data_6gt6_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 6gt6 _Structure_validation_residue.Date_analyzed 2019-07-12 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 ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 39.5 t . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 117.932 -1.033 . . . . 37.44 108.417 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 2.6 m -94.61 143.69 11.24 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 O-C-N 123.931 0.769 . . . . 37.6 109.562 177.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' GLY . . . . . . . . . . . . . . . 59.19 42.92 97.42 Favored Glycine 0 CA--C 1.525 0.668 0 CA-C-O 119.191 -0.783 . . . . 39.01 112.304 -176.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -117.76 -170.29 15.07 Favored Glycine 0 N--CA 1.485 1.926 0 CA-C-O 118.77 -1.017 . . . . 33.72 111.41 179.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 18.1 mt -136.36 144.03 44.37 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 118.134 0.967 . . . . 32.13 109.608 -174.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 38.6 t -52.93 133.95 15.18 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.281 0 N-CA-C 107.038 -1.467 . . . . 31.74 107.038 169.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' ALA . . . . . . . . . . . . . . . -96.63 154.36 17.32 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 123.109 0.563 . . . . 36.23 109.568 -178.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 87.5 mt -64.73 154.74 35.87 Favored 'General case' 0 C--O 1.211 -0.931 0 N-CA-C 108.687 -0.857 . . . . 39.67 108.687 171.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 15.3 mtt-85 -53.09 128.84 28.99 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 122.288 1.042 . . . . 71.55 108.949 164.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.54 7.7 88.28 Favored Glycine 0 N--CA 1.449 -0.468 0 CA-C-O 119.298 -0.723 . . . . 41.49 112.567 174.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.63 -39.5 84.51 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 117.548 0.674 . . . . 36.63 109.813 -178.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 75.2 m-70 -130.78 79.54 71.61 Favored Pre-proline 0 N--CA 1.488 1.457 0 N-CA-C 107.768 -1.197 . . . . 38.54 107.768 -178.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_endo -78.87 0.97 9.54 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 121.556 1.504 . . . . 33.66 113.615 -172.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' TYR . . . . . . . . . . . . . 2.5 p90 -97.08 -2.41 43.3 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.167 0.987 . . . . 36.31 112.247 178.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 13.2 tt -85.11 137.33 21.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 CA-C-O 121.784 0.802 . . . . 30.49 109.197 -175.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -113.96 137.53 51.57 Favored 'General case' 0 N--CA 1.425 -1.697 0 CA-C-N 114.049 -1.432 . . . . 30.65 108.353 -177.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -102.55 126.38 49.59 Favored 'General case' 0 N--CA 1.443 -0.78 0 O-C-N 124.61 1.194 . . . . 29.92 108.519 170.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 10.9 mp -108.27 122.69 47.48 Favored 'General case' 0 C--O 1.212 -0.907 0 C-N-CA 124.478 1.111 . . . . 35.25 109.829 179.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' TYR . . . . . . . . . . . . . 46.6 m-85 -124.92 130.94 53.37 Favored 'General case' 0 C--O 1.243 0.753 0 N-CA-C 109.327 -0.619 . . . . 31.9 109.327 177.467 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' TRP . . . . . . . . . . . . . 12.0 p90 -152.29 146.05 25.09 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 114.874 -1.057 . . . . 35.9 108.917 166.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 48.92 -126.7 18.47 Favored Glycine 0 C--N 1.337 0.616 0 N-CA-C 110.666 -0.974 . . . . 43.39 110.666 174.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' HIS . . . . . . . . . . . . . 34.3 m80 -107.06 38.16 2.18 Favored 'General case' 0 C--O 1.22 -0.448 0 N-CA-C 109.384 -0.598 . . . . 65.83 109.384 174.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' SER . . . . . . . . . . . . . 37.5 m -126.66 162.37 25.9 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 124.098 0.959 . . . . 35.07 110.988 -173.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -155.45 141.55 18.34 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 114.669 -1.151 . . . . 35.35 110.683 -176.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' CYS . . . . . . . . . . . . . 1.3 m -152.92 170.97 19.08 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-O 122.4 1.095 . . . . 40.83 111.173 167.488 -94.888 -141.381 -87.659 104.332 2.04 102.861 -80.821 -90.605 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' ALA . . . . . . . . . . . . . . . -110.15 163.67 13.38 Favored 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 114.355 -1.293 . . . . 30.48 108.512 176.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' GLY . . . . . . . . . . . . . . . -156.76 178.09 33.36 Favored Glycine 0 N--CA 1.423 -2.19 0 CA-C-N 114.587 -1.188 . . . . 31.74 111.166 174.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 36.7 m -126.15 119.24 27.01 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 109.357 -0.609 . . . . 31.45 109.357 -175.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 23.9 tp -70.11 117.64 11.93 Favored 'General case' 0 C--O 1.209 -1.07 0 N-CA-C 108.538 -0.912 . . . . 30.82 108.538 174.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' ILE . . . . . . . . . . . . . 22.6 pt -105.5 -15.58 8.45 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.614 0 C-N-CA 123.367 0.667 . . . . 31.92 110.938 -179.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -156.88 162.25 27.97 Favored Pre-proline 0 C--N 1.322 -0.595 0 N-CA-C 106.875 -1.528 . . . . 29.29 106.875 173.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_exo -49.54 -32.85 28.72 Favored 'Trans proline' 0 C--N 1.348 0.521 0 CA-C-N 120.722 1.294 . . . . 31.78 114.236 -176.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' CYS . . . . . . . . . . . . . 99.3 m -106.79 5.44 28.58 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 124.825 1.328 . . . . 35.23 114.165 -178.129 -65.589 -63.963 101.141 102.695 1.933 103.926 137.782 -71.803 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' TRP . . . . . . . . . . . . . 99.0 m95 -131.1 132.03 44.57 Favored 'General case' 0 C--O 1.245 0.852 0 O-C-N 121.154 -0.967 . . . . 32.8 111.678 -169.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 37.6 t -126.32 137.87 56.42 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 CA-C-N 115.393 -0.821 . . . . 24.17 109.005 178.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 8.5 tp -110.52 140.18 45.06 Favored 'General case' 0 C--O 1.217 -0.608 0 N-CA-C 108.974 -0.75 . . . . 34.59 108.974 177.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' THR . . . . . . . . . . . . . 9.5 t -151.34 -171.29 3.89 Favored 'General case' 0 C--O 1.216 -0.676 0 C-N-CA 123.279 0.632 . . . . 30.49 109.327 178.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . -88.76 153.79 20.8 Favored 'General case' 0 N--CA 1.44 -0.972 0 N-CA-C 107.957 -1.127 . . . . 33.64 107.957 179.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.75 -42.36 73.99 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.618 -0.719 . . . . 34.38 109.364 176.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' HIS . . . . . . . . . . . . . 5.3 p-80 -59.26 -34.26 72.04 Favored 'General case' 0 C--O 1.212 -0.918 0 O-C-N 123.61 0.569 . . . . 30.41 110.387 -173.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' CYS . . . . . . . . . . . . . 1.7 m -52.68 -43.31 65.47 Favored 'General case' 0 N--CA 1.439 -1.006 0 C-N-CA 124.232 1.013 . . . . 34.56 111.932 179.171 -90.605 -80.821 -87.659 102.861 2.04 104.332 -141.381 -94.888 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 43.4 mt -113.28 18.79 17.58 Favored 'General case' 0 C--O 1.217 -0.644 0 O-C-N 125.149 1.531 . . . . 30.1 111.595 -174.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -33.04 -43.55 0.1 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.983 1.713 . . . . 39.4 111.954 166.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' A ASP . . . . . . . . . . . . . 17.3 p-10 -78.56 -3.56 44.33 Favored 'General case' 0 C--O 1.209 -1.067 0 CA-C-N 115.875 -0.602 . . . . 47.24 110.209 -169.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' B ARG . . . . . . . . . . . . . 6.8 mpt_? 58.47 48.36 2.46 Favored Pre-proline 0 N--CA 1.47 0.549 0 C-N-CA 124.533 1.133 . . . . 42.9 111.138 169.