data_6lxr_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 6lxr _Structure_validation_residue.Date_analyzed 2020-09-04 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 ' 5' ' ' PHE . . . . . . . . . . . . . 6.1 t80 . . . . . 0 N--CA 1.469 0.52 0 N-CA-C 113.014 0.746 . . . . 70.23 113.014 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -83.75 128.0 34.21 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 108.345 -0.983 . . . . 58.48 108.345 173.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.5 p -122.01 -29.86 4.18 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 116.204 1.927 . . . . 57.37 116.204 -164.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ARG . . . . . . . . . . . . . 10.6 ttt85 -139.74 172.6 12.55 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 120.853 1.661 . . . . 62.27 110.029 179.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 2.4 t -124.92 98.98 5.63 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 N-CA-C 106.267 -1.753 . . . . 37.53 106.267 -172.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 1.7 mp -97.28 133.39 39.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 109.111 -0.7 . . . . 48.43 109.111 -176.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.2 p -87.74 26.21 1.35 Allowed 'General case' 0 C--O 1.242 0.666 0 C-N-CA 123.493 0.717 . . . . 30.92 112.908 168.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -152.45 170.92 7.31 Favored Pre-proline 0 C--O 1.234 0.269 0 N-CA-C 108.52 -0.919 . . . . 29.14 108.52 -170.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -73.98 156.39 47.67 Favored 'Trans proline' 0 C--N 1.331 -0.367 0 CA-C-O 122.392 0.914 . . . . 31.82 111.186 173.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LYS . . . . . 0.787 ' NZ ' ' OD2' ' A' ' 40' ' ' ASP . 7.2 ttpm? -76.58 140.49 41.08 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.046 -0.979 . . . . 54.23 110.773 -178.118 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 41.4 t -79.81 112.95 18.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 107.691 -1.226 . . . . 40.06 107.691 173.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 36.1 m -85.93 -51.5 6.33 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 124.969 1.307 . . . . 49.19 112.03 -178.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 23.4 mmtm -126.81 162.31 26.17 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 107.4 -1.333 . . . . 47.91 107.4 -179.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -129.59 139.18 51.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.482 -0.781 . . . . 39.25 109.488 175.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 17.2 m -136.35 171.43 16.9 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 N-CA-C 107.32 -1.363 . . . . 33.85 107.32 176.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 33.9 p90 -144.07 156.72 44.48 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.338 0.59 . . . . 38.52 110.027 179.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.2 m-30 -114.83 150.18 35.9 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 114.547 -1.206 . . . . 36.8 108.796 164.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.6 mttt -116.8 123.22 46.6 Favored 'General case' 0 C--O 1.241 0.621 0 N-CA-C 107.933 -1.136 . . . . 51.4 107.933 166.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 27.5 mm -98.24 132.42 43.29 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 CA-C-N 116.007 -0.542 . . . . 39.7 109.694 -166.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.4 p -112.07 137.42 50.13 Favored 'General case' 0 C--O 1.237 0.443 0 N-CA-C 109.181 -0.674 . . . . 40.4 109.181 166.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 93.2 mt -123.56 107.74 19.57 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.569 0 N-CA-C 106.236 -1.764 . . . . 40.81 106.236 -179.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 61.21 40.38 14.7 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.745 0.783 . . . . 36.68 110.736 -179.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 80.7 4.53 90.26 Favored Glycine 0 N--CA 1.44 -1.092 0 CA-C-O 118.823 -0.987 . . . . 50.14 115.106 179.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -116.52 140.49 49.32 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 119.107 1.454 . . . . 59.34 111.209 -179.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -62.82 129.5 40.73 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-N 114.76 -1.109 . . . . 80.6 109.883 -178.78 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -119.84 -3.75 10.22 Favored 'General case' 0 CA--C 1.512 -0.494 0 N-CA-C 112.948 0.721 . . . . 45.02 112.948 -175.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 118.37 -178.52 16.81 Favored Glycine 0 N--CA 1.442 -0.923 0 CA-C-O 122.386 0.992 . . . . 36.17 112.037 175.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 30.2 m -113.77 150.33 33.58 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.125 -1.038 . . . . 37.09 109.65 -173.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 84.2 mt -128.56 123.9 60.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 106.433 -1.692 . . . . 36.13 106.433 176.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 58.3 mttt -105.7 138.32 42.09 Favored 'General case' 0 C--O 1.239 0.547 0 N-CA-C 109.529 -0.545 . . . . 56.52 109.529 -178.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -122.22 144.94 48.66 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.43 -0.804 . . . . 29.26 109.007 -175.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -112.71 129.43 8.97 Favored Glycine 0 N--CA 1.446 -0.678 0 N-CA-C 109.654 -1.379 . . . . 28.73 109.654 166.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.0 mt -97.88 146.37 25.51 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 123.0 0.52 . . . . 34.23 110.651 -178.03 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -95.99 65.35 2.48 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 122.702 1.239 . . . . 30.66 109.412 -177.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -62.88 -23.18 65.35 Favored Glycine 0 C--O 1.241 0.556 0 CA-C-N 114.458 -1.246 . . . . 37.6 114.492 -173.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ASP . . . . . 0.787 ' OD2' ' NZ ' ' A' ' 14' ' ' LYS . 23.5 m-20 -73.66 -28.59 61.85 Favored 'General case' 0 C--O 1.241 0.628 0 C-N-CA 119.398 -0.921 . . . . 51.5 112.078 177.427 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -102.2 -41.58 6.34 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 112.699 0.629 . . . . 37.6 112.699 -170.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 1.4 m -125.67 78.29 68.97 Favored Pre-proline 0 C--O 1.237 0.42 0 N-CA-C 107.663 -1.236 . . . . 36.03 107.663 172.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -69.58 -46.45 1.29 Allowed 'Trans proline' 0 C--O 1.235 0.354 0 N-CA-C 114.338 0.861 . . . . 34.62 114.338 -174.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 55.3 mttm -62.1 -35.6 79.17 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 119.516 -0.874 . . . . 45.89 111.057 179.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 15.3 m -74.11 -36.06 64.19 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 119.914 -0.714 . . . . 35.22 110.76 179.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.77 -37.0 67.78 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 119.675 -0.81 . . . . 32.66 110.55 178.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 44.4 tp10 -67.25 -45.96 75.13 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 119.944 -0.702 . . . . 35.69 111.058 179.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -49.06 -53.1 21.8 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-O 120.976 0.417 . . . . 34.31 110.825 174.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -65.11 -33.49 76.14 Favored 'General case' 0 C--O 1.239 0.506 0 C-N-CA 120.556 -0.458 . . . . 30.67 111.31 -175.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 38.8 ttp85 -72.11 -48.98 39.83 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-O 120.852 0.358 . . . . 31.03 111.1 -175.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.75 -16.63 64.38 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 112.561 0.578 . . . . 36.84 112.561 176.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 85.2 mt -80.77 -20.22 43.13 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 117.927 -1.509 . . . . 32.44 111.948 169.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 71.6 m -80.9 -27.1 36.35 Favored 'General case' 0 CA--C 1.514 -0.421 0 C-N-CA 120.198 -0.601 . . . . 32.0 111.977 174.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 60.1 p -87.29 -33.94 19.06 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 112.755 0.65 . . . . 39.35 112.755 177.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 77.63 6.31 86.76 Favored Glycine 0 N--CA 1.444 -0.798 0 CA-C-O 119.563 -0.576 . . . . 32.37 113.393 -170.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' GLU . . . . . 0.639 ' OE1' ' O ' ' A' ' 203' ' ' HOH . 7.4 pt-20 -61.69 -17.49 55.83 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 113.005 0.743 . . . . 42.53 113.005 -170.26 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 12.0 mmtt -86.72 0.16 55.18 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 112.66 0.615 . . . . 45.83 112.66 -177.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 73.99 -139.37 26.01 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 118.909 -1.615 . . . . 41.75 112.384 175.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 2.4 tpp -98.72 133.68 42.7 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 124.105 0.962 . . . . 45.63 109.979 -164.649 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -84.59 176.39 51.13 Favored Glycine 0 N--CA 1.444 -0.831 0 CA-C-O 122.454 1.03 . . . . 37.5 112.501 -176.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -63.15 -16.38 59.86 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 114.642 -0.779 . . . . 44.21 111.878 177.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 95.7 mt -99.15 6.47 46.42 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 113.152 0.797 . . . . 35.06 113.152 -174.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 83.14 14.54 74.41 Favored Glycine 0 N--CA 1.444 -0.805 0 C-N-CA 119.79 -1.195 . . . . 40.91 114.933 174.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' LYS . . . . . . . . . . . . . 14.6 mmtp -121.82 159.36 51.45 Favored Pre-proline 0 C--O 1.24 0.57 0 CA-C-N 117.985 0.893 . . . . 42.18 110.683 171.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -59.92 140.43 92.87 Favored 'Trans proline' 0 CA--C 1.518 -0.321 0 C-N-CA 120.047 0.498 . . . . 35.14 110.865 171.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 73.1 mt -78.86 81.03 5.18 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 107.421 -1.326 . . . . 39.34 107.421 164.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -164.75 123.88 1.83 Allowed 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 108.911 -0.774 . . . . 34.9 108.911 -164.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -70.49 -21.04 62.81 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 112.651 0.612 . . . . 27.37 112.651 -177.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 20.1 tttt -60.21 121.82 12.9 Favored 'General case' 0 C--O 1.234 0.262 0 O-C-N 123.626 0.579 . . . . 37.3 110.684 -172.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 98.28 -12.61 63.48 Favored Glycine 0 N--CA 1.438 -1.189 0 CA-C-O 118.659 -1.078 . . . . 28.52 114.621 -177.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.5 p -77.6 149.96 78.67 Favored Pre-proline 0 C--N 1.354 0.769 0 C-N-CA 118.16 -1.416 . . . . 34.26 110.204 179.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_endo -93.7 167.08 2.18 Favored 'Trans proline' 0 C--N 1.328 -0.513 0 C-N-CA 121.105 1.203 . . . . 31.02 112.492 -178.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 30.2 m-85 -88.6 94.35 9.86 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 106.399 -1.704 . . . . 28.32 106.399 160.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 30.2 p80 -84.6 -12.77 53.37 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 113.595 0.961 . . . . 27.13 113.595 -169.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 11.5 ttt-85 -147.62 114.24 6.02 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.492 -1.299 . . . . 48.23 107.492 -178.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' VAL . . . . . . . . . . . . . 46.9 t -129.06 113.43 28.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 107.441 -1.318 . . . . 28.36 107.441 -174.