23 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 119.074 -1.05 . . . . 30.44 110.695 174.149 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' ARG . . . . . . . . . . . . . 29.7 ttp-105 -62.45 -40.05 95.35 Favored 'General case' 0 C--O 1.239 0.548 0 C-N-CA 119.829 -0.748 . . . . 53.07 111.455 -176.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' ASN . . . . . . . . . . . . . 94.8 m-20 -87.69 -23.66 24.12 Favored 'General case' 0 CA--C 1.515 -0.369 0 N-CA-C 113.857 1.058 . . . . 35.46 113.857 -173.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' ARG . . . . . . . . . . . . . 64.6 mtp180 -127.97 -11.81 5.33 Favored 'General case' 0 C--O 1.235 0.321 0 N-CA-C 114.402 1.26 . . . . 37.45 114.402 -169.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' CYS . . . . . 0.441 ' HB2' ' CD1' ' B' ' 111' ' ' TRP . 64.5 m -119.31 -45.28 2.54 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 119.176 0.898 . . . . 34.85 112.772 179.634 -57.453 -73.409 -94.422 102.334 2.024 104.744 -89.521 -178.861 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' LYS . . . . . . . . . . . . . 75.8 tttt -52.97 133.26 38.29 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 120.963 0.411 . . . . 34.87 110.769 -177.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' GLY . . . . . . . . . . . . . . . 69.92 5.89 54.12 Favored Glycine 0 N--CA 1.447 -0.62 0 N-CA-C 115.468 0.947 . . . . 42.95 115.468 177.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' THR . . . . . . . . . . . . . 69.8 p -97.12 175.67 6.22 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.774 1.287 . . . . 39.74 109.473 171.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' ASP . . . . . . . . . . . . . 14.0 t0 -82.02 79.57 8.5 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-O 122.464 1.126 . . . . 55.12 108.138 176.573 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' VAL . . . . . . . . . . . . . 17.9 m -70.62 -15.75 19.21 Favored 'Isoleucine or valine' 0 C--O 1.235 0.304 0 CA-C-N 115.271 -0.877 . . . . 38.54 113.027 -178.454 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' GLN . . . . . . . . . . . . . 10.7 mm-40 -61.89 -28.43 69.51 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 119.564 -0.854 . . . . 64.31 111.612 174.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' ALA . . . . . . . . . . . . . . . -57.57 -27.15 62.41 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.174 -0.611 . . . . 45.01 112.002 178.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' TRP . . . . . 0.45 ' CD1' ' HB2' ' B' ' 30' ' ' CYS . 91.7 m95 -69.17 -17.8 63.85 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 112.942 0.719 . . . . 43.77 112.942 -177.419 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' ILE . . . . . . . . . . . . . 40.0 pt -119.5 4.72 6.75 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.181 0 CA-C-N 118.54 0.609 . . . . 45.49 112.293 179.591 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' ARG . . . . . 0.52 ' HD2' ' C ' ' B' ' 125' ' ' ARG . 4.4 tmm_? -60.0 136.8 58.12 Favored 'General case' 0 C--O 1.234 0.272 0 C-N-CA 120.337 -0.545 . . . . 59.17 110.189 176.591 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' GLY . . . . . 0.456 ' N ' ' HD2' ' B' ' 125' ' ' ARG . . . 80.09 -1.71 78.88 Favored Glycine 0 N--CA 1.447 -0.61 0 N-CA-C 115.3 0.88 . . . . 53.43 115.3 178.265 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' CYS . . . . . . . . . . . . . 79.6 m -90.53 130.47 36.57 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 118.584 1.192 . . . . 43.87 110.431 -177.058 -59.072 -51.527 -72.145 104.143 2.027 103.746 -51.299 -71.936 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' ARG . . . . . . . . . . . . . 14.5 ttp85 -81.86 113.83 20.06 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 107.551 -1.277 . . . . 75.15 107.551 164.366 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' LEU . . . . . . . . . . . . . 60.0 mt . . . . . 0 C--N 1.327 -0.398 0 CA-C-N 116.536 -0.302 . . . . 71.3 110.71 -175.915 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' QEB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' QEB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' QEB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' QEB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' QEB . . . . . 0.594 ' O5 ' ' HG2' ' A' ' 70' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' QEB . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' RRE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 202' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 203' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 204' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 205' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 206' ' ' ' CL' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 207' ' ' ' NA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 208' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 209' ' ' ' RE' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 210' ' ' RRE . . . . . 0.628 ' O4 ' HG12 ' B' ' 88' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 211' ' ' ACT . . . . . 0.511 ' H1 ' ' O ' ' B' ' 57' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . 0.709 ' O ' ' NH2' ' A' ' 61' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_