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' C PRO . . . . . . . . . . . . . 37.6 Cg_endo -59.6 146.16 96.05 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 CA-C-N 120.434 1.191 . . . . 33.63 110.508 179.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' D ALA . . . . . . . . . . . . . . . -58.59 142.57 82.85 Favored Pre-proline 0 N--CA 1.457 -0.108 0 N-CA-C 107.514 -1.291 . . . . 32.12 107.514 173.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -62.5 -27.99 77.32 Favored 'Trans proline' 0 CA--C 1.538 0.716 0 C-N-CA 120.853 1.035 . . . . 27.16 111.598 -172.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 17.5 pm0 -64.61 -21.35 66.69 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 123.528 0.518 . . . . 30.17 110.277 179.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 88.6 m-20 -82.53 -11.66 58.3 Favored 'General case' 0 N--CA 1.438 -1.055 0 C-N-CA 123.381 0.672 . . . . 38.27 111.308 -176.161 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 47.3 mt -88.74 139.9 29.99 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 118.653 0.66 . . . . 32.8 109.87 -176.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' THR . . . . . . . . . . . . . 26.6 m -118.49 127.58 53.77 Favored 'General case' 0 C--O 1.246 0.904 0 C-N-CA 123.726 0.81 . . . . 28.19 109.605 163.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 92.5 t -108.31 128.71 63.61 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 N-CA-C 107.506 -1.294 . . . . 31.47 107.506 172.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' VAL . . . . . . . . . . . . . 18.4 t -114.25 123.0 69.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 N-CA-C 107.3 -1.37 . . . . 30.36 107.3 178.061 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 83.7 mt -108.15 147.6 31.05 Favored 'General case' 0 C--O 1.244 0.773 0 O-C-N 123.682 0.614 . . . . 32.65 109.943 176.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 72.86 38.06 56.59 Favored Glycine 0 C--N 1.344 1.024 0 O-C-N 124.745 1.278 . . . . 36.31 111.912 174.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -101.69 133.11 46.9 Favored 'General case' 0 C--O 1.21 -0.997 0 C-N-CA 124.6 1.16 . . . . 37.86 108.934 -172.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 56.5 tt0 -89.38 -47.43 8.02 Favored 'General case' 0 C--O 1.217 -0.611 0 C-N-CA 123.554 0.742 . . . . 53.63 110.444 179.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' ARG . . . . . . . . . . . . . 67.2 mtp180 -119.6 133.17 55.77 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 124.552 1.157 . . . . 47.77 111.412 -174.772 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 24.5 ttp180 -45.75 113.34 0.59 Allowed 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 125.349 1.46 . . . . 44.78 109.068 177.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 71.94 20.82 4.31 Favored 'General case' 0 N--CA 1.44 -0.929 0 C-N-CA 125.235 1.414 . . . . 39.89 110.781 167.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' HIS . . . . . . . . . . . . . 28.3 m80 -107.36 138.95 42.61 Favored 'General case' 0 C--O 1.246 0.905 0 C-N-CA 122.818 0.447 . . . . 65.96 110.854 174.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' SER . . . . . . . . . . . . . 1.4 m -71.72 155.24 40.7 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 113.699 -1.591 . . . . 52.41 106.984 171.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' CYS . . . . . . . . . . . . . 7.2 p -161.73 149.38 14.72 Favored 'General case' 0 C--O 1.213 -0.826 0 N-CA-C 108.284 -1.006 . . . . 42.87 108.284 -174.139 80.764 -72.017 108.062 111.236 2.121 106.724 57.615 -77.524 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -46.76 -56.04 12.84 Favored Pre-proline 0 N--CA 1.475 0.797 0 CA-C-O 119.391 -0.338 . . . . 82.4 110.818 -178.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_endo -88.14 7.77 4.38 Favored 'Trans proline' 0 CA--C 1.543 0.969 0 N-CA-C 117.222 1.97 . . . . 42.62 117.222 -176.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 36.5 m -61.33 142.68 56.72 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.876 0.369 . . . . 41.29 110.134 174.821 -77.524 57.615 108.062 106.724 2.121 111.236 -72.017 80.764 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -129.17 126.84 40.12 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 108.623 -0.88 . . . . 33.99 108.623 175.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' THR . . . . . . . . . . . . . 55.1 m -111.93 115.18 28.55 Favored 'General case' 0 C--O 1.211 -0.922 0 O-C-N 124.245 0.965 . . . . 31.8 109.625 -174.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 6.3 mp -120.03 155.03 33.72 Favored 'General case' 0 C--O 1.225 -0.214 0 O-C-N 123.672 0.607 . . . . 34.56 109.528 -179.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -86.98 176.41 7.66 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.415 1.486 . . . . 30.62 108.957 167.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' VAL . . . . . . . . . . . . . 91.4 t -121.65 131.93 71.94 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.972 0 N-CA-C 107.962 -1.125 . . . . 29.47 107.962 -178.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' ARG . . . . . . . . . . . . . 34.7 mtt-85 -71.88 -51.08 24.08 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 123.372 0.669 . . . . 31.4 109.819 177.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 96.9 p -168.17 161.77 12.56 Favored 'General case' 0 C--O 1.209 -1.031 0 CA-C-N 113.908 -1.497 . . . . 35.82 106.965 -164.122 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' TYR . . . . . . . . . . . . . 33.0 p90 -159.82 160.96 34.4 Favored 'General case' 0 N--CA 1.446 -0.67 0 O-C-N 123.339 0.399 . . . . 33.28 110.381 173.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 1.1 mmt85 -138.92 126.68 22.1 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 116.301 -0.409 . . . . 83.94 109.973 -175.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 11.2 mp -81.95 152.28 26.82 Favored 'General case' 0 C--O 1.21 -1.005 0 N-CA-C 107.684 -1.228 . . . . 33.48 107.684 166.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' HIS . . . . . . . . . . . . . 62.9 t-80 -64.43 122.23 16.23 Favored 'General case' 0 N--CA 1.439 -0.991 0 O-C-N 124.06 0.85 . . . . 37.92 109.303 170.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 59.7 mp0 -44.87 -35.47 2.82 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 127.152 2.181 . . . . 47.08 113.126 -179.655 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -102.82 9.96 38.68 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 118.147 -0.93 . . . . 36.49 112.031 -170.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -57.53 119.22 6.16 Favored 'General case' 0 C--O 1.205 -1.271 0 CA-C-O 118.774 -0.631 . . . . 35.76 110.051 -179.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 10.8 t -103.45 121.19 49.35 Favored Pre-proline 0 C--N 1.34 0.172 0 O-C-N 123.904 0.752 . . . . 40.96 110.746 -179.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -80.54 2.04 8.82 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 121.544 1.496 . . . . 41.76 114.989 171.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' VAL . . . . . . . . . . . . . 51.2 t -86.33 -55.95 5.97 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-O 121.905 0.859 . . . . 38.9 109.602 168.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' SER . . . . . . . . . . . . . 87.2 p -91.38 -20.55 21.69 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.585 1.154 . . . . 37.91 111.832 -173.206 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 22.9 m-30 71.77 12.78 6.24 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.914 2.086 . . . . 39.4 111.065 -175.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -75.66 150.59 37.91 Favored 'General case' 0 C--O 1.207 -1.139 0 CA-C-O 121.234 0.54 . . . . 44.31 110.006 -173.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' HIS . . . . . . . . . . . . . 35.2 m-70 61.6 46.54 7.18 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 123.746 0.818 . . . . 36.78 110.405 179.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -89.18 76.01 7.76 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 121.001 0.429 . . . . 31.91 110.205 -174.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -151.78 167.07 29.4 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 118.504 -1.278 . . . . 42.04 110.91 167.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -153.51 152.86 31.43 Favored 'General case' 0 N--CA 1.44 -0.972 0 O-C-N 125.677 1.861 . . . . 28.2 109.449 -177.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 59.4 tp -127.29 124.68 39.33 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.06 -1.089 . . . . 