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 3.9 mt -118.57 115.65 35.42 Favored Pre-proline 0 C--N 1.328 -0.362 0 C-N-CA 122.934 0.494 . . . . 33.79 109.695 -177.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -66.49 146.26 79.38 Favored 'Trans proline' 0 C--N 1.321 -0.877 0 CA-C-N 119.51 0.861 . . . . 34.37 112.084 -179.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 73.6 m-80 62.81 27.11 15.92 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.111 -0.95 . . . . 39.42 112.322 -172.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -145.47 -87.18 0.11 Allowed 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 109.869 -0.419 . . . . 33.44 109.869 176.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -160.41 166.49 29.2 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.895 0.855 . . . . 27.57 109.871 -175.736 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 21.3 pt -115.1 147.12 18.72 Favored 'Isoleucine or valine' 0 C--O 1.242 0.676 0 N-CA-C 105.735 -1.95 . . . . 27.75 105.735 167.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -139.91 139.01 36.09 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.939 -0.573 . . . . 26.43 110.376 -173.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -156.58 -147.53 4.79 Favored Glycine 0 C--O 1.226 -0.365 0 N-CA-C 110.535 -1.026 . . . . 26.21 110.535 173.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 82.2 21.82 60.09 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 119.417 -1.373 . . . . 27.64 115.568 -179.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 56.6 t0 -87.78 100.74 13.08 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 107.002 -1.481 . . . . 35.74 107.002 171.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 25.9 pt -102.03 -3.84 9.39 Favored 'Isoleucine or valine' 0 C--O 1.239 0.5 0 CA-C-N 115.217 -0.901 . . . . 34.47 112.464 -170.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 37.0 p -100.49 -83.87 0.43 Allowed 'General case' 0 C--O 1.234 0.25 0 N-CA-C 109.499 -0.556 . . . . 39.62 109.499 174.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 92.4 p -81.82 -10.09 59.43 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 117.069 -1.853 . . . . 45.86 113.419 -178.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 64.02 16.72 60.13 Favored Glycine 0 N--CA 1.451 -0.364 0 N-CA-C 115.604 1.001 . . . . 44.2 115.604 173.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 20.4 p30 -118.86 6.34 11.45 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 118.685 1.243 . . . . 48.63 112.821 -178.502 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 99.67 -5.51 58.44 Favored Glycine 0 N--CA 1.444 -0.769 0 CA-C-O 118.821 -0.988 . . . . 34.38 114.783 179.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -106.04 -15.74 14.81 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 118.622 1.211 . . . . 38.16 112.671 176.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -92.17 -145.83 16.9 Favored Glycine 0 N--CA 1.444 -0.793 0 CA-C-O 121.913 0.729 . . . . 34.97 112.886 -174.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 107.44 149.73 15.67 Favored Glycine 0 N--CA 1.443 -0.882 0 C-N-CA 119.922 -1.133 . . . . 41.93 111.835 -173.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' GLU . . . . . 0.606 ' OE2' ' O ' ' A' ' 204' ' ' HOH . 84.7 tt0 -156.86 140.28 15.75 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 107.677 -1.231 . . . . 50.52 107.677 -179.79 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -90.09 170.87 9.96 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.848 0.832 . . . . 37.04 111.006 175.412 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 34.6 pt -81.21 5.64 1.56 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.487 0 CA-C-N 115.388 -0.824 . . . . 36.71 112.266 177.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -106.96 22.67 15.61 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 112.473 0.546 . . . . 46.91 112.473 -178.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' GLY . . . . . 0.662 ' O ' ' O ' ' A' ' 202' ' ' HOH . . . 82.18 -33.66 2.68 Favored Glycine 0 N--CA 1.442 -0.955 0 CA-C-N 118.082 0.401 . . . . 60.38 114.067 178.79 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 18.3 p -151.63 -179.57 7.53 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.17 -1.048 . . . . 52.2 108.17 -175.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 33.2 mmtt -67.06 131.18 45.31 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.909 -0.587 . . . . 47.3 109.896 177.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 3.3 p90 -102.49 163.71 12.07 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.997 0.903 . . . . 37.97 110.292 -177.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -71.28 152.05 43.65 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.627 -1.17 . . . . 45.73 110.827 -173.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -58.74 122.22 12.99 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 115.44 -0.8 . . . . 47.6 109.319 172.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -71.7 -54.99 8.55 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 120.071 -0.652 . . . . 42.26 111.513 -176.002 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 4.2 t -164.62 142.31 6.55 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 120.336 -0.546 . . . . 37.32 109.849 -173.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -105.6 19.48 20.49 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 123.422 0.689 . . . . 36.81 112.562 -179.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 43.4 mttm -83.89 -24.49 30.79 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 113.293 0.849 . . . . 48.7 113.293 -170.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 36.0 mt -88.99 118.83 35.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 107.032 -1.47 . . . . 32.89 107.032 168.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 2.1 p -102.33 170.22 8.21 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.46 0.648 . . . . 37.36 110.364 -169.447 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 73.6 m80 -88.0 65.14 8.13 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 122.576 1.179 . . . . 34.37 110.883 -173.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -81.88 -22.29 36.97 Favored 'General case' 0 C--O 1.24 0.584 0 C-N-CA 118.359 -1.336 . . . . 46.63 113.308 -163.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -159.72 -175.45 30.7 Favored Glycine 0 N--CA 1.442 -0.955 0 CA-C-N 118.678 0.672 . . . . 32.72 111.91 -178.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -69.47 164.09 35.56 Favored 'Trans proline' 0 C--N 1.328 -0.533 0 CA-C-O 121.876 0.698 . . . . 30.66 111.666 178.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 77.39 20.59 74.58 Favored Glycine 0 C--N 1.335 0.507 0 CA-C-N 115.0 -1.0 . . . . 31.28 114.96 173.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 73.1 mt -95.8 135.22 37.8 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-N 118.728 1.264 . . . . 29.18 109.676 175.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 5.4 mt -81.09 128.77 34.1 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.64 -0.709 . . . . 28.36 109.416 168.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 47.6 t -143.78 154.8 43.81 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.399 0.618 . . . . 29.8 109.798 178.089 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 95.4 mmm -81.98 123.83 29.23 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.279 -0.873 . . . . 30.84 110.486 -176.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' ALA . . . . . 0.677 ' O ' ' O ' ' A' ' 201' ' ' HOH . . . -72.86 145.73 46.71 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 119.51 -0.876 . . . . 30.93 109.345 166.736 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ASN . . . . . . . . . . . . . 14.3 p30 -144.31 178.8 7.66 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 118.613 -1.235 . . . . 33.41 108.623 178.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 52.1 p -123.18 44.82 2.57 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 124.12 0.968 . . . . 39.14 109.587 170.207 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 117.02 -173.92 14.95 Favored Glycine 0 N--CA 1.441 -1.01 0 CA-C-O 121.916 0.731 . . . . 43.55 111.869 -176.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_exo -66.58 133.41 31.96 Favored 'Trans proline' 0 C--N 1.329 -0.451 0 C-N-CA 119.848 0.365 . . . . 41.32 111.248 -176.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 60.7 m-20 64.82 36.24 8.05 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.806 -0.633 . . . . 45.76 111.951 171.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' THR . . . . . . . . . . . . . 73.9 p -117.91 31.48 6.68 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 122.512 0.325 . . . . 36.41 111.336 -179.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -74.72 126.58 31.19 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 109.71 -0.478 . . . . 36.91 109.71 -176.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . -118.28 -103.2 2.15 Favored Glycine 0 N--CA 1.445 -0.715 0 N-CA-C 110.78 -0.928 . . . . 32.94 110.78 178.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 61.3 p -125.74 -7.45 6.76 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.885 0.698 . . . . 27.46 112.885 172.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -75.22 131.44 40.4 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 119.813 -0.755 . . . . 27.91 109.713 -178.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 52.4 p90 -124.21 168.93 12.27 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.941 -1.133 . . . . 27.9 107.941 -178.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' PHE . . . . . . . . . . . . . 38.5 p90 -142.92 156.49 44.91 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 118.601 -1.24 . . . . 26.05 108.565 165.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 60.9 mt -111.64 118.73 58.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 N-CA-C 107.302 -1.37 . . . . 26.64 107.302 174.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 26.0 p -63.72 149.64 46.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.694 0.759 . . . . 28.4 110.661 175.106 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 61.1 p -120.66 3.4 10.66 Favored 'General case' 0 C--N 1.327 -0.392 0 O-C-N 122.003 -0.435 . . . . 27.07 112.002 167.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 27.0 m -151.16 166.53 14.9 Favored Pre-proline 0 C--O 1.239 0.535 0 N-CA-C 105.009 -2.219 . . . . 26.78 105.009 178.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -67.42 136.78 41.0 Favored 'Trans proline' 0 C--O 1.234 0.281 0 CA-C-N 119.755 0.948 . . . . 30.9 111.0 170.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 56.5 m -125.3 57.13 15.83 Favored Pre-proline 0 CA--C 1.515 -0.399 0 CA-C-N 115.75 -0.659 . . . . 38.19 110.486 -176.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -54.3 -24.92 36.53 Favored 'Trans proline' 0 C--O 1.238 0.511 0 CA-C-N 118.599 0.535 . . . . 33.03 113.146 -175.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 43.5 p90 -74.81 -13.73 60.61 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 112.835 0.68 . . . . 35.82 112.835 -176.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 27.4 mt -85.8 -3.25 58.86 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-N 119.144 0.884 . . . . 33.73 112.427 173.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' ASN . . . . . 0.611 ' ND2' ' O ' ' A' ' 206' ' ' HOH . 92.1 m-20 -63.31 135.7 57.2 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 121.096 0.474 . . . . 35.53 110.525 -179.575 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 80.6 -8.31 55.21 Favored Glycine 0 N--CA 1.439 -1.123 0 CA-C-O 118.705 -1.053 . . . . 32.83 115.351 -174.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 3.7 mttm -110.12 -37.0 5.69 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 119.068 1.434 . . . . 52.02 113.648 176.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 82.6 m-70 -122.75 132.95 54.46 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 118.308 0.504 . . . . 34.19 109.872 -178.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 77.6 t -81.27 112.0 18.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.338 0 C-N-CA 123.722 0.809 . . . . 28.17 109.722 -177.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 60.5 t -76.26 137.93 21.72 Favored 'Isoleucine or valine' 0 C--O 1.242 0.675 0 N-CA-C 108.392 -0.966 . . . . 29.02 108.392 170.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 52.5 p90 -145.53 4.56 1.03 Allowed 'General case' 0 C--O 1.239 0.527 0 N-CA-C 113.281 0.845 . . . . 28.48 113.281 -172.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . -174.44 178.7 46.16 Favored Glycine 0 N--CA 1.452 -0.291 0 CA-C-N 118.76 0.709 . . . . 26.57 111.479 -177.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 56.9 pttt -149.69 158.6 44.33 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 118.943 -1.103 . . . . 33.83 109.983 178.827 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 5.5 t -71.62 128.34 34.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 CA-C-N 114.463 -1.244 . . . . 30.79 108.955 170.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 10.1 pt -115.93 -20.01 6.09 Favored 'Isoleucine or valine' 0 C--O 1.24 0.583 0 CA-C-N 115.954 -0.567 . . . . 33.19 111.816 178.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' GLU . . . . . . . . . . . . . 52.3 tt0 -149.88 142.29 24.31 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.653 -0.869 . . . . 56.13 108.653 171.897 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 89.13 23.45 34.8 Favored Glycine 0 C--O 1.239 0.463 0 N-CA-C 115.843 1.097 . . . . 36.87 115.843 173.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' MET . . . . . . . . . . . . . 14.7 tpt -57.78 -25.71 60.91 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 118.227 1.014 . . . . 36.6 111.862 173.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -58.23 -25.85 62.18 Favored 'General case' 0 C--O 1.241 0.648 0 O-C-N 121.737 -0.602 . . . . 48.23 111.474 176.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' ILE . . . . . . . . . . . . . 70.6 mt -85.95 -38.14 12.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 120.846 0.355 . . . . 35.4 111.096 -179.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 95.4 t -54.65 -45.49 72.54 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 C-N-CA 120.068 -0.653 . . . . 32.6 109.84 167.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -60.33 -32.75 71.54 Favored 'General case' 0 C--O 1.239 0.548 0 O-C-N 122.099 -0.376 . . . . 30.76 111.413 177.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 18.9 ttmt -72.58 -48.31 40.93 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 121.033 -0.267 . . . . 54.16 111.579 -179.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' ILE . . . . . . . . . . . . . 22.4 mt -56.78 -40.06 68.25 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-O 120.898 0.38 . . . . 33.03 110.464 175.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 47.4 tt0 -58.18 -43.24 87.39 Favored 'General case' 0 C--O 1.242 0.671 0 O-C-N 121.91 -0.494 . . . . 32.54 111.371 179.381 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 94.8 p -64.81 -16.19 62.76 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 112.383 0.512 . . . . 29.89 112.383 -179.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 56.7 mt -90.74 14.61 13.03 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 121.743 -0.598 . . . . 32.59 112.422 174.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -95.37 -174.94 37.35 Favored Glycine 0 N--CA 1.447 -0.584 0 CA-C-O 122.429 1.016 . . . . 33.18 113.347 -177.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 35.1 p -143.38 168.23 20.3 Favored 'General case' 0 CA--C 1.521 -0.165 0 C-N-CA 124.469 1.107 . . . . 32.91 108.101 174.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 85.4 mm-40 -71.69 -34.31 69.54 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 117.146 -1.822 . . . . 57.47 111.124 178.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 10.1 p -59.98 -25.83 65.54 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 120.512 -0.475 . . . . 33.47 111.837 168.04 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' GLY . . . . . . . . . . . . . . . 96.73 -6.96 65.13 Favored Glycine 0 N--CA 1.437 -1.29 0 CA-C-O 119.009 -0.884 . . . . 29.06 114.151 177.317 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' THR . . . . . . . . . . . . . 3.8 m -67.72 130.73 92.92 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 118.134 0.967 . . . . 29.65 108.529 177.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_exo -72.58 150.47 51.21 Favored 'Trans proline' 0 C--N 1.328 -0.516 0 CA-C-N 118.87 0.632 . . . . 32.31 111.331 -176.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' LYS . . . . . . . . . . . . . 14.4 mttt -96.25 4.54 52.3 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 113.113 0.783 . . . . 35.42 113.113 177.008 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -148.07 169.44 19.95 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 107.156 -1.424 . . . . 30.51 107.156 172.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' LYS . . . . . . . . . . . . . 9.9 tttt -88.98 104.23 16.78 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 107.525 -1.287 . . . . 51.01 107.525 175.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' ILE . . . . . . . . . . . . . 2.6 mp -102.34 126.01 56.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 N-CA-C 108.166 -1.05 . . . . 32.61 108.166 -178.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' ILE . . . . . . . . . . . . . 3.6 mp -129.83 144.55 37.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-O 121.813 0.816 . . . . 45.71 110.607 -169.91 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 72.9 mt -81.17 89.8 1.8 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.447 0 N-CA-C 107.764 -1.199 . . . . 32.22 107.764 162.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' ALA . . . . . . . . . . . . . . . -69.29 -34.77 75.22 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 120.739 -0.384 . . . . 34.74 111.603 -176.095 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -154.53 163.64 39.9 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.754 0.788 . . . . 47.23 109.675 169.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 181' ' ' CYS . . . . . . . . . . . . . 4.6 p -161.11 154.45 21.61 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.789 -1.096 . . . . 34.83 108.331 -173.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' GLY . . . . . . . . . . . . . . . -170.46 -171.53 35.95 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 119.073 -1.537 . . . . 36.96 110.915 176.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 74.1 tt0 -100.99 150.72 22.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.56 0.695 . . . . 43.43 109.639 173.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 184' ' ' ILE . . . . . . . . . . . . . 5.9 mt -100.95 95.63 4.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 105.997 -1.853 . . . . 47.23 105.997 171.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 185' ' ' THR . . . . . . . . . . . . . 2.2 p -85.84 128.49 34.83 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 107.624 -1.25 . . . . 60.01 107.624 168.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 . . . . . 0 C--O 1.237 0.419 0 N-CA-C 113.543 0.942 . . . . 76.76 113.543 -172.615 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . 0.677 ' O ' ' O ' ' A' ' 121' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . 0.662 ' O ' ' O ' ' A' ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . 0.639 ' O ' ' OE1' ' A' ' 56' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . 0.606 ' O ' ' OE2' ' A' ' 96' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . 0.611 ' O ' ' ND2' ' A' ' 143' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 6.1 t80 . . . . . 0 N--CA 1.469 0.52 0 N-CA-C 113.014 0.746 . . . . 70.23 113.014 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -83.75 128.0 34.21 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 108.345 -0.983 . . . . 58.48 108.345 173.141 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.5 p -122.01 -29.86 4.18 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 116.204 1.927 . . . . 57.37 116.204 -164.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ARG . . . . . 0.584 ' HG2' ' H ' ' A' ' 9' ' ' VAL . 10.6 ttt85 -139.74 172.6 12.55 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 120.853 1.661 . . . . 62.27 110.029 179.12 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' VAL . . . . . 0.584 ' H ' ' HG2' ' A' ' 8' ' ' ARG . 2.4 t -124.92 98.98 5.63 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 N-CA-C 106.267 -1.753 . . . . 37.53 106.267 -172.82 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 1.7 mp -97.28 133.39 39.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 109.111 -0.7 . . . . 48.43 109.111 -176.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.2 p -87.74 26.21 1.35 Allowed 'General case' 0 C--O 1.242 0.666 0 C-N-CA 123.493 0.717 . . . . 30.92 112.908 168.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -152.45 170.92 7.31 Favored Pre-proline 0 C--O 1.234 0.269 0 N-CA-C 108.52 -0.919 . . . . 29.14 108.52 -170.582 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -73.98 156.39 47.67 Favored 'Trans proline' 0 C--N 1.331 -0.367 0 CA-C-O 122.392 0.914 . . . . 31.82 111.186 173.216 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LYS . . . . . 0.787 ' NZ ' ' OD2' ' A' ' 40' ' ' ASP . 7.2 ttpm? -76.58 140.49 41.08 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.046 -0.979 . . . . 54.23 110.773 -178.118 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 41.4 t -79.81 112.95 18.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 107.691 -1.226 . . . . 40.06 107.691 173.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' THR . . . . . 0.435 HG22 ' HD3' ' A' ' 17' ' ' LYS . 36.1 m -85.93 -51.5 6.33 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 124.969 1.307 . . . . 49.19 112.03 -178.599 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LYS . . . . . 0.435 ' HD3' HG22 ' A' ' 16' ' ' THR . 23.4 mmtm -126.81 162.31 26.17 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 107.4 -1.333 . . . . 47.91 107.4 -179.851 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -129.59 139.18 51.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.482 -0.781 . . . . 39.25 109.488 175.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 17.2 m -136.35 171.43 16.9 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 N-CA-C 107.32 -1.363 . . . . 33.85 107.32 176.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 33.9 p90 -144.07 156.72 44.48 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.338 0.59 . . . . 38.52 110.027 179.096 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.2 m-30 -114.83 150.18 35.9 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 114.547 -1.206 . . . . 36.8 108.796 164.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.6 mttt -116.8 123.22 46.6 Favored 'General case' 0 C--O 1.241 0.621 0 N-CA-C 107.933 -1.136 . . . . 51.4 107.933 166.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 27.5 mm -98.24 132.42 43.29 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 CA-C-N 116.007 -0.542 . . . . 39.7 109.694 -166.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.4 p -112.07 137.42 50.13 Favored 'General case' 0 C--O 1.237 0.443 0 N-CA-C 109.181 -0.674 . . . . 40.4 109.181 166.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 93.2 mt -123.56 107.74 19.57 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.569 0 N-CA-C 106.236 -1.764 . . . . 40.81 106.236 -179.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 61.21 40.38 14.7 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.745 0.783 . . . . 36.68 110.736 -179.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 80.7 4.53 90.26 Favored Glycine 0 N--CA 1.44 -1.092 0 CA-C-O 118.823 -0.987 . . . . 50.14 115.106 179.801 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -116.52 140.49 49.32 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 119.107 1.454 . . . . 59.34 111.209 -179.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -62.82 129.5 40.73 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-N 114.76 -1.109 . . . . 80.6 109.883 -178.78 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -119.84 -3.75 10.22 Favored 'General case' 0 CA--C 1.512 -0.494 0 N-CA-C 112.948 0.721 . . . . 45.02 112.948 -175.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 118.37 -178.52 16.81 Favored Glycine 0 N--CA 1.442 -0.923 0 CA-C-O 122.386 0.992 . . . . 36.17 112.037 175.191 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' THR . . . . . 0.426 ' O ' HD12 ' A' ' 158' ' ' ILE . 30.2 m -113.77 150.33 33.58 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.125 -1.038 . . . . 37.09 109.65 -173.456 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 84.2 mt -128.56 123.9 60.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 106.433 -1.692 . . . . 36.13 106.433 176.334 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' LYS . . . . . 0.461 ' HB2' ' HB3' ' A' ' 154' ' ' GLU . 