31.23 108.06 -173.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' LEU . . . . . . . . . . . . . 8.6 mp -108.05 131.9 54.11 Favored 'General case' 0 C--O 1.214 -0.815 0 O-C-N 124.091 0.87 . . . . 31.34 109.205 -179.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' ARG . . . . . 0.435 ' NH1' ' OE2' ' B' ' 109' A GLU . 32.2 tpt85 -94.97 120.36 35.05 Favored 'General case' 0 C--O 1.203 -1.366 0 N-CA-C 107.478 -1.304 . . . . 29.57 107.478 166.081 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' LEU . . . . . 0.424 ' O ' ' NH2' ' B' ' 107' ' ' ARG . 35.9 mt -77.02 163.47 26.65 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 123.26 0.35 . . . . 34.51 110.586 177.954 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 66.2 tp60 -95.81 121.28 37.37 Favored 'General case' 0 C--O 1.212 -0.877 0 C-N-CA 124.891 1.276 . . . . 36.77 110.518 179.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' A GLU . . . . . 0.435 ' OE2' ' NH1' ' B' ' 107' ' ' ARG . 53.3 mp0 -56.94 138.54 53.89 Favored 'General case' 0 C--O 1.21 -1.006 0 C-N-CA 123.862 0.865 . . . . 30.58 109.437 172.42 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 109' B ASP . . . . . 0.728 ' O ' ' O ' ' B' ' 109' D ASP . 11.2 p30 -68.52 -178.08 1.06 Allowed 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 107.978 -1.119 . . . . 33.63 107.978 170.562 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 109' C ALA . . . . . . . . . . . . . . . -69.03 -27.12 65.37 Favored 'General case' 0 C--O 1.217 -0.643 0 N-CA-C 114.111 1.152 . . . . 34.03 114.111 -171.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' D ASP . . . . . 0.728 ' O ' ' O ' ' B' ' 109' B ASP . 14.7 m-20 -71.22 178.06 3.52 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 103.35 -2.833 . . . . 51.64 103.35 153.897 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 109' E GLY . . . . . . . . . . . . . . . -93.35 25.18 21.83 Favored Glycine 0 N--CA 1.486 2.005 1 C-N-CA 113.186 -4.34 . . . . 37.11 115.503 -170.499 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 2.6 p -107.9 147.2 31.3 Favored 'General case' 0 N--CA 1.492 1.654 0 CA-C-N 119.028 1.414 . . . . 39.9 112.338 -164.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' CYS . . . . . . . . . . . . 0.3 68.9 m -103.02 -154.72 0.5 Allowed 'General case' 0 N--CA 1.479 1.019 1 N-CA-C 97.698 -4.927 . . . . 36.01 97.698 173.452 -71.803 137.782 101.141 103.926 1.933 102.695 -63.963 -65.589 3 2 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -32.2 124.96 0.3 Allowed 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 116.931 2.197 . . . . 39.25 116.931 179.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 31.9 mt -91.65 116.61 29.02 Favored 'General case' 0 C--O 1.214 -0.78 0 N-CA-C 107.656 -1.239 . . . . 36.98 107.656 173.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 21.5 mt -64.5 143.57 57.82 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 109.077 -0.712 . . . . 46.57 109.077 -175.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' SER . . . . . . . . . . . . . 28.4 p -154.69 174.22 4.07 Favored Pre-proline 0 N--CA 1.425 -1.715 0 N-CA-C 106.737 -1.579 . . . . 39.62 106.737 -177.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' PRO . . . . . . . . . . . . . 49.0 Cg_endo -65.87 -11.34 30.43 Favored 'Trans proline' 0 CA--C 1.544 1.002 0 CA-C-N 119.546 0.874 . . . . 45.04 113.072 172.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -106.54 -12.42 15.61 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 124.137 0.975 . . . . 55.57 112.55 -178.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 53.9 t -136.79 111.22 9.89 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.907 0 N-CA-C 108.431 -0.952 . . . . 36.89 108.431 -172.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' GLN . . . . . . . . . . . . . 21.2 tp60 -154.2 131.35 6.02 Favored Pre-proline 0 N--CA 1.442 -0.849 0 N-CA-C 107.252 -1.388 . . . . 46.07 107.252 -167.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -70.32 168.11 23.22 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 N-CA-C 108.5 -1.385 . . . . 37.44 108.5 177.153 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' VAL . . . . . . . . . . . . . 4.9 p -124.9 127.7 72.69 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.906 0 N-CA-C 107.478 -1.304 . . . . 37.66 107.478 172.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' CYS . . . . . 0.454 ' N ' ' SG ' ' B' ' 306' ' ' CYS . 82.5 m -52.99 148.74 7.37 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 121.81 0.814 . . . . 68.02 110.381 -179.338 -59.257 -22.755 -94.455 91.207 1.985 118.89 -133.206 -76.716 2 2 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' LEU . . . . . . . . . . . . . 92.4 mt -75.0 162.07 74.92 Favored Pre-proline 0 N--CA 1.429 -1.493 0 N-CA-C 107.999 -1.111 . . . . 47.47 107.999 167.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -76.17 -175.68 2.66 Favored 'Trans proline' 0 CA--C 1.536 0.576 0 N-CA-C 109.238 -1.101 . . . . 56.92 109.238 173.041 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 5.0 p -122.97 -7.63 8.37 Favored 'General case' 0 N--CA 1.481 1.12 0 O-C-N 123.389 0.431 . . . . 75.17 111.221 165.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 57.03 59.91 10.0 Favored Glycine 0 C--N 1.337 0.601 0 N-CA-C 112.036 -0.426 . . . . 82.21 112.036 176.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.304 0 C-N-CA 124.051 0.94 . . . . 84.11 109.239 -178.728 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo . . . . . 0 CA--C 1.538 0.684 0 N-CA-C 112.783 0.263 . . . . 104.35 112.783 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 71.1 m -161.03 57.45 0.3 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.213 0.605 . . . . 109.62 110.508 -172.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 22.5 tp10 -72.61 107.11 4.93 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.601 0.76 . . . . 108.24 110.091 -179.106 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' THR . . . . . . . . . . . . . 16.6 m 70.2 50.27 0.43 Allowed 'General case' 0 N--CA 1.499 1.988 0 C-N-CA 125.433 1.493 . . . . 106.18 111.527 169.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 134' ' ' THR . . . . . . . . . . . . . 1.2 m -89.42 175.87 7.14 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 108.416 -0.957 . . . . 105.06 108.416 166.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 135' ' ' LEU . . . . . . . . . . . . . 2.1 tp -71.08 106.17 3.62 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 109.164 -0.68 . . . . 80.4 109.164 166.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 136' ' ' CYS . . . . . . . . . . . . . 78.4 m -120.62 128.46 53.04 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 122.868 0.467 . . . . 55.91 109.991 177.237 -63.808 -89.349 113.351 107.462 2.078 104.712 -96.999 -50.227 1 1 . 1 . 001 ecloud orig full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 -110.43 144.57 39.02 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.953 -0.567 . . . . 49.13 110.013 176.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 138' ' ' VAL . . . . . . . . . . . . . 4.7 p -112.23 149.53 14.78 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 N-CA-C 107.781 -1.192 . . . . 35.81 107.781 165.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -141.33 151.21 43.4 Favored 'General case' 0 N--CA 1.483 1.185 0 CA-C-O 121.241 0.543 . . . . 33.9 111.396 177.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 140' ' ' GLY . . . . . . . . . . . . . . . 177.27 168.68 37.41 Favored Glycine 0 N--CA 1.472 1.081 0 CA-C-O 122.334 0.963 . . . . 32.37 114.189 -178.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 141' ' ' TRP . . . . . . . . . . . . . 22.6 m-90 -108.16 12.47 26.66 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-N 114.441 -0.88 . . . . 30.41 110.535 179.226 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 142' ' ' GLY . . . . . . . . . . . . . . . -70.26 -163.99 4.68 Favored Glycine 0 CA--C 1.525 0.663 0 CA-C-O 123.466 1.592 . . . . 29.74 113.484 -176.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 143' ' ' HIS . . . . . . . . . . . . . 38.6 m170 -63.83 138.87 58.67 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 114.336 -0.932 . . . . 32.24 109.719 -177.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -85.53 -10.05 56.55 Favored 'General case' 0 C--O 1.223 -0.32 0 O-C-N 124.444 1.09 . . . . 40.23 110.506 178.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 145' ' ' PHE . . . . . . . . . . . . . 50.8 p90 -163.78 145.51 9.2 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 125.647 1.579 . . . . 