58.3 mttt -105.7 138.32 42.09 Favored 'General case' 0 C--O 1.239 0.547 0 N-CA-C 109.529 -0.545 . . . . 56.52 109.529 -178.007 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -122.22 144.94 48.66 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.43 -0.804 . . . . 29.26 109.007 -175.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -112.71 129.43 8.97 Favored Glycine 0 N--CA 1.446 -0.678 0 N-CA-C 109.654 -1.379 . . . . 28.73 109.654 166.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.0 mt -97.88 146.37 25.51 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 123.0 0.52 . . . . 34.23 110.651 -178.03 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -95.99 65.35 2.48 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 122.702 1.239 . . . . 30.66 109.412 -177.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -62.88 -23.18 65.35 Favored Glycine 0 C--O 1.241 0.556 0 CA-C-N 114.458 -1.246 . . . . 37.6 114.492 -173.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ASP . . . . . 0.787 ' OD2' ' NZ ' ' A' ' 14' ' ' LYS . 23.5 m-20 -73.66 -28.59 61.85 Favored 'General case' 0 C--O 1.241 0.628 0 C-N-CA 119.398 -0.921 . . . . 51.5 112.078 177.427 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -102.2 -41.58 6.34 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 112.699 0.629 . . . . 37.6 112.699 -170.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 1.4 m -125.67 78.29 68.97 Favored Pre-proline 0 C--O 1.237 0.42 0 N-CA-C 107.663 -1.236 . . . . 36.03 107.663 172.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -69.58 -46.45 1.29 Allowed 'Trans proline' 0 C--O 1.235 0.354 0 N-CA-C 114.338 0.861 . . . . 34.62 114.338 -174.605 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 55.3 mttm -62.1 -35.6 79.17 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 119.516 -0.874 . . . . 45.89 111.057 179.522 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 15.3 m -74.11 -36.06 64.19 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 119.914 -0.714 . . . . 35.22 110.76 179.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.77 -37.0 67.78 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 119.675 -0.81 . . . . 32.66 110.55 178.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 44.4 tp10 -67.25 -45.96 75.13 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 119.944 -0.702 . . . . 35.69 111.058 179.775 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -49.06 -53.1 21.8 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-O 120.976 0.417 . . . . 34.31 110.825 174.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -65.11 -33.49 76.14 Favored 'General case' 0 C--O 1.239 0.506 0 C-N-CA 120.556 -0.458 . . . . 30.67 111.31 -175.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 38.8 ttp85 -72.11 -48.98 39.83 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-O 120.852 0.358 . . . . 31.03 111.1 -175.591 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.75 -16.63 64.38 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 112.561 0.578 . . . . 36.84 112.561 176.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 85.2 mt -80.77 -20.22 43.13 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 117.927 -1.509 . . . . 32.44 111.948 169.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 71.6 m -80.9 -27.1 36.35 Favored 'General case' 0 CA--C 1.514 -0.421 0 C-N-CA 120.198 -0.601 . . . . 32.0 111.977 174.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 60.1 p -87.29 -33.94 19.06 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 112.755 0.65 . . . . 39.35 112.755 177.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 77.63 6.31 86.76 Favored Glycine 0 N--CA 1.444 -0.798 0 CA-C-O 119.563 -0.576 . . . . 32.37 113.393 -170.461 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' GLU . . . . . 0.639 ' OE1' ' O ' ' A' ' 203' ' ' HOH . 7.4 pt-20 -61.69 -17.49 55.83 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 113.005 0.743 . . . . 42.53 113.005 -170.26 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 12.0 mmtt -86.72 0.16 55.18 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 112.66 0.615 . . . . 45.83 112.66 -177.215 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 73.99 -139.37 26.01 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 118.909 -1.615 . . . . 41.75 112.384 175.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 2.4 tpp -98.72 133.68 42.7 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 124.105 0.962 . . . . 45.63 109.979 -164.649 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -84.59 176.39 51.13 Favored Glycine 0 N--CA 1.444 -0.831 0 CA-C-O 122.454 1.03 . . . . 37.5 112.501 -176.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -63.15 -16.38 59.86 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 114.642 -0.779 . . . . 44.21 111.878 177.573 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 95.7 mt -99.15 6.47 46.42 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 113.152 0.797 . . . . 35.06 113.152 -174.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 83.14 14.54 74.41 Favored Glycine 0 N--CA 1.444 -0.805 0 C-N-CA 119.79 -1.195 . . . . 40.91 114.933 174.519 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' LYS . . . . . 0.556 ' HG3' ' HA ' ' A' ' 88' ' ' THR . 14.6 mmtp -121.82 159.36 51.45 Favored Pre-proline 0 C--O 1.24 0.57 0 CA-C-N 117.985 0.893 . . . . 42.18 110.683 171.434 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -59.92 140.43 92.87 Favored 'Trans proline' 0 CA--C 1.518 -0.321 0 C-N-CA 120.047 0.498 . . . . 35.14 110.865 171.474 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 73.1 mt -78.86 81.03 5.18 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 107.421 -1.326 . . . . 39.34 107.421 164.044 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -164.75 123.88 1.83 Allowed 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 108.911 -0.774 . . . . 34.9 108.911 -164.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -70.49 -21.04 62.81 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 112.651 0.612 . . . . 27.37 112.651 -177.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 20.1 tttt -60.21 121.82 12.9 Favored 'General case' 0 C--O 1.234 0.262 0 O-C-N 123.626 0.579 . . . . 37.3 110.684 -172.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 98.28 -12.61 63.48 Favored Glycine 0 N--CA 1.438 -1.189 0 CA-C-O 118.659 -1.078 . . . . 28.52 114.621 -177.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.5 p -77.6 149.96 78.67 Favored Pre-proline 0 C--N 1.354 0.769 0 C-N-CA 118.16 -1.416 . . . . 34.26 110.204 179.856 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_endo -93.7 167.08 2.18 Favored 'Trans proline' 0 C--N 1.328 -0.513 0 C-N-CA 121.105 1.203 . . . . 31.02 112.492 -178.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 30.2 m-85 -88.6 94.35 9.86 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 106.399 -1.704 . . . . 28.32 106.399 160.466 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 30.2 p80 -84.6 -12.77 53.37 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 113.595 0.961 . . . . 27.13 113.595 -169.194 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 11.5 ttt-85 -147.62 114.24 6.02 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.492 -1.299 . . . . 48.23 107.492 -178.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' VAL . . . . . 0.588 HG13 HG22 ' A' ' 82' ' ' ILE . 46.9 t -129.06 113.43 28.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 107.441 -1.318 . . . . 28.36 107.441 -174.081 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ILE . . . . . 0.42 HG12 ' HA2' ' A' ' 170' ' ' GLY . 3.9 mt -118.57 115.65 35.42 Favored Pre-proline 0 C--N 1.328 -0.362 0 C-N-CA 122.934 0.494 . . . . 33.79 109.695 -177.548 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -66.49 146.26 79.38 Favored 'Trans proline' 0 C--N 1.321 -0.877 0 CA-C-N 119.51 0.861 . . . . 34.37 112.084 -179.521 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 73.6 m-80 62.81 27.11 15.92 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.111 -0.95 . . . . 39.42 112.322 -172.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -145.47 -87.18 0.11 Allowed 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 109.869 -0.419 . . . . 33.44 109.869 176.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -160.41 166.49 29.2 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.895 0.855 . . . . 27.57 109.871 -175.736 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ILE . . . . . 0.588 HG22 HG13 ' A' ' 76' ' ' VAL . 21.3 pt -115.1 147.12 18.72 Favored 'Isoleucine or valine' 0 C--O 1.242 0.676 0 N-CA-C 105.735 -1.95 . . . . 27.75 105.735 167.635 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -139.91 139.01 36.09 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.939 -0.573 . . . . 26.43 110.376 -173.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -156.58 -147.53 4.79 Favored Glycine 0 C--O 1.226 -0.365 0 N-CA-C 110.535 -1.026 . . . . 26.21 110.535 173.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 82.2 21.82 60.09 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 119.417 -1.373 . . . . 27.64 115.568 -179.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 56.6 t0 -87.78 100.74 13.08 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 107.002 -1.481 . . . . 35.74 107.002 171.567 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 25.9 pt -102.03 -3.84 9.39 Favored 'Isoleucine or valine' 0 C--O 1.239 0.5 0 CA-C-N 115.217 -0.901 . . . . 34.47 112.464 -170.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' THR . . . . . 0.556 ' HA ' ' HG3' ' A' ' 64' ' ' LYS . 37.0 p -100.49 -83.87 0.43 Allowed 'General case' 0 C--O 1.234 0.25 0 N-CA-C 109.499 -0.556 . . . . 39.62 109.499 174.656 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 92.4 p -81.82 -10.09 59.43 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 117.069 -1.853 . . . . 45.86 113.419 -178.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 64.02 16.72 60.13 Favored Glycine 0 N--CA 1.451 -0.364 0 N-CA-C 115.604 1.001 . . . . 44.2 115.604 173.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 20.4 p30 -118.86 6.34 11.45 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 118.685 1.243 . . . . 48.63 112.821 -178.502 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 99.67 -5.51 58.44 Favored Glycine 0 N--CA 1.444 -0.769 0 CA-C-O 118.821 -0.988 . . . . 34.38 114.783 179.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -106.04 -15.74 14.81 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 118.622 1.211 . . . . 38.16 112.671 176.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -92.17 -145.83 16.9 Favored Glycine 0 N--CA 1.444 -0.793 0 CA-C-O 121.913 0.729 . . . . 34.97 112.886 -174.062 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 107.44 149.73 15.67 Favored Glycine 0 N--CA 1.443 -0.882 0 C-N-CA 119.922 -1.133 . . . . 41.93 111.835 -173.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' GLU . . . . . 0.606 ' OE2' ' O ' ' A' ' 204' ' ' HOH . 84.7 tt0 -156.86 140.28 15.75 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 107.677 -1.231 . . . . 50.52 107.677 -179.79 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -90.09 170.87 9.96 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.848 0.832 . . . . 37.04 111.006 175.412 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 34.6 pt -81.21 5.64 1.56 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.487 0 CA-C-N 115.388 -0.824 . . . . 36.71 112.266 177.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -106.96 22.67 15.61 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 112.473 0.546 . . . . 46.91 112.473 -178.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' GLY . . . . . 0.662 ' O ' ' O ' ' A' ' 202' ' ' HOH . . . 82.18 -33.66 2.68 Favored Glycine 0 N--CA 1.442 -0.955 0 CA-C-N 118.082 0.401 . . . . 60.38 114.067 178.79 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 18.3 p -151.63 -179.57 7.53 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.17 -1.048 . . . . 52.2 108.17 -175.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 33.2 mmtt -67.06 131.18 45.31 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.909 -0.587 . . . . 47.3 109.896 177.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 3.3 p90 -102.49 163.71 12.07 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.997 0.903 . . . . 37.97 110.292 -177.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -71.28 152.05 43.65 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.627 -1.17 . . . . 45.73 110.827 -173.398 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -58.74 122.22 12.99 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 115.44 -0.8 . . . . 47.6 109.319 172.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -71.7 -54.99 8.55 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 120.071 -0.652 . . . . 42.26 111.513 -176.002 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 4.2 t -164.62 142.31 6.55 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 120.336 -0.546 . . . . 37.32 109.849 -173.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -105.6 19.48 20.49 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 123.422 0.689 . . . . 36.81 112.562 -179.044 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 43.4 mttm -83.89 -24.49 30.79 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 113.293 0.849 . . . . 48.7 113.293 -170.822 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 36.0 mt -88.99 118.83 35.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 107.032 -1.47 . . . . 32.89 107.032 168.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 2.1 p -102.33 170.22 8.21 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.46 0.648 . . . . 37.36 110.364 -169.447 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 73.6 m80 -88.0 65.14 8.13 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 122.576 1.179 . . . . 34.37 110.883 -173.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -81.88 -22.29 36.97 Favored 'General case' 0 C--O 1.24 0.584 0 C-N-CA 118.359 -1.336 . . . . 46.63 113.308 -163.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -159.72 -175.45 30.7 Favored Glycine 0 N--CA 1.442 -0.955 0 CA-C-N 118.678 0.672 . . . . 32.72 111.91 -178.606 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -69.47 164.09 35.56 Favored 'Trans proline' 0 C--N 1.328 -0.533 0 CA-C-O 121.876 0.698 . . . . 30.66 111.666 178.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 77.39 20.59 74.58 Favored Glycine 0 C--N 1.335 0.507 0 CA-C-N 115.0 -1.0 . . . . 31.28 114.96 173.037 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 73.1 mt -95.8 135.22 37.8 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-N 118.728 1.264 . . . . 29.18 109.676 175.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 5.4 mt -81.09 128.77 34.1 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.64 -0.709 . . . . 28.36 109.416 168.561 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' SER . . . . . 0.403 ' HB3' ' CZ ' ' A' ' 133' ' ' PHE . 47.6 t -143.78 154.8 43.81 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.399 0.618 . . . . 29.8 109.798 178.089 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 95.4 mmm -81.98 123.83 29.23 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.279 -0.873 . . . . 30.84 110.486 -176.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' ALA . . . . . 0.677 ' O ' ' O ' ' A' ' 201' ' ' HOH . . . -72.86 145.73 46.71 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 119.51 -0.876 . . . . 30.93 109.345 166.736 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ASN . . . . . 0.517 ' HB2' ' OG1' ' A' ' 127' ' ' THR . 14.3 p30 -144.31 178.8 7.66 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 118.613 -1.235 . . . . 33.41 108.623 178.42 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 52.1 p -123.18 44.82 2.57 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 124.12 0.968 . . . . 39.14 109.587 170.207 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 117.02 -173.92 14.95 Favored Glycine 0 N--CA 1.441 -1.01 0 CA-C-O 121.916 0.731 . . . . 43.55 111.869 -176.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_exo -66.58 133.41 31.96 Favored 'Trans proline' 0 C--N 1.329 -0.451 0 C-N-CA 119.848 0.365 . . . . 41.32 111.248 -176.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 60.7 m-20 64.82 36.24 8.05 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.806 -0.633 . . . . 45.76 111.951 171.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' THR . . . . . 0.517 ' OG1' ' HB2' ' A' ' 122' ' ' ASN . 73.9 p -117.91 31.48 6.68 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 122.512 0.325 . . . . 36.41 111.336 -179.342 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -74.72 126.58 31.19 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 109.71 -0.478 . . . . 36.91 109.71 -176.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . -118.28 -103.2 2.15 Favored Glycine 0 N--CA 1.445 -0.715 0 N-CA-C 110.78 -0.928 . . . . 32.94 110.78 178.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 61.3 p -125.74 -7.45 6.76 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.885 0.698 . . . . 27.46 112.885 172.648 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -75.22 131.44 40.4 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 119.813 -0.755 . . . . 27.91 109.713 -178.189 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 52.4 p90 -124.21 168.93 12.27 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.941 -1.133 . . . . 27.9 107.941 -178.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' PHE . . . . . 0.403 ' CZ ' ' HB3' ' A' ' 119' ' ' SER . 38.5 p90 -142.92 156.49 44.91 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 118.601 -1.24 . . . . 26.05 108.565 165.288 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 60.9 mt -111.64 118.73 58.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 N-CA-C 107.302 -1.37 . . . . 26.64 107.302 174.107 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 26.0 p -63.72 149.64 46.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.694 0.759 . . . . 28.4 110.661 175.106 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 61.1 p -120.66 3.4 10.66 Favored 'General case' 0 C--N 1.327 -0.392 0 O-C-N 122.003 -0.435 . . . . 27.07 112.002 167.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 27.0 m -151.16 166.53 14.9 Favored Pre-proline 0 C--O 1.239 0.535 0 N-CA-C 105.009 -2.219 . . . . 26.78 105.009 178.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -67.42 136.78 41.0 Favored 'Trans proline' 0 C--O 1.234 0.281 0 CA-C-N 119.755 0.948 . . . . 30.9 111.0 170.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 56.5 m -125.3 57.13 15.83 Favored Pre-proline 0 CA--C 1.515 -0.399 0 CA-C-N 115.75 -0.659 . . . . 38.19 110.486 -176.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -54.3 -24.92 36.53 Favored 'Trans proline' 0 C--O 1.238 0.511 0 CA-C-N 118.599 0.535 . . . . 33.03 113.146 -175.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 43.5 p90 -74.81 -13.73 60.61 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 112.835 0.68 . . . . 35.82 112.835 -176.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 27.4 mt -85.8 -3.25 58.86 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-N 119.144 0.884 . . . . 33.73 112.427 173.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -63.31 135.7 57.2 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 121.096 0.474 . . . . 35.53 110.525 -179.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 80.6 -8.31 55.21 Favored Glycine 0 N--CA 1.439 -1.123 0 CA-C-O 118.705 -1.053 . . . . 32.83 115.351 -174.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 3.7 mttm -110.12 -37.0 5.69 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 119.068 1.434 . . . . 52.02 113.648 176.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 82.6 m-70 -122.75 132.95 54.46 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 118.308 0.504 . . . . 34.19 109.872 -178.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 77.6 t -81.27 112.0 18.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.338 0 C-N-CA 123.722 0.809 . . . . 28.17 109.722 -177.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 60.5 t -76.26 137.93 21.72 Favored 'Isoleucine or valine' 0 C--O 1.242 0.675 0 N-CA-C 108.392 -0.966 . . . . 29.02 108.392 170.535 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 52.5 p90 -145.53 4.56 1.03 Allowed 'General case' 0 C--O 1.239 0.527 0 N-CA-C 113.281 0.845 . . . . 28.48 113.281 -172.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . -174.44 178.7 46.16 Favored Glycine 0 N--CA 1.452 -0.291 0 CA-C-N 118.76 0.709 . . . . 26.57 111.479 -177.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 56.9 pttt -149.69 158.6 44.33 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 118.943 -1.103 . . . . 33.83 109.983 178.827 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 5.5 t -71.62 128.34 34.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 CA-C-N 114.463 -1.244 . . . . 30.79 108.955 170.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 10.1 pt -115.93 -20.01 6.09 Favored 'Isoleucine or valine' 0 C--O 1.24 0.583 0 CA-C-N 115.954 -0.567 . . . . 33.19 111.816 178.516 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 154' ' ' GLU . . . . . 0.461 ' HB3' ' HB2' ' A' ' 34' ' ' LYS . 52.3 tt0 -149.88 142.29 24.31 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.653 -0.869 . . . . 56.13 108.653 171.897 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 89.13 23.45 34.8 Favored Glycine 0 C--O 1.239 0.463 0 N-CA-C 115.843 1.097 . . . . 36.87 115.843 173.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' MET . . . . . . . . . . . . . 14.7 tpt -57.78 -25.71 60.91 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 118.227 1.014 . . . . 36.6 111.862 173.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 157' ' ' GLU . . . . . 0.498 ' H ' ' CD ' ' A' ' 157' ' ' GLU . 2.3 mp0 -58.23 -25.85 62.18 Favored 'General case' 0 C--O 1.241 0.648 0 O-C-N 121.737 -0.602 . . . . 48.23 111.474 176.315 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 158' ' ' ILE . . . . . 0.426 HD12 ' O ' ' A' ' 32' ' ' THR . 70.6 mt -85.95 -38.14 12.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 120.846 0.355 . . . . 35.4 111.096 -179.151 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 95.4 t -54.65 -45.49 72.54 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 C-N-CA 120.068 -0.653 . . . . 32.6 109.84 167.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -60.33 -32.75 71.54 Favored 'General case' 0 C--O 1.239 0.548 0 O-C-N 122.099 -0.376 . . . . 30.76 111.413 177.329 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 18.9 ttmt -72.58 -48.31 40.93 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 121.033 -0.267 . . . . 54.16 111.579 -179.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 162' ' ' ILE . . . . . 0.457 ' O ' HG11 ' A' ' 76' ' ' VAL . 22.4 mt -56.78 -40.06 68.25 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-O 120.898 0.38 . . . . 33.03 110.464 175.824 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 47.4 tt0 -58.18 -43.24 87.39 Favored 'General case' 0 C--O 1.242 0.671 0 O-C-N 121.91 -0.494 . . . . 32.54 111.371 179.381 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 94.8 p -64.81 -16.19 62.76 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 112.383 0.512 . . . . 29.89 112.383 -179.651 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 56.7 mt -90.74 14.61 13.03 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 121.743 -0.598 . . . . 32.59 112.422 174.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -95.37 -174.94 37.35 Favored Glycine 0 N--CA 1.447 -0.584 0 CA-C-O 122.429 1.016 . . . . 33.18 113.347 -177.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 35.1 p -143.38 168.23 20.3 Favored 'General case' 0 CA--C 1.521 -0.165 0 C-N-CA 124.469 1.107 . . . . 32.91 108.101 174.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 85.4 mm-40 -71.69 -34.31 69.54 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 117.146 -1.822 . . . . 57.47 111.124 178.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 10.1 p -59.98 -25.83 65.54 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 120.512 -0.475 . . . . 33.47 111.837 168.04 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 170' ' ' GLY . . . . . 0.42 ' HA2' HG12 ' A' ' 77' ' ' ILE . . . 96.73 -6.96 65.13 Favored Glycine 0 N--CA 1.437 -1.29 0 CA-C-O 119.009 -0.884 . . . . 29.06 114.151 177.317 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 171' ' ' THR . . . . . . . . . . . . . 3.8 m -67.72 130.73 92.92 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 118.134 0.967 . . . . 29.65 108.529 177.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_exo -72.58 150.47 51.21 Favored 'Trans proline' 0 C--N 1.328 -0.516 0 CA-C-N 118.87 0.632 . . . . 32.31 111.331 -176.347 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 173' ' ' LYS . . . . . . . . . . . . . 14.4 mttt -96.25 4.54 52.3 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 113.113 0.783 . . . . 35.42 113.113 177.008 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -148.07 169.44 19.95 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 107.156 -1.424 . . . . 30.51 107.156 172.