42.7 108.499 174.08 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 63.3 tt0 -51.67 130.85 29.3 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-O 121.296 0.57 . . . . 69.67 110.857 -176.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . 65.8 29.44 75.08 Favored Glycine 0 C--O 1.205 -1.671 0 CA-C-N 115.406 -0.816 . . . . 45.69 112.654 177.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -64.97 166.61 8.99 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 108.365 -0.976 . . . . 45.71 108.365 163.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 149' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -91.8 -32.12 15.48 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 122.881 0.472 . . . . 70.15 109.728 -165.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -134.46 153.08 52.11 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.727 1.211 . . . . 54.49 109.689 -178.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 151' ' ' TYR . . . . . . . . . . . . . 13.5 m-30 -65.39 158.43 26.66 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 108.316 -0.994 . . . . 36.76 108.316 167.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -65.03 160.06 21.74 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 116.446 -0.343 . . . . 29.34 110.31 178.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 48.2 t -92.66 -66.18 0.94 Allowed 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 122.706 0.402 . . . . 36.4 110.604 171.542 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 154' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -71.83 146.39 48.01 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 109.256 -0.646 . . . . 39.49 109.256 174.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 155' ' ' LEU . . . . . . . . . . . . . 47.6 tp -64.53 143.01 58.22 Favored 'General case' 0 N--CA 1.435 -1.22 0 O-C-N 124.491 1.119 . . . . 32.8 108.787 176.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 156' ' ' GLN . . . . . . . . . . . . . 52.9 mm-40 -115.1 153.42 30.77 Favored 'General case' 0 C--O 1.217 -0.622 0 N-CA-C 107.232 -1.395 . . . . 40.14 107.232 -179.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 157' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -134.07 152.69 51.95 Favored 'General case' 0 N--CA 1.451 -0.415 0 O-C-N 124.583 1.177 . . . . 37.03 108.048 176.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -149.85 147.9 28.51 Favored 'General case' 0 C--O 1.212 -0.87 0 CA-C-N 115.916 -0.584 . . . . 38.98 109.647 171.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 159' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -88.83 137.67 32.1 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 106.673 -1.603 . . . . 92.14 106.673 170.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 160' ' ' VAL . . . . . . . . . . . . . 5.4 p -149.29 129.5 6.71 Favored Pre-proline 0 N--CA 1.403 -2.795 0 N-CA-C 107.317 -1.364 . . . . 45.97 107.317 -173.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 161' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -86.8 144.92 7.61 Favored 'Trans proline' 0 CA--C 1.536 0.582 0 C-N-CA 121.396 1.397 . . . . 48.36 112.965 -176.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 162' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -57.26 161.02 3.5 Favored 'General case' 0 C--O 1.206 -1.211 0 N-CA-C 107.968 -1.123 . . . . 96.0 107.968 171.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 18.6 mt -139.72 144.79 37.67 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.904 0.383 . . . . 75.04 110.038 174.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 46.2 t -64.45 156.15 30.41 Favored 'General case' 0 N--CA 1.436 -1.151 0 N-CA-C 108.194 -1.039 . . . . 88.81 108.194 179.247 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 1.1 tp -67.18 -48.04 69.15 Favored 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 124.416 1.073 . . . . 76.18 109.488 173.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -45.29 -55.44 5.91 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 108.998 -0.742 . . . . 95.61 108.998 175.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 167' ' ' ARG . . . . . 0.523 ' NE ' ' O ' ' B' ' 402' ' ' HOH . 12.2 mtp180 -67.91 -38.94 83.57 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 124.051 0.844 . . . . 95.43 110.293 -173.61 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 168' ' ' CYS . . . . . . . . . . . . . 37.0 t -74.75 -37.37 62.5 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 112.064 0.394 . . . . 73.83 112.064 -177.087 -171.827 175.619 -80.708 104.573 2.008 102.396 -173.705 -45.211 1 1 . 1 . 001 ecloud orig full ' B' B ' 169' ' ' SER . . . . . . . . . . . . . 89.6 p -81.01 4.51 19.39 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 119.354 -0.355 . . . . 60.24 111.558 -178.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 169' A ALA . . . . . . . . . . . . . . . -54.65 137.97 62.18 Favored Pre-proline 0 N--CA 1.449 -0.476 0 N-CA-C 109.554 -0.536 . . . . 63.43 109.554 177.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 169' B PRO . . . . . . . . . . . . . 54.9 Cg_exo -47.2 -30.77 11.16 Favored 'Trans proline' 0 C--N 1.357 1.018 0 N-CA-C 117.281 1.993 . . . . 68.8 117.281 -175.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 15.1 p30 -105.75 4.79 30.34 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 120.66 0.267 . . . . 76.99 110.64 -174.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 171' ' ' VAL . . . . . . . . . . . . . 73.9 t -96.03 -77.33 0.35 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.6 0 CA-C-O 118.169 -0.92 . . . . 65.26 111.371 169.441 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 172' ' ' HIS . . . . . . . . . . . . . 45.6 m-70 -138.12 -7.12 1.59 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.882 0.873 . . . . 55.44 109.894 -177.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 173' ' ' GLY . . . . . . . . . . . . . . . 58.18 -133.14 52.79 Favored Glycine 0 C--N 1.335 0.488 0 CA-C-O 121.746 0.637 . . . . 59.2 112.154 175.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 6.1 p -98.32 12.46 34.74 Favored 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 122.306 -0.526 . . . . 61.82 110.938 -174.201 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 5.1 m -60.46 -32.12 71.09 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.425 0.69 . . . . 58.76 110.884 165.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 176' ' ' ILE . . . . . . . . . . . . . 36.0 mm -78.07 105.81 7.69 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.219 0 N-CA-C 109.454 -0.573 . . . . 51.01 109.454 -177.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 177' ' ' LEU . . . . . . . . . . . . . 35.2 mt -106.71 158.36 32.97 Favored Pre-proline 0 C--O 1.234 0.273 0 O-C-N 124.041 0.838 . . . . 49.53 110.326 -179.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 178' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -46.24 138.85 12.82 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 120.902 1.068 . . . . 44.97 110.968 174.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 179' ' ' GLY . . . . . . . . . . . . . . . 94.05 -2.28 68.76 Favored Glycine 0 N--CA 1.467 0.733 0 C-N-CA 124.419 1.009 . . . . 40.26 111.554 -177.478 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 180' ' ' MET . . . . . . . . . . . . . 54.7 mtt -108.52 170.16 8.2 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.181 0.992 . . . . 50.42 109.971 174.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 181' ' ' LEU . . . . . . . . . . . . . 4.6 tt -170.21 136.38 1.4 Allowed 'General case' 0 C--O 1.246 0.905 0 C-N-CA 125.454 1.502 . . . . 47.31 107.437 -164.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 182' ' ' CYS . . . . . . . . . . . . . 11.0 m -113.37 151.65 30.99 Favored 'General case' 0 C--O 1.221 -0.445 0 N-CA-C 109.862 -0.421 . . . . 58.94 109.862 -177.452 -45.211 -173.705 -80.708 102.396 2.008 104.573 175.619 -171.827 1 1 . 1 . 001 ecloud orig full ' B' B ' 183' ' ' ALA . . . . . . . . . . . . . . . -165.86 124.53 1.59 Allowed 'General case' 0 N--CA 1.438 -1.036 0 N-CA-C 107.337 -1.357 . . . . 45.93 107.337 -174.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 184' ' ' GLY . . . . . . . . . . . . . . . 151.96 171.48 19.74 Favored Glycine 0 C--N 1.336 0.545 0 O-C-N 124.443 1.09 . . . . 55.77 111.596 -165.124 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 184' A PHE . . . . . . . . . . . . . 54.9 m-85 -102.07 130.26 48.6 Favored 'General case' 0 N--CA 1.432 -1.344 0 N-CA-C 108.442 -0.947 . . . . 58.89 108.442 174.756 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 75.9 mt -61.66 -30.28 70.62 Favored 'General case' 0 C--O 1.215 -0.715 0 O-C-N 124.64 1.213 . . . . 