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 175' ' ' LYS . . . . . 0.752 ' HG2' HD11 ' A' ' 177' ' ' ILE . 9.9 tttt -88.98 104.23 16.78 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 107.525 -1.287 . . . . 51.01 107.525 175.082 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 176' ' ' ILE . . . . . . . . . . . . . 2.6 mp -102.34 126.01 56.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 N-CA-C 108.166 -1.05 . . . . 32.61 108.166 -178.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 177' ' ' ILE . . . . . 0.752 HD11 ' HG2' ' A' ' 175' ' ' LYS . 3.6 mp -129.83 144.55 37.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-O 121.813 0.816 . . . . 45.71 110.607 -169.91 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 72.9 mt -81.17 89.8 1.8 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.447 0 N-CA-C 107.764 -1.199 . . . . 32.22 107.764 162.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 179' ' ' ALA . . . . . . . . . . . . . . . -69.29 -34.77 75.22 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 120.739 -0.384 . . . . 34.74 111.603 -176.095 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -154.53 163.64 39.9 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.754 0.788 . . . . 47.23 109.675 169.483 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 181' ' ' CYS . . . . . . . . . . . . . 4.6 p -161.11 154.45 21.61 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.789 -1.096 . . . . 34.83 108.331 -173.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 182' ' ' GLY . . . . . . . . . . . . . . . -170.46 -171.53 35.95 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 119.073 -1.537 . . . . 36.96 110.915 176.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 74.1 tt0 -100.99 150.72 22.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.56 0.695 . . . . 43.43 109.639 173.14 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 184' ' ' ILE . . . . . . . . . . . . . 5.9 mt -100.95 95.63 4.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 105.997 -1.853 . . . . 47.23 105.997 171.453 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 185' ' ' THR . . . . . . . . . . . . . 2.2 p -85.84 128.49 34.83 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 107.624 -1.25 . . . . 60.01 107.624 168.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 . . . . . 0 C--O 1.237 0.419 0 N-CA-C 113.543 0.942 . . . . 76.76 113.543 -172.615 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . 0.677 ' O ' ' O ' ' A' ' 121' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . 0.662 ' O ' ' O ' ' A' ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . 0.639 ' O ' ' OE1' ' A' ' 56' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . 0.606 ' O ' ' OE2' ' A' ' 96' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 6.1 t80 . . . . . 0 N--CA 1.469 0.52 0 N-CA-C 113.014 0.746 . . . . 70.23 113.014 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -83.75 128.0 34.21 Favored 'General case' 0 CA--C 1.52 -0.183 0 N-CA-C 108.345 -0.983 . . . . 58.48 108.345 173.141 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.5 p -122.01 -29.86 4.18 Favored 'General case' 0 C--N 1.329 -0.313 0 N-CA-C 116.204 1.927 . . . . 57.37 116.204 -164.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ARG . . . . . 0.584 ' HG2' ' H ' ' A' ' 9' ' ' VAL . 10.6 ttt85 -139.74 172.6 12.55 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 120.853 1.661 . . . . 62.27 110.029 179.12 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.584 ' H ' ' HG2' ' A' ' 8' ' ' ARG . 2.4 t -124.92 98.98 5.63 Favored 'Isoleucine or valine' 0 C--O 1.237 0.401 0 N-CA-C 106.267 -1.753 . . . . 37.53 106.267 -172.82 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 1.7 mp -97.28 133.39 39.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.411 0 N-CA-C 109.111 -0.7 . . . . 48.43 109.111 -176.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 18.2 p -87.74 26.21 1.35 Allowed 'General case' 0 C--O 1.242 0.666 0 C-N-CA 123.493 0.717 . . . . 30.92 112.908 168.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -152.45 170.92 7.31 Favored Pre-proline 0 C--O 1.234 0.269 0 N-CA-C 108.52 -0.919 . . . . 29.14 108.52 -170.582 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 33.0 Cg_exo -73.98 156.39 47.67 Favored 'Trans proline' 0 C--N 1.331 -0.367 0 CA-C-O 122.392 0.914 . . . . 31.82 111.186 173.216 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.787 ' NZ ' ' OD2' ' A' ' 40' ' ' ASP . 7.2 ttpm? -76.58 140.49 41.08 Favored 'General case' 0 C--N 1.325 -0.491 0 CA-C-N 115.046 -0.979 . . . . 54.23 110.773 -178.118 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 41.4 t -79.81 112.95 18.48 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 107.691 -1.226 . . . . 40.06 107.691 173.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' THR . . . . . 0.435 HG22 ' HD3' ' A' ' 17' ' ' LYS . 36.1 m -85.93 -51.5 6.33 Favored 'General case' 0 C--N 1.33 -0.256 0 C-N-CA 124.969 1.307 . . . . 49.19 112.03 -178.599 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.435 ' HD3' HG22 ' A' ' 16' ' ' THR . 23.4 mmtm -126.81 162.31 26.17 Favored 'General case' 0 N--CA 1.449 -0.493 0 N-CA-C 107.4 -1.333 . . . . 47.91 107.4 -179.851 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 88.1 mttt -129.59 139.18 51.54 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.482 -0.781 . . . . 39.25 109.488 175.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 17.2 m -136.35 171.43 16.9 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 N-CA-C 107.32 -1.363 . . . . 33.85 107.32 176.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 33.9 p90 -144.07 156.72 44.48 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.338 0.59 . . . . 38.52 110.027 179.096 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 22.2 m-30 -114.83 150.18 35.9 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 114.547 -1.206 . . . . 36.8 108.796 164.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 16.6 mttt -116.8 123.22 46.6 Favored 'General case' 0 C--O 1.241 0.621 0 N-CA-C 107.933 -1.136 . . . . 51.4 107.933 166.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 27.5 mm -98.24 132.42 43.29 Favored 'Isoleucine or valine' 0 C--O 1.238 0.466 0 CA-C-N 116.007 -0.542 . . . . 39.7 109.694 -166.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 1.4 p -112.07 137.42 50.13 Favored 'General case' 0 C--O 1.237 0.443 0 N-CA-C 109.181 -0.674 . . . . 40.4 109.181 166.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 93.2 mt -123.56 107.74 19.57 Favored 'Isoleucine or valine' 0 CA--C 1.51 -0.569 0 N-CA-C 106.236 -1.764 . . . . 40.81 106.236 -179.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ASN . . . . . . . . . . . . . 75.9 m-20 61.21 40.38 14.7 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.745 0.783 . . . . 36.68 110.736 -179.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 80.7 4.53 90.26 Favored Glycine 0 N--CA 1.44 -1.092 0 CA-C-O 118.823 -0.987 . . . . 50.14 115.106 179.801 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 4.0 mt-10 -116.52 140.49 49.32 Favored 'General case' 0 CA--C 1.516 -0.333 0 CA-C-N 119.107 1.454 . . . . 59.34 111.209 -179.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -62.82 129.5 40.73 Favored 'General case' 0 CA--C 1.511 -0.553 0 CA-C-N 114.76 -1.109 . . . . 80.6 109.883 -178.78 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -119.84 -3.75 10.22 Favored 'General case' 0 CA--C 1.512 -0.494 0 N-CA-C 112.948 0.721 . . . . 45.02 112.948 -175.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . 118.37 -178.52 16.81 Favored Glycine 0 N--CA 1.442 -0.923 0 CA-C-O 122.386 0.992 . . . . 36.17 112.037 175.191 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' THR . . . . . 0.426 ' O ' HD12 ' A' ' 158' ' ' ILE . 30.2 m -113.77 150.33 33.58 Favored 'General case' 0 C--N 1.324 -0.541 0 CA-C-N 114.125 -1.038 . . . . 37.09 109.65 -173.456 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ILE . . . . . . . . . . . . . 84.2 mt -128.56 123.9 60.57 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.583 0 N-CA-C 106.433 -1.692 . . . . 36.13 106.433 176.334 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.461 ' HB2' ' HB3' ' A' ' 154' ' ' GLU . 58.3 mttt -105.7 138.32 42.09 Favored 'General case' 0 C--O 1.239 0.547 0 N-CA-C 109.529 -0.545 . . . . 56.52 109.529 -178.007 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -122.22 144.94 48.66 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-N 115.43 -0.804 . . . . 29.26 109.007 -175.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . -112.71 129.43 8.97 Favored Glycine 0 N--CA 1.446 -0.678 0 N-CA-C 109.654 -1.379 . . . . 28.73 109.654 166.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.0 mt -97.88 146.37 25.51 Favored 'General case' 0 C--N 1.33 -0.275 0 C-N-CA 123.0 0.52 . . . . 34.23 110.651 -178.03 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 18.1 m-85 -95.99 65.35 2.48 Favored 'General case' 0 C--O 1.233 0.218 0 CA-C-O 122.702 1.239 . . . . 30.66 109.412 -177.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . -62.88 -23.18 65.35 Favored Glycine 0 C--O 1.241 0.556 0 CA-C-N 114.458 -1.246 . . . . 37.6 114.492 -173.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ASP . . . . . 0.787 ' OD2' ' NZ ' ' A' ' 14' ' ' LYS . 23.5 m-20 -73.66 -28.59 61.85 Favored 'General case' 0 C--O 1.241 0.628 0 C-N-CA 119.398 -0.921 . . . . 51.5 112.078 177.427 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 11.0 m-20 -102.2 -41.58 6.34 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 112.699 0.629 . . . . 37.6 112.699 -170.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 1.4 m -125.67 78.29 68.97 Favored Pre-proline 0 C--O 1.237 0.42 0 N-CA-C 107.663 -1.236 . . . . 36.03 107.663 172.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -69.58 -46.45 1.29 Allowed 'Trans proline' 0 C--O 1.235 0.354 0 N-CA-C 114.338 0.861 . . . . 34.62 114.338 -174.605 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 55.3 mttm -62.1 -35.6 79.17 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 119.516 -0.874 . . . . 45.89 111.057 179.522 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 15.3 m -74.11 -36.06 64.19 Favored 'General case' 0 N--CA 1.454 -0.271 0 C-N-CA 119.914 -0.714 . . . . 35.22 110.76 179.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -72.77 -37.0 67.78 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 119.675 -0.81 . . . . 32.66 110.55 178.807 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 44.4 tp10 -67.25 -45.96 75.13 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 119.944 -0.702 . . . . 35.69 111.058 179.775 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -49.06 -53.1 21.8 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-O 120.976 0.417 . . . . 34.31 110.825 174.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 65.7 t80 -65.11 -33.49 76.14 Favored 'General case' 0 C--O 1.239 0.506 0 C-N-CA 120.556 -0.458 . . . . 30.67 111.31 -175.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 38.8 ttp85 -72.11 -48.98 39.83 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-O 120.852 0.358 . . . . 31.03 111.1 -175.591 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -66.75 -16.63 64.38 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 112.561 0.578 . . . . 36.84 112.561 176.306 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 85.2 mt -80.77 -20.22 43.13 Favored 'General case' 0 C--O 1.234 0.274 0 C-N-CA 117.927 -1.509 . . . . 32.44 111.948 169.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 71.6 m -80.9 -27.1 36.35 Favored 'General case' 0 CA--C 1.514 -0.421 0 C-N-CA 120.198 -0.601 . . . . 32.0 111.977 174.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 60.1 p -87.29 -33.94 19.06 Favored 'General case' 0 CA--C 1.516 -0.33 0 N-CA-C 112.755 0.65 . . . . 39.35 112.755 177.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 77.63 6.31 86.76 Favored Glycine 0 N--CA 1.444 -0.798 0 CA-C-O 119.563 -0.576 . . . . 32.37 113.393 -170.461 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.639 ' OE1' ' O ' ' A' ' 203' ' ' HOH . 7.4 pt-20 -61.69 -17.49 55.83 Favored 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 113.005 0.743 . . . . 42.53 113.005 -170.26 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 12.0 mmtt -86.72 0.16 55.18 Favored 'General case' 0 C--N 1.324 -0.543 0 N-CA-C 112.66 0.615 . . . . 45.83 112.66 -177.215 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' GLY . . . . . . . . . . . . . . . 73.99 -139.37 26.01 Favored Glycine 0 N--CA 1.449 -0.457 0 C-N-CA 118.909 -1.615 . . . . 41.75 112.384 175.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' MET . . . . . . . . . . . . . 2.4 tpp -98.72 133.68 42.7 Favored 'General case' 0 C--O 1.234 0.27 0 C-N-CA 124.105 0.962 . . . . 45.63 109.979 -164.649 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -84.59 176.39 51.13 Favored Glycine 0 N--CA 1.444 -0.831 0 CA-C-O 122.454 1.03 . . . . 37.5 112.501 -176.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -63.15 -16.38 59.86 Favored 'General case' 0 CA--C 1.512 -0.504 0 CA-C-N 114.642 -0.779 . . . . 44.21 111.878 177.573 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 95.7 mt -99.15 6.47 46.42 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 113.152 0.797 . . . . 35.06 113.152 -174.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 83.14 14.54 74.41 Favored Glycine 0 N--CA 1.444 -0.805 0 C-N-CA 119.79 -1.195 . . . . 40.91 114.933 174.519 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' LYS . . . . . 0.556 ' HG3' ' HA ' ' A' ' 88' ' ' THR . 14.6 mmtp -121.82 159.36 51.45 Favored Pre-proline 0 C--O 1.24 0.57 0 CA-C-N 117.985 0.893 . . . . 42.18 110.683 171.434 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -59.92 140.43 92.87 Favored 'Trans proline' 0 CA--C 1.518 -0.321 0 C-N-CA 120.047 0.498 . . . . 35.14 110.865 171.474 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 73.1 mt -78.86 81.03 5.18 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 107.421 -1.326 . . . . 39.34 107.421 164.044 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 2.0 t60 -164.75 123.88 1.83 Allowed 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 108.911 -0.774 . . . . 34.9 108.911 -164.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 4.2 m-85 -70.49 -21.04 62.81 Favored 'General case' 0 CA--C 1.509 -0.614 0 N-CA-C 112.651 0.612 . . . . 27.37 112.651 -177.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 20.1 tttt -60.21 121.82 12.9 Favored 'General case' 0 C--O 1.234 0.262 0 O-C-N 123.626 0.579 . . . . 37.3 110.684 -172.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' GLY . . . . . . . . . . . . . . . 98.28 -12.61 63.48 Favored Glycine 0 N--CA 1.438 -1.189 0 CA-C-O 118.659 -1.078 . . . . 28.52 114.621 -177.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 1.5 p -77.6 149.96 78.67 Favored Pre-proline 0 C--N 1.354 0.769 0 C-N-CA 118.16 -1.416 . . . . 34.26 110.204 179.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_endo -93.7 167.08 2.18 Favored 'Trans proline' 0 C--N 1.328 -0.513 0 C-N-CA 121.105 1.203 . . . . 31.02 112.492 -178.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 30.2 m-85 -88.6 94.35 9.86 Favored 'General case' 0 CA--C 1.517 -0.297 0 N-CA-C 106.399 -1.704 . . . . 28.32 106.399 160.466 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 30.2 p80 -84.6 -12.77 53.37 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 113.595 0.961 . . . . 27.13 113.595 -169.194 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 11.5 ttt-85 -147.62 114.24 6.02 Favored 'General case' 0 C--N 1.325 -0.498 0 N-CA-C 107.492 -1.299 . . . . 48.23 107.492 -178.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' VAL . . . . . 0.588 HG13 HG22 ' A' ' 82' ' ' ILE . 46.9 t -129.06 113.43 28.61 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.421 0 N-CA-C 107.441 -1.318 . . . . 28.36 107.441 -174.081 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.42 HG12 ' HA2' ' A' ' 170' ' ' GLY . 3.9 mt -118.57 115.65 35.42 Favored Pre-proline 0 C--N 1.328 -0.362 0 C-N-CA 122.934 0.494 . . . . 33.79 109.695 -177.548 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' PRO . . . . . . . . . . . . . 36.6 Cg_exo -66.49 146.26 79.38 Favored 'Trans proline' 0 C--N 1.321 -0.877 0 CA-C-N 119.51 0.861 . . . . 34.37 112.084 -179.521 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 73.6 m-80 62.81 27.11 15.92 Favored 'General case' 0 N--CA 1.469 0.485 0 CA-C-N 115.111 -0.95 . . . . 39.42 112.322 -172.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -145.47 -87.18 0.11 Allowed 'General case' 0 N--CA 1.451 -0.417 0 N-CA-C 109.869 -0.419 . . . . 33.44 109.869 176.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -160.41 166.49 29.2 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 121.895 0.855 . . . . 27.57 109.871 -175.736 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ILE . . . . . 0.588 HG22 HG13 ' A' ' 76' ' ' VAL . 21.3 pt -115.1 147.12 18.72 Favored 'Isoleucine or valine' 0 C--O 1.242 0.676 0 N-CA-C 105.735 -1.95 . . . . 27.75 105.735 167.635 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -139.91 139.01 36.09 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 115.939 -0.573 . . . . 26.43 110.376 -173.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLY . . . . . . . . . . . . . . . -156.58 -147.53 4.79 Favored Glycine 0 C--O 1.226 -0.365 0 N-CA-C 110.535 -1.026 . . . . 26.21 110.535 173.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 82.2 21.82 60.09 Favored Glycine 0 N--CA 1.448 -0.548 0 C-N-CA 119.417 -1.373 . . . . 27.64 115.568 -179.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 56.6 t0 -87.78 100.74 13.08 Favored 'General case' 0 C--N 1.328 -0.351 0 N-CA-C 107.002 -1.481 . . . . 35.74 107.002 171.567 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 25.9 pt -102.03 -3.84 9.39 Favored 'Isoleucine or valine' 0 C--O 1.239 0.5 0 CA-C-N 115.217 -0.901 . . . . 34.47 112.464 -170.981 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' THR . . . . . 0.556 ' HA ' ' HG3' ' A' ' 64' ' ' LYS . 37.0 p -100.49 -83.87 0.43 Allowed 'General case' 0 C--O 1.234 0.25 0 N-CA-C 109.499 -0.556 . . . . 39.62 109.499 174.656 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 92.4 p -81.82 -10.09 59.43 Favored 'General case' 0 C--O 1.234 0.256 0 C-N-CA 117.069 -1.853 . . . . 45.86 113.419 -178.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 64.02 16.72 60.13 Favored Glycine 0 N--CA 1.451 -0.364 0 N-CA-C 115.604 1.001 . . . . 44.2 115.604 173.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ASN . . . . . . . . . . . . . 20.4 p30 -118.86 6.34 11.45 Favored 'General case' 0 C--O 1.233 0.227 0 CA-C-N 118.685 1.243 . . . . 48.63 112.821 -178.502 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 99.67 -5.51 58.44 Favored Glycine 0 N--CA 1.444 -0.769 0 CA-C-O 118.821 -0.988 . . . . 34.38 114.783 179.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' TYR . . . . . . . . . . . . . 23.1 m-85 -106.04 -15.74 14.81 Favored 'General case' 0 CA--C 1.512 -0.49 0 CA-C-N 118.622 1.211 . . . . 38.16 112.671 176.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . -92.17 -145.83 16.9 Favored Glycine 0 N--CA 1.444 -0.793 0 CA-C-O 121.913 0.729 . . . . 34.97 112.886 -174.062 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 107.44 149.73 15.67 Favored Glycine 0 N--CA 1.443 -0.882 0 C-N-CA 119.922 -1.133 . . . . 41.93 111.835 -173.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' GLU . . . . . 0.606 ' OE2' ' O ' ' A' ' 204' ' ' HOH . 84.7 tt0 -156.86 140.28 15.75 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 107.677 -1.231 . . . . 50.52 107.677 -179.79 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -90.09 170.87 9.96 Favored 'General case' 0 N--CA 1.449 -0.503 0 CA-C-O 121.848 0.832 . . . . 37.04 111.006 175.412 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ILE . . . . . . . . . . . . . 34.6 pt -81.21 5.64 1.56 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.487 0 CA-C-N 115.388 -0.824 . . . . 36.71 112.266 177.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 42.4 m-85 -106.96 22.67 15.61 Favored 'General case' 0 N--CA 1.454 -0.247 0 N-CA-C 112.473 0.546 . . . . 46.91 112.473 -178.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' GLY . . . . . 0.662 ' O ' ' O ' ' A' ' 202' ' ' HOH . . . 82.18 -33.66 2.68 Favored Glycine 0 N--CA 1.442 -0.955 0 CA-C-N 118.082 0.401 . . . . 60.38 114.067 178.79 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' SER . . . . . . . . . . . . . 18.3 p -151.63 -179.57 7.53 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 108.17 -1.048 . . . . 52.2 108.17 -175.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 33.2 mmtt -67.06 131.18 45.31 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.909 -0.587 . . . . 47.3 109.896 177.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 3.3 p90 -102.49 163.71 12.07 Favored 'General case' 0 C--N 1.321 -0.634 0 CA-C-O 121.997 0.903 . . . . 37.97 110.292 -177.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -71.28 152.05 43.65 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 114.627 -1.17 . . . . 45.73 110.827 -173.398 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -58.74 122.22 12.99 Favored 'General case' 0 CA--C 1.517 -0.319 0 CA-C-N 115.44 -0.8 . . . . 47.6 109.319 172.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 18.1 tt0 -71.7 -54.99 8.55 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 120.071 -0.652 . . . . 42.26 111.513 -176.002 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 4.2 t -164.62 142.31 6.55 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 120.336 -0.546 . . . . 37.32 109.849 -173.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' PHE . . . . . . . . . . . . . 51.0 m-85 -105.6 19.48 20.49 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 123.422 0.689 . . . . 36.81 112.562 -179.044 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' LYS . . . . . . . . . . . . . 43.4 mttm -83.89 -24.49 30.79 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 113.293 0.849 . . . . 48.7 113.293 -170.822 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 36.0 mt -88.99 118.83 35.07 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.556 0 N-CA-C 107.032 -1.47 . . . . 32.89 107.032 168.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' THR . . . . . . . . . . . . . 2.1 p -102.33 170.22 8.21 Favored 'General case' 0 C--N 1.32 -0.704 0 CA-C-O 121.46 0.648 . . . . 37.36 110.364 -169.447 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HIS . . . . . . . . . . . . . 73.6 m80 -88.0 65.14 8.13 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 122.576 1.179 . . . . 34.37 110.883 -173.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 93.9 m-20 -81.88 -22.29 36.97 Favored 'General case' 0 C--O 1.24 0.584 0 C-N-CA 118.359 -1.336 . . . . 46.63 113.308 -163.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' GLY . . . . . . . . . . . . . . . -159.72 -175.45 30.7 Favored Glycine 0 N--CA 1.442 -0.955 0 CA-C-N 118.678 0.672 . . . . 32.72 111.91 -178.606 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -69.47 164.09 35.56 Favored 'Trans proline' 0 C--N 1.328 -0.533 0 CA-C-O 121.876 0.698 . . . . 30.66 111.666 178.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 77.39 20.59 74.58 Favored Glycine 0 C--N 1.335 0.507 0 CA-C-N 115.0 -1.0 . . . . 31.28 114.96 173.037 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 73.1 mt -95.8 135.22 37.8 Favored 'General case' 0 C--O 1.24 0.562 0 CA-C-N 118.728 1.264 . . . . 29.18 109.676 175.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 5.4 mt -81.09 128.77 34.1 Favored 'General case' 0 CA--C 1.517 -0.301 0 CA-C-N 115.64 -0.709 . . . . 28.36 109.416 168.561 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' SER . . . . . 0.403 ' HB3' ' CZ ' ' A' ' 133' ' ' PHE . 47.6 t -143.78 154.8 43.81 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.399 0.618 . . . . 29.8 109.798 178.089 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 95.4 mmm -81.98 123.83 29.23 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.279 -0.873 . . . . 30.84 110.486 -176.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' ALA . . . . . 0.677 ' O ' ' O ' ' A' ' 201' ' ' HOH . . . -72.86 145.73 46.71 Favored 'General case' 0 C--N 1.326 -0.449 0 C-N-CA 119.51 -0.876 . . . . 30.93 109.345 166.736 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ASN . . . . . 0.517 ' HB2' ' OG1' ' A' ' 127' ' ' THR . 14.3 p30 -144.31 178.8 7.66 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 118.613 -1.235 . . . . 33.41 108.623 178.42 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' SER . . . . . . . . . . . . . 52.1 p -123.18 44.82 2.57 Favored 'General case' 0 C--N 1.325 -0.48 0 C-N-CA 124.12 0.968 . . . . 39.14 109.587 170.207 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 117.02 -173.92 14.95 Favored Glycine 0 N--CA 1.441 -1.01 0 CA-C-O 121.916 0.731 . . . . 43.55 111.869 -176.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_exo -66.58 133.41 31.96 Favored 'Trans proline' 0 C--N 1.329 -0.451 0 C-N-CA 119.848 0.365 . . . . 41.32 111.248 -176.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' ASN . . . . . . . . . . . . . 60.7 m-20 64.82 36.24 8.05 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-N 115.806 -0.633 . . . . 45.76 111.951 171.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' THR . . . . . 