67.4 109.594 178.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 186' ' ' GLU . . . . . . . . . . . . . 18.7 pm0 -72.1 -15.06 62.0 Favored 'General case' 0 C--O 1.217 -0.632 0 CA-C-O 118.85 -0.595 . . . . 66.22 110.734 176.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . 87.08 -167.16 37.59 Favored Glycine 0 N--CA 1.479 1.554 0 C-N-CA 124.318 0.961 . . . . 47.68 111.162 178.047 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . 100.97 -32.92 6.89 Favored Glycine 0 C--O 1.243 0.682 0 C-N-CA 123.13 0.395 . . . . 38.84 113.089 166.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 188' A THR . . . . . . . . . . . . . 2.8 m -130.06 136.28 49.19 Favored 'General case' 0 C--O 1.256 1.423 0 N-CA-C 109.797 -0.446 . . . . 45.65 109.797 172.28 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 189' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -178.47 167.64 1.83 Allowed 'General case' 0 C--O 1.243 0.744 0 O-C-N 125.363 1.664 . . . . 38.98 111.353 -171.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -78.38 161.9 26.84 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 114.469 -1.241 . . . . 39.24 109.372 166.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 191' ' ' CYS . . . . . . . . . . . . . 1.8 t -140.84 176.56 8.7 Favored 'General case' 0 C--O 1.244 0.765 0 CA-C-O 121.7 0.762 . . . . 42.11 109.872 177.983 -149.932 42.38 80.05 108.081 2.035 101.037 -179.418 -53.043 1 1 . 1 . 001 ecloud orig full ' B' B ' 192' ' ' GLN . . . . . . . . . . . . . 16.3 mp0 -52.05 128.09 23.45 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 108.672 -0.862 . . . . 37.2 108.672 173.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 104.19 -7.34 47.64 Favored Glycine 0 N--CA 1.446 -0.656 0 CA-C-N 115.107 -0.952 . . . . 32.3 112.023 -178.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 194' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -95.3 -6.19 41.85 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 120.242 -0.583 . . . . 32.75 109.95 -178.162 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 195' ' ' SER . . . . . . . . . . . . . 1.2 m -75.17 150.06 38.81 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-O 122.687 1.232 . . . . 35.73 112.5 -168.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 196' ' ' GLY . . . . . . . . . . . . . . . 89.77 -18.9 44.38 Favored Glycine 0 N--CA 1.41 -3.085 0 CA-C-N 110.756 -2.929 . . . . 38.15 111.289 -166.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -82.75 173.42 52.54 Favored Glycine 0 N--CA 1.438 -1.22 0 C-N-CA 121.363 -0.446 . . . . 31.78 112.398 -164.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 198' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -80.64 136.87 11.11 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 122.837 2.358 . . . . 32.84 116.337 -171.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 199' ' ' LEU . . . . . . . . . . . . . 28.4 tp -108.35 114.64 28.66 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.949 1.7 . . . . 36.72 108.396 150.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 200' ' ' VAL . . . . . . . . . . . . . 2.1 t -119.63 136.58 56.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 CA-C-N 113.908 -1.496 . . . . 46.06 111.216 -172.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' CYS . . . . . . . . . . . . . 32.0 m -130.13 166.6 19.88 Favored 'General case' 0 N--CA 1.486 1.35 0 O-C-N 124.432 1.082 . . . . 62.93 109.233 179.723 -50.227 -96.999 113.351 104.712 2.078 107.462 -89.349 -63.808 1 1 . 1 . 001 ecloud orig full ' B' B ' 202' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -130.06 156.12 45.02 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 119.742 -0.783 . . . . 94.28 112.54 -173.317 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 203' ' ' ASP . . . . . . . . . . . . . 1.3 t0 . . . . . 0 N--CA 1.49 1.553 0 O-C-N 125.604 1.815 . . . . 94.98 110.165 -177.672 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 206' ' ' ARG . . . . . . . . . . . . . 17.6 tpp180 . . . . . 0 CA--C 1.533 0.304 0 N-CA-C 109.134 -0.691 . . . . 89.44 109.134 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 207' ' ' LEU . . . . . . . . . . . . . 7.3 tp -112.72 122.62 48.2 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.887 0.875 . . . . 69.36 110.411 -179.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 208' ' ' THR . . . . . . . . . . . . . 31.1 p -133.77 144.1 48.83 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-O 121.176 0.512 . . . . 61.54 112.248 -179.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 209' ' ' LEU . . . . . . . . . . . . . 56.3 tp -80.72 99.22 8.1 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.969 0.908 . . . . 46.68 109.263 178.827 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 210' ' ' GLN . . . . . . . . . . . . . 29.6 mm100 -84.26 -34.07 23.9 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 108.613 -0.884 . . . . 53.93 108.613 -174.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 211' ' ' GLY . . . . . . . . . . . . . . . -142.4 152.96 24.15 Favored Glycine 0 N--CA 1.481 1.656 0 O-C-N 124.323 1.015 . . . . 36.09 114.552 -169.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 212' ' ' ILE . . . . . . . . . . . . . 49.0 mt -111.23 126.4 68.61 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 124.777 1.231 . . . . 38.72 108.338 168.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 213' ' ' ILE . . . . . . . . . . . . . 36.9 mt -60.97 123.89 14.47 Favored 'Isoleucine or valine' 0 C--O 1.24 0.575 0 N-CA-C 106.806 -1.553 . . . . 33.02 106.806 -179.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 214' ' ' SER . . . . . . . . . . . . . 42.6 t -125.69 -78.73 0.6 Allowed 'General case' 0 N--CA 1.442 -0.842 0 O-C-N 123.992 0.807 . . . . 33.59 110.389 -166.269 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 215' ' ' TRP . . . . . . . . . . . . . 60.3 p-90 -143.99 -179.27 6.39 Favored 'General case' 0 N--CA 1.437 -1.104 0 C-N-CA 118.753 -1.179 . . . . 44.9 111.805 -175.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 216' ' ' GLY . . . . . . . . . . . . . . . 175.22 164.88 30.56 Favored Glycine 0 C--O 1.213 -1.186 0 CA-C-N 115.024 -0.989 . . . . 47.06 112.569 174.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 217' ' ' SER . . . . . . . . . . . . . 14.6 t -96.23 118.04 32.0 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 105.091 -2.189 . . . . 51.28 105.091 174.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 219' ' ' GLY . . . . . . . . . . . . . . . 57.63 -163.3 7.94 Favored Glycine 0 N--CA 1.448 -0.514 0 N-CA-C 110.152 -1.179 . . . . 43.6 110.152 -173.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 220' ' ' CYS . . . . . . . . . . . . . 48.5 m -134.12 109.59 9.03 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 110.007 -0.368 . . . . 41.67 110.007 173.104 -53.043 -179.418 80.05 101.037 2.035 108.081 42.38 -149.932 1 1 . 1 . 001 ecloud orig full ' B' B ' 221' ' ' GLY . . . . . . . . . . . . . . . 64.5 41.45 97.94 Favored Glycine 0 N--CA 1.444 -0.796 0 CA-C-N 115.282 -0.872 . . . . 50.73 112.073 -177.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 221' A ASP . . . . . . . . . . . . . 87.2 m-20 -83.5 151.57 25.35 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 109.107 -0.701 . . . . 57.21 109.107 169.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 222' ' ' ARG . . . . . 0.474 ' NH2' ' O ' ' B' ' 405' ' ' HOH . 10.5 ttp85 -52.38 126.51 19.42 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.776 1.23 . . . . 85.18 109.427 174.875 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 223' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 67.39 27.17 8.2 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 125.843 1.657 . . . . 67.21 110.598 174.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 224' ' ' LYS . . . . . . . . . . . . . 24.1 mmtt -137.92 70.46 49.95 Favored Pre-proline 0 C--N 1.34 0.16 0 C-N-CA 123.959 0.904 . . . . 58.19 109.138 -178.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 225' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -71.15 154.4 62.1 Favored 'Trans proline' 0 CA--C 1.54 0.78 0 C-N-CA 120.877 1.052 . . . . 46.91 110.82 175.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 226' ' ' GLY . . . . . . . . . . . . . . . -61.37 142.34 48.31 Favored Glycine 0 N--CA 1.442 -0.964 0 N-CA-C 110.613 -0.995 . . . . 46.58 110.613 176.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 227' ' ' VAL . . . . . . . . . . . . . 21.0 t -103.64 148.03 9.12 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.85 0 N-CA-C 107.472 -1.307 . . . . 40.43 107.472 173.