0.517 ' OG1' ' HB2' ' A' ' 122' ' ' ASN . 73.9 p -117.91 31.48 6.68 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 122.512 0.325 . . . . 36.41 111.336 -179.342 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ASN . . . . . . . . . . . . . 70.4 m-80 -74.72 126.58 31.19 Favored 'General case' 0 CA--C 1.518 -0.288 0 N-CA-C 109.71 -0.478 . . . . 36.91 109.71 -176.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . -118.28 -103.2 2.15 Favored Glycine 0 N--CA 1.445 -0.715 0 N-CA-C 110.78 -0.928 . . . . 32.94 110.78 178.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' SER . . . . . . . . . . . . . 61.3 p -125.74 -7.45 6.76 Favored 'General case' 0 C--N 1.325 -0.466 0 N-CA-C 112.885 0.698 . . . . 27.46 112.885 172.648 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' GLN . . . . . . . . . . . . . 58.4 mt-30 -75.22 131.44 40.4 Favored 'General case' 0 C--N 1.316 -0.868 0 C-N-CA 119.813 -0.755 . . . . 27.91 109.713 -178.189 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' PHE . . . . . . . . . . . . . 52.4 p90 -124.21 168.93 12.27 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 107.941 -1.133 . . . . 27.9 107.941 -178.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' PHE . . . . . 0.403 ' CZ ' ' HB3' ' A' ' 119' ' ' SER . 38.5 p90 -142.92 156.49 44.91 Favored 'General case' 0 C--N 1.322 -0.617 0 C-N-CA 118.601 -1.24 . . . . 26.05 108.565 165.288 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 60.9 mt -111.64 118.73 58.27 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.562 0 N-CA-C 107.302 -1.37 . . . . 26.64 107.302 174.107 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' THR . . . . . . . . . . . . . 26.0 p -63.72 149.64 46.25 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 121.694 0.759 . . . . 28.4 110.661 175.106 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 61.1 p -120.66 3.4 10.66 Favored 'General case' 0 C--N 1.327 -0.392 0 O-C-N 122.003 -0.435 . . . . 27.07 112.002 167.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' VAL . . . . . . . . . . . . . 27.0 m -151.16 166.53 14.9 Favored Pre-proline 0 C--O 1.239 0.535 0 N-CA-C 105.009 -2.219 . . . . 26.78 105.009 178.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_exo -67.42 136.78 41.0 Favored 'Trans proline' 0 C--O 1.234 0.281 0 CA-C-N 119.755 0.948 . . . . 30.9 111.0 170.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' CYS . . . . . . . . . . . . . 56.5 m -125.3 57.13 15.83 Favored Pre-proline 0 CA--C 1.515 -0.399 0 CA-C-N 115.75 -0.659 . . . . 38.19 110.486 -176.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -54.3 -24.92 36.53 Favored 'Trans proline' 0 C--O 1.238 0.511 0 CA-C-N 118.599 0.535 . . . . 33.03 113.146 -175.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' TRP . . . . . . . . . . . . . 43.5 p90 -74.81 -13.73 60.61 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 112.835 0.68 . . . . 35.82 112.835 -176.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' LEU . . . . . . . . . . . . . 27.4 mt -85.8 -3.25 58.86 Favored 'General case' 0 C--O 1.239 0.544 0 CA-C-N 119.144 0.884 . . . . 33.73 112.427 173.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' ASN . . . . . . . . . . . . . 92.1 m-20 -63.31 135.7 57.2 Favored 'General case' 0 CA--C 1.517 -0.292 0 CA-C-O 121.096 0.474 . . . . 35.53 110.525 -179.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' GLY . . . . . . . . . . . . . . . 80.6 -8.31 55.21 Favored Glycine 0 N--CA 1.439 -1.123 0 CA-C-O 118.705 -1.053 . . . . 32.83 115.351 -174.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 3.7 mttm -110.12 -37.0 5.69 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 119.068 1.434 . . . . 52.02 113.648 176.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' HIS . . . . . . . . . . . . . 82.6 m-70 -122.75 132.95 54.46 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 118.308 0.504 . . . . 34.19 109.872 -178.537 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' VAL . . . . . . . . . . . . . 77.6 t -81.27 112.0 18.66 Favored 'Isoleucine or valine' 0 C--O 1.235 0.338 0 C-N-CA 123.722 0.809 . . . . 28.17 109.722 -177.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' VAL . . . . . . . . . . . . . 60.5 t -76.26 137.93 21.72 Favored 'Isoleucine or valine' 0 C--O 1.242 0.675 0 N-CA-C 108.392 -0.966 . . . . 29.02 108.392 170.535 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' PHE . . . . . . . . . . . . . 52.5 p90 -145.53 4.56 1.03 Allowed 'General case' 0 C--O 1.239 0.527 0 N-CA-C 113.281 0.845 . . . . 28.48 113.281 -172.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . -174.44 178.7 46.16 Favored Glycine 0 N--CA 1.452 -0.291 0 CA-C-N 118.76 0.709 . . . . 26.57 111.479 -177.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' LYS . . . . . . . . . . . . . 56.9 pttt -149.69 158.6 44.33 Favored 'General case' 0 C--N 1.325 -0.468 0 C-N-CA 118.943 -1.103 . . . . 33.83 109.983 178.827 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' VAL . . . . . . . . . . . . . 5.5 t -71.62 128.34 34.57 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 CA-C-N 114.463 -1.244 . . . . 30.79 108.955 170.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 10.1 pt -115.93 -20.01 6.09 Favored 'Isoleucine or valine' 0 C--O 1.24 0.583 0 CA-C-N 115.954 -0.567 . . . . 33.19 111.816 178.516 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' GLU . . . . . 0.461 ' HB3' ' HB2' ' A' ' 34' ' ' LYS . 52.3 tt0 -149.88 142.29 24.31 Favored 'General case' 0 C--N 1.323 -0.583 0 N-CA-C 108.653 -0.869 . . . . 56.13 108.653 171.897 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' GLY . . . . . . . . . . . . . . . 89.13 23.45 34.8 Favored Glycine 0 C--O 1.239 0.463 0 N-CA-C 115.843 1.097 . . . . 36.87 115.843 173.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' MET . . . . . . . . . . . . . 14.7 tpt -57.78 -25.71 60.91 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-N 118.227 1.014 . . . . 36.6 111.862 173.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' GLU . . . . . 0.498 ' H ' ' CD ' ' A' ' 157' ' ' GLU . 2.3 mp0 -58.23 -25.85 62.18 Favored 'General case' 0 C--O 1.241 0.648 0 O-C-N 121.737 -0.602 . . . . 48.23 111.474 176.315 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' ILE . . . . . 0.426 HD12 ' O ' ' A' ' 32' ' ' THR . 70.6 mt -85.95 -38.14 12.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.363 0 CA-C-O 120.846 0.355 . . . . 35.4 111.096 -179.151 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' VAL . . . . . . . . . . . . . 95.4 t -54.65 -45.49 72.54 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 C-N-CA 120.068 -0.653 . . . . 32.6 109.84 167.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -60.33 -32.75 71.54 Favored 'General case' 0 C--O 1.239 0.548 0 O-C-N 122.099 -0.376 . . . . 30.76 111.413 177.329 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' LYS . . . . . . . . . . . . . 18.9 ttmt -72.58 -48.31 40.93 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 121.033 -0.267 . . . . 54.16 111.579 -179.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' ILE . . . . . 0.457 ' O ' HG11 ' A' ' 76' ' ' VAL . 22.4 mt -56.78 -40.06 68.25 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.392 0 CA-C-O 120.898 0.38 . . . . 33.03 110.464 175.824 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' GLU . . . . . . . . . . . . . 47.4 tt0 -58.18 -43.24 87.39 Favored 'General case' 0 C--O 1.242 0.671 0 O-C-N 121.91 -0.494 . . . . 32.54 111.371 179.381 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' SER . . . . . . . . . . . . . 94.8 p -64.81 -16.19 62.76 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 112.383 0.512 . . . . 29.89 112.383 -179.651 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' LEU . . . . . . . . . . . . . 56.7 mt -90.74 14.61 13.03 Favored 'General case' 0 C--N 1.326 -0.442 0 O-C-N 121.743 -0.598 . . . . 32.59 112.422 174.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' GLY . . . . . . . . . . . . . . . -95.37 -174.94 37.35 Favored Glycine 0 N--CA 1.447 -0.584 0 CA-C-O 122.429 1.016 . . . . 33.18 113.347 -177.537 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' SER . . . . . . . . . . . . . 35.1 p -143.38 168.23 20.3 Favored 'General case' 0 CA--C 1.521 -0.165 0 C-N-CA 124.469 1.107 . . . . 32.91 108.101 174.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' GLN . . . . . . . . . . . . . 85.4 mm-40 -71.69 -34.31 69.54 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 117.146 -1.822 . . . . 57.47 111.124 178.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' SER . . . . . . . . . . . . . 10.1 p -59.98 -25.83 65.54 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 120.512 -0.475 . . . . 33.47 111.837 168.04 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' GLY . . . . . 0.42 ' HA2' HG12 ' A' ' 77' ' ' ILE . . . 96.73 -6.96 65.13 Favored Glycine 0 N--CA 1.437 -1.29 0 CA-C-O 119.009 -0.884 . . . . 29.06 114.151 177.317 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' THR . . . . . . . . . . . . . 3.8 m -67.72 130.73 92.92 Favored Pre-proline 0 C--N 1.324 -0.524 0 CA-C-N 118.134 0.967 . . . . 29.65 108.529 177.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' PRO . . . . . . . . . . . . . 22.2 Cg_exo -72.58 150.47 51.21 Favored 'Trans proline' 0 C--N 1.328 -0.516 0 CA-C-N 118.87 0.632 . . . . 32.31 111.331 -176.347 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' LYS . . . . . . . . . . . . . 14.4 mttt -96.25 4.54 52.3 Favored 'General case' 0 C--O 1.234 0.283 0 N-CA-C 113.113 0.783 . . . . 35.42 113.113 177.008 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' ALA . . . . . . . . . . . . . . . -148.07 169.44 19.95 Favored 'General case' 0 C--N 1.325 -0.497 0 N-CA-C 107.156 -1.424 . . . . 30.51 107.156 172.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' LYS . . . . . 0.752 ' HG2' HD11 ' A' ' 177' ' ' ILE . 9.9 tttt -88.98 104.23 16.78 Favored 'General case' 0 C--N 1.327 -0.407 0 N-CA-C 107.525 -1.287 . . . . 51.01 107.525 175.082 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' ILE . . . . . . . . . . . . . 2.6 mp -102.34 126.01 56.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 N-CA-C 108.166 -1.05 . . . . 32.61 108.166 -178.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' ILE . . . . . 0.752 HD11 ' HG2' ' A' ' 175' ' ' LYS . 3.6 mp -129.83 144.55 37.71 Favored 'Isoleucine or valine' 0 C--O 1.234 0.288 0 CA-C-O 121.813 0.816 . . . . 45.71 110.607 -169.91 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' ILE . . . . . . . . . . . . . 72.9 mt -81.17 89.8 1.8 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.447 0 N-CA-C 107.764 -1.199 . . . . 32.22 107.764 162.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' ALA . . . . . . . . . . . . . . . -69.29 -34.77 75.22 Favored 'General case' 0 N--CA 1.463 0.21 0 C-N-CA 120.739 -0.384 . . . . 34.74 111.603 -176.095 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 180' ' ' ASP . . . . . . . . . . . . . 31.7 t0 -154.53 163.64 39.9 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-O 121.754 0.788 . . . . 47.23 109.675 169.483 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 181' ' ' CYS . . . . . . . . . . . . . 4.6 p -161.11 154.45 21.61 Favored 'General case' 0 N--CA 1.449 -0.494 0 CA-C-N 114.789 -1.096 . . . . 34.83 108.331 -173.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' GLY . . . . . . . . . . . . . . . -170.46 -171.53 35.95 Favored Glycine 0 N--CA 1.448 -0.513 0 C-N-CA 119.073 -1.537 . . . . 36.96 110.915 176.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 183' ' ' GLU . . . . . . . . . . . . . 74.1 tt0 -100.99 150.72 22.59 Favored 'General case' 0 C--N 1.325 -0.478 0 CA-C-O 121.56 0.695 . . . . 43.43 109.639 173.14 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 184' ' ' ILE . . . . . . . . . . . . . 5.9 mt -100.95 95.63 4.16 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.589 0 N-CA-C 105.997 -1.853 . . . . 47.23 105.997 171.453 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 185' ' ' THR . . . . . . . . . . . . . 2.2 p -85.84 128.49 34.83 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 107.624 -1.25 . . . . 60.01 107.624 168.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 186' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 . . . . . 0 C--O 1.237 0.419 0 N-CA-C 113.543 0.942 . . . . 76.76 113.543 -172.615 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . 0.677 ' O ' ' O ' ' A' ' 121' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . 0.662 ' O ' ' O ' ' A' ' 100' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . 0.639 ' O ' ' OE1' ' A' ' 56' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . 0.606 ' O ' ' OE2' ' A' ' 96' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_