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 228' ' ' TYR . . . . . . . . . . . . . 42.0 m-85 -136.91 146.04 45.02 Favored 'General case' 0 N--CA 1.442 -0.847 0 C-N-CA 126.056 1.742 . . . . 38.18 110.025 -169.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 229' ' ' THR . . . . . . . . . . . . . 35.8 m -70.77 124.84 25.25 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 108.308 -0.997 . . . . 34.77 108.308 166.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 230' ' ' ASP . . . . . . . . . . . . . 52.8 t0 -74.12 95.46 2.57 Favored 'General case' 0 C--O 1.204 -1.296 0 C-N-CA 125.841 1.656 . . . . 40.44 109.337 179.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 231' ' ' VAL . . . . . . . . . . . . . 77.3 t -57.05 -44.45 82.95 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.687 0 N-CA-C 109.935 -0.395 . . . . 39.72 109.935 -169.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -56.17 -35.51 67.31 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.839 0.856 . . . . 40.46 110.536 -173.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 233' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -59.52 -18.98 44.86 Favored 'General case' 0 C--O 1.208 -1.093 0 C-N-CA 124.639 1.175 . . . . 42.09 112.028 178.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 234' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 -122.02 13.69 10.58 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 118.829 0.74 . . . . 35.83 110.216 -164.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 235' ' ' LEU . . . . . . . . . . . . . 60.9 mt -55.1 -43.68 74.25 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 123.234 0.334 . . . . 43.09 111.284 -177.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 236' ' ' ALA . . . . . . . . . . . . . . . -65.36 -48.02 74.41 Favored 'General case' 0 C--O 1.246 0.888 0 N-CA-C 109.746 -0.465 . . . . 37.27 109.746 178.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 237' ' ' TRP . . . . . . . . . . . . . 86.3 t90 -53.41 -45.26 69.29 Favored 'General case' 0 N--CA 1.437 -1.099 0 N-CA-C 108.842 -0.799 . . . . 39.98 108.842 178.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 238' ' ' ILE . . . . . . . . . . . . . 96.3 mt -63.58 -46.91 93.64 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 CA-C-O 119.039 -0.505 . . . . 42.82 110.663 -177.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 239' ' ' ARG . . . . . . . . . . . . . 51.6 mtt180 -56.07 -50.92 69.63 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.223 0.609 . . . . 83.79 110.354 178.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 240' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -76.74 -9.05 58.4 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 122.209 -0.307 . . . . 84.73 110.751 -169.5 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 241' ' ' HIS . . . . . . . . . . . . . 48.2 m80 -108.59 31.37 5.67 Favored 'General case' 0 C--O 1.21 -0.999 0 C-N-CA 122.678 0.391 . . . . 48.67 111.623 177.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 30.0 p -101.62 38.2 1.66 Allowed 'General case' 0 C--O 1.239 0.547 0 CA-C-O 121.009 0.433 . . . . 51.47 110.043 176.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 243' ' ' VAL . . . . . . . . . . . . . 1.7 m -86.98 151.07 3.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 N-CA-C 106.181 -1.785 . . . . 54.99 106.181 172.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 244' ' ' SER . . . . . . . . . . . . . 22.7 t -157.28 155.98 31.67 Favored 'General case' 0 N--CA 1.429 -1.476 0 CA-C-O 122.569 1.176 . . . . 56.63 111.25 -175.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 245' ' ' THR . . . . . . . . . . . . . 67.8 p -69.57 168.57 14.44 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 111.538 -2.574 . . . . 38.8 106.286 171.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 246' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 . . . . . 0 N--CA 1.502 2.136 0 CA-C-O 117.062 -1.447 . . . . 38.68 112.423 -168.78 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 301' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 302' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 303' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 304' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 305' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 306' ' ' CYS . . . . . 0.454 ' SG ' ' N ' ' B' ' 122' ' ' CYS . 47.3 m . . . . . 0 N--CA 1.487 1.404 0 CA-C-O 117.324 -1.322 . . . . 105.23 109.435 . -76.716 -133.206 -94.455 118.89 1.985 91.207 -22.755 -59.257 1 1 . 1 . 001 ecloud orig full ' B' B ' 401' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 402' ' ' HOH . . . . . 0.523 ' O ' ' NE ' ' B' ' 167' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 405' ' ' HOH . . . . . 0.474 ' O ' ' NH2' ' B' ' 222' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 422' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 426' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 428' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 431' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 432' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 435' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 436' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 438' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 439' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 440' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 441' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 442' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 443' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 444' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 445' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 446' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 447' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 448' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 449' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 453' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 454' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 455' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 456' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 457' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 458' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 459' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 39.5 t . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 117.932 -1.033 . . . . 37.44 108.417 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 2.6 m -94.61 143.69 11.24 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 O-C-N 123.931 0.769 . . . . 37.6 109.562 177.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' GLY . . . . . . . . . . . . . . . 59.19 42.92 97.42 Favored Glycine 0 CA--C 1.525 0.668 0 CA-C-O 119.191 -0.783 . . . . 39.01 112.304 -176.417 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -117.76 -170.29 15.07 Favored Glycine 0 N--CA 1.485 1.926 0 CA-C-O 118.77 -1.017 . . . . 33.72 111.41 179.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 18.1 mt -136.36 144.03 44.37 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 118.134 0.967 . . . . 32.13 109.608 -174.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 38.6 t -52.93 133.95 15.18 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.281 0 N-CA-C 107.038 -1.467 . . . . 31.74 107.038 169.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' ALA . . . . . . . . . . . . . . . -96.63 154.36 17.32 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 123.109 0.563 . . . . 36.23 109.568 -178.372 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 87.5 mt -64.73 154.74 35.87 Favored 'General case' 0 C--O 1.211 -0.931 0 N-CA-C 108.687 -0.857 . . . . 39.67 108.687 171.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 15.3 mtt-85 -53.09 128.84 28.99 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 122.288 1.042 . . . . 71.55 108.949 164.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.54 7.7 88.28 Favored Glycine 0 N--CA 1.449 -0.468 0 CA-C-O 119.298 -0.723 . . . . 41.49 112.567 174.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.63 -39.5 84.51 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 117.548 0.674 . . . . 36.63 109.813 -178.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 75.2 m-70 -130.78 79.54 71.61 Favored Pre-proline 0 N--CA 1.488 1.457 0 N-CA-C 107.768 -1.197 . . . . 38.54 107.768 -178.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_endo -78.87 0.97 9.54 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 121.556 1.504 . . . . 33.66 113.615 -172.152 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' TYR . . . . . . . . . . . . . 2.5 p90 -97.08 -2.41 43.3 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.167 0.987 . . . . 36.31 112.247 178.155 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 13.2 tt -85.11 137.33 21.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 CA-C-O 121.784 0.802 . . . . 30.49 109.197 -175.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -113.96 137.53 51.57 Favored 'General case' 0 N--CA 1.425 -1.697 0 CA-C-N 114.049 -1.432 . . . . 30.65 108.353 -177.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -102.55 126.38 49.59 Favored 'General case' 0 N--CA 1.443 -0.78 0 O-C-N 124.61 1.194 . . . . 29.92 108.519 170.414 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 10.9 mp -108.27 122.69 47.48 Favored 'General case' 0 C--O 1.212 -0.907 0 C-N-CA 124.478 1.111 . . . . 35.25 109.829 179.848 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' TYR . . . . . . . . . . . . . 46.6 m-85 -124.92 130.94 53.37 Favored 'General case' 0 C--O 1.243 0.753 0 N-CA-C 109.327 -0.619 . . . . 31.9 109.327 177.467 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' TRP . . . . . . . . . . . . . 12.0 p90 -152.29 146.05 25.09 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 114.874 -1.057 . . . . 35.9 108.917 166.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 48.92 -126.7 18.47 Favored Glycine 0 C--N 1.337 0.616 0 N-CA-C 110.666 -0.974 . . . . 43.39 110.666 174.815 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' HIS . . . . . . . . . . . . . 34.3 m80 -107.06 38.16 2.18 Favored 'General case' 0 C--O 1.22 -0.448 0 N-CA-C 109.384 -0.598 . . . . 65.83 109.384 174.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' SER . . . . . . . . . . . . . 37.5 m -126.66 162.37 25.9 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 124.098 0.959 . . . . 35.07 110.988 -173.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -155.45 141.55 18.34 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 114.669 -1.151 . . . . 35.35 110.683 -176.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' CYS . . . . . . . . . . . . . 1.3 m -152.92 170.97 19.08 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-O 122.4 1.095 . . . . 40.83 111.173 167.488 -94.888 -141.381 -87.659 104.332 2.04 102.861 -80.821 -90.605 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' ALA . . . . . 0.554 ' O ' ' HA3' ' B' ' 196' ' ' GLY . . . -110.15 163.67 13.38 Favored 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 114.355 -1.293 . . . . 30.48 108.512 176.046 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 44' ' ' GLY . . . . . . . . . . . . . . . -156.76 178.09 33.36 Favored Glycine 0 N--CA 1.423 -2.19 0 CA-C-N 114.587 -1.188 . . . . 31.74 111.166 174.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 36.7 m -126.15 119.24 27.01 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 109.357 -0.609 . . . . 31.45 109.357 -175.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 23.9 tp -70.11 117.64 11.93 Favored 'General case' 0 C--O 1.209 -1.07 0 N-CA-C 108.538 -0.912 . . . . 30.82 108.538 174.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' ILE . . . . . . . . . . . . . 22.6 pt -105.5 -15.58 8.45 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.614 0 C-N-CA 123.367 0.667 . . . . 31.92 110.938 -179.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -156.88 162.25 27.97 Favored Pre-proline 0 C--N 1.322 -0.595 0 N-CA-C 106.875 -1.528 . . . . 29.29 106.875 173.299 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_exo -49.54 -32.85 28.72 Favored 'Trans proline' 0 C--N 1.348 0.521 0 CA-C-N 120.722 1.294 . . . . 31.78 114.236 -176.037 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' CYS . . . . . . . . . . . . . 99.3 m -106.79 5.44 28.58 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 124.825 1.328 . . . . 35.23 114.165 -178.129 -65.589 -63.963 101.141 102.695 1.933 103.926 137.782 -71.803 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' TRP . . . . . 0.425 ' CZ2' ' HD3' ' B' ' 107' ' ' ARG . 99.0 m95 -131.1 132.03 44.57 Favored 'General case' 0 C--O 1.245 0.852 0 O-C-N 121.154 -0.967 . . . . 32.8 111.678 -169.526 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 37.6 t -126.32 137.87 56.42 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 CA-C-N 115.393 -0.821 . . . . 24.17 109.005 178.454 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 8.5 tp -110.52 140.18 45.06 Favored 'General case' 0 C--O 1.217 -0.608 0 N-CA-C 108.974 -0.75 . . . . 34.59 108.974 177.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' THR . . . . . . . . . . . . . 9.5 t -151.34 -171.29 3.89 Favored 'General case' 0 C--O 1.216 -0.676 0 C-N-CA 123.279 0.632 . . . . 30.49 109.327 178.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . -88.76 153.79 20.8 Favored 'General case' 0 N--CA 1.44 -0.972 0 N-CA-C 107.957 -1.127 . . . . 33.64 107.957 179.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.75 -42.36 73.99 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.618 -0.719 . . . . 34.38 109.364 176.522 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' HIS . . . . . . . . . . . . . 5.3 p-80 -59.26 -34.26 72.04 Favored 'General case' 0 C--O 1.212 -0.918 0 O-C-N 123.61 0.569 . . . . 30.41 110.387 -173.499 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' CYS . . . . . . . . . . . . . 1.7 m -52.68 -43.31 65.47 Favored 'General case' 0 N--CA 1.439 -1.006 0 C-N-CA 124.232 1.013 . . . . 34.56 111.932 179.171 -90.605 -80.821 -87.659 102.861 2.04 104.332 -141.381 -94.888 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 43.4 mt -113.28 18.79 17.58 Favored 'General case' 0 C--O 1.217 -0.644 0 O-C-N 125.149 1.531 . . . . 30.1 111.595 -174.926 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -33.04 -43.55 0.1 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.983 1.713 . . . . 39.4 111.954 166.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' A ASP . . . . . . . . . . . . . 17.3 p-10 -78.56 -3.56 44.33 Favored 'General case' 0 C--O 1.209 -1.067 0 CA-C-N 115.875 -0.602 . . . . 47.24 110.209 -169.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' B ARG . . . . . . . . . . . . . 6.8 mpt_? 58.47 48.36 2.46 Favored Pre-proline 0 N--CA 1.47 0.549 0 C-N-CA 124.533 1.133 . . . . 42.9 111.138 169.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' C PRO . . . . . . . . . . . . . 37.6 Cg_endo -59.6 146.16 96.05 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 CA-C-N 120.434 1.191 . . . . 33.63 110.508 179.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' D ALA . . . . . . . . . . . . . . . -58.59 142.57 82.85 Favored Pre-proline 0 N--CA 1.457 -0.108 0 N-CA-C 107.514 -1.291 . . . . 32.12 107.514 173.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -62.5 -27.99 77.32 Favored 'Trans proline' 0 CA--C 1.538 0.716 0 C-N-CA 120.853 1.035 . . . . 27.16 111.598 -172.011 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 17.5 pm0 -64.61 -21.35 66.69 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 123.528 0.518 . . . . 30.17 110.277 179.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 88.6 m-20 -82.53 -11.66 58.3 Favored 'General case' 0 N--CA 1.438 -1.055 0 C-N-CA 123.381 0.672 . . . . 38.27 111.308 -176.161 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 47.3 mt -88.74 139.9 29.99 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 118.653 0.66 . . . . 32.8 109.87 -176.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' THR . . . . . . . . . . . . . 26.6 m -118.49 127.58 53.77 Favored 'General case' 0 C--O 1.246 0.904 0 C-N-CA 123.726 0.81 . . . . 28.19 109.605 163.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 92.5 t -108.31 128.71 63.61 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 N-CA-C 107.506 -1.294 . . . . 31.47 107.506 172.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' VAL . . . . . . . . . . . . . 18.4 t -114.25 123.0 69.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 N-CA-C 107.3 -1.37 . . . . 30.36 107.3 178.061 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 83.7 mt -108.15 147.6 31.05 Favored 'General case' 0 C--O 1.244 0.773 0 O-C-N 123.682 0.614 . . . . 32.65 109.943 176.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 72.86 38.06 56.59 Favored Glycine 0 C--N 1.344 1.024 0 O-C-N 124.745 1.278 . . . . 36.31 111.912 174.34 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -101.69 133.11 46.9 Favored 'General case' 0 C--O 1.21 -0.997 0 C-N-CA 124.6 1.16 . . . . 37.86 108.934 -172.605 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 56.5 tt0 -89.38 -47.43 8.02 Favored 'General case' 0 C--O 1.217 -0.611 0 C-N-CA 123.554 0.742 . . . . 53.63 110.444 179.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' ARG . . . . . 0.41 ' HB2' ' HB2' ' B' ' 75' ' ' HIS . 67.2 mtp180 -119.6 133.17 55.77 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 124.552 1.157 . . . . 47.77 111.412 -174.772 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 24.5 ttp180 -45.75 113.34 0.59 Allowed 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 125.349 1.46 . . . . 44.78 109.068 177.44 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 71.94 20.82 4.31 Favored 'General case' 0 N--CA 1.44 -0.929 0 C-N-CA 125.235 1.414 . . . . 39.89 110.781 167.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' HIS . . . . . 0.41 ' HB2' ' HB2' ' B' ' 72' ' ' ARG . 28.3 m80 -107.36 138.95 42.61 Favored 'General case' 0 C--O 1.246 0.905 0 C-N-CA 122.818 0.447 . . . . 65.96 110.854 174.264 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 76' ' ' SER . . . . . . . . . . . . . 1.4 m -71.72 155.24 40.7 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 113.699 -1.591 . . . . 52.41 106.984 171.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' CYS . . . . . . . . . . . . . 7.2 p -161.73 149.38 14.72 Favored 'General case' 0 C--O 1.213 -0.826 0 N-CA-C 108.284 -1.006 . . . . 42.87 108.284 -174.139 80.764 -72.017 108.062 111.236 2.121 106.724 57.615 -77.524 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' GLU . . . . . 0.483 ' HB3' ' HD3' ' B' ' 79' ' ' PRO . 2.9 tp10 -46.76 -56.04 12.84 Favored Pre-proline 0 N--CA 1.475 0.797 0 CA-C-O 119.391 -0.338 . . . . 82.4 110.818 -178.453 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 79' ' ' PRO . . . . . 0.483 ' HD3' ' HB3' ' B' ' 78' ' ' GLU . 37.4 Cg_endo -88.14 7.77 4.38 Favored 'Trans proline' 0 CA--C 1.543 0.969 0 N-CA-C 117.222 1.97 . . . . 42.62 117.222 -176.646 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 36.5 m -61.33 142.68 56.72 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.876 0.369 . . . . 41.29 110.134 174.821 -77.524 57.615 108.062 106.724 2.121 111.236 -72.017 80.764 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -129.17 126.84 40.12 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 108.623 -0.88 . . . . 33.99 108.623 175.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 82' ' ' THR . . . . . . . . . . . . . 55.1 m -111.93 115.18 28.55 Favored 'General case' 0 C--O 1.211 -0.922 0 O-C-N 124.245 0.965 . . . . 31.8 109.625 -174.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 6.3 mp -120.03 155.03 33.72 Favored 'General case' 0 C--O 1.225 -0.214 0 O-C-N 123.672 0.607 . . . . 34.56 109.528 -179.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -86.98 176.41 7.66 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.415 1.486 . . . . 30.62 108.957 167.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' VAL . . . . . . . . . . . . . 91.4 t -121.65 131.93 71.94 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.972 0 N-CA-C 107.962 -1.125 . . . . 29.47 107.962 -178.178 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' ARG . . . . . . . . . . . . . 34.7 mtt-85 -71.88 -51.08 24.08 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 123.372 0.669 . . . . 31.4 109.819 177.489 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 96.9 p -168.17 161.77 12.56 Favored 'General case' 0 C--O 1.209 -1.031 0 CA-C-N 113.908 -1.497 . . . . 35.82 106.965 -164.122 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' TYR . . . . . . . . . . . . . 33.0 p90 -159.82 160.96 34.4 Favored 'General case' 0 N--CA 1.446 -0.67 0 O-C-N 123.339 0.399 . . . . 33.28 110.381 173.481 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 1.1 mmt85 -138.92 126.68 22.1 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 116.301 -0.409 . . . . 83.94 109.973 -175.086 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 11.2 mp -81.95 152.28 26.82 Favored 'General case' 0 C--O 1.21 -1.005 0 N-CA-C 107.684 -1.228 . . . . 33.48 107.684 166.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' HIS . . . . . . . . . . . . . 62.9 t-80 -64.43 122.23 16.23 Favored 'General case' 0 N--CA 1.439 -0.991 0 O-C-N 124.06 0.85 . . . . 37.92 109.303 170.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 59.7 mp0 -44.87 -35.47 2.82 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 127.152 2.181 . . . . 47.08 113.126 -179.655 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -102.82 9.96 38.68 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 118.147 -0.93 . . . . 36.49 112.031 -170.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -57.53 119.22 6.16 Favored 'General case' 0 C--O 1.205 -1.271 0 CA-C-O 118.774 -0.631 . . . . 35.76 110.051 -179.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 10.8 t -103.45 121.19 49.35 Favored Pre-proline 0 C--N 1.34 0.172 0 O-C-N 123.904 0.752 . . . . 40.96 110.746 -179.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -80.54 2.04 8.82 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 121.544 1.496 . . . . 41.76 114.989 171.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' VAL . . . . . . . . . . . . . 51.2 t -86.33 -55.95 5.97 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-O 121.905 0.859 . . . . 38.9 109.602 168.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' SER . . . . . . . . . . . . . 87.2 p -91.38 -20.55 21.69 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.585 1.154 . . . . 37.91 111.832 -173.206 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 22.9 m-30 71.77 12.78 6.24 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.914 2.086 . . . . 39.4 111.065 -175.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -75.66 150.59 37.91 Favored 'General case' 0 C--O 1.207 -1.139 0 CA-C-O 121.234 0.54 . . . . 44.31 110.006 -173.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' HIS . . . . . . . . . . . . . 35.2 m-70 61.6 46.54 7.18 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 123.746 0.818 . . . . 36.78 110.405 179.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -89.18 76.01 7.76 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 121.001 0.429 . . . . 31.91 110.205 -174.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -151.78 167.07 29.4 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 118.504 -1.278 . . . . 42.04 110.91 167.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -153.51 152.86 31.43 Favored 'General case' 0 N--CA 1.44 -0.972 0 O-C-N 125.677 1.861 . . . . 28.2 109.449 -177.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 59.4 tp -127.29 124.68 39.33 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.06 -1.089 . . . . 31.23 108.06 -173.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' LEU . . . . . . . . . . . . . 8.6 mp -108.05 131.9 54.11 Favored 'General case' 0 C--O 1.214 -0.815 0 O-C-N 124.091 0.87 . . . . 31.34 109.205 -179.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 107' ' ' ARG . . . . . 0.425 ' HD3' ' CZ2' ' B' ' 51' ' ' TRP . 32.2 tpt85 -94.97 120.36 35.05 Favored 'General case' 0 C--O 1.203 -1.366 0 N-CA-C 107.478 -1.304 . . . . 29.57 107.478 166.081 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 108' ' ' LEU . . . . . 0.424 ' O ' ' NH2' ' B' ' 107' ' ' ARG . 35.9 mt -77.02 163.47 26.65 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 123.26 0.35 . . . . 34.51 110.586 177.954 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 66.2 tp60 -95.81 121.28 37.37 Favored 'General case' 0 C--O 1.212 -0.877 0 C-N-CA 124.891 1.276 . . . . 36.77 110.518 179.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 109' A GLU . . . . . . . . . . . . . 53.3 mp0 -56.94 138.54 53.89 Favored 'General case' 0 C--O 1.21 -1.006 0 C-N-CA 123.862 0.865 . . . . 30.58 109.437 172.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 109' B ASP . . . . . 0.728 ' O ' ' O ' ' B' ' 109' D ASP . 11.2 p30 -68.52 -178.08 1.06 Allowed 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 107.978 -1.119 . . . . 33.63 107.978 170.562 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 109' C ALA . . . . . . . . . . . . . . . -69.03 -27.12 65.37 Favored 'General case' 0 C--O 1.217 -0.643 0 N-CA-C 114.111 1.152 . . . . 34.03 114.111 -171.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 109' D ASP . . . . . 0.728 ' O ' ' O ' ' B' ' 109' B ASP . 14.7 m-20 -71.22 178.06 3.52 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 103.35 -2.833 . . . . 51.64 103.35 153.897 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 109' E GLY . . . . . . . . . . . . . . . -93.35 25.18 21.83 Favored Glycine 0 N--CA 1.486 2.005 1 C-N-CA 113.186 -4.34 . . . . 37.11 115.503 -170.499 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 2.6 p -107.9 147.2 31.3 Favored 'General case' 0 N--CA 1.492 1.654 0 CA-C-N 119.028 1.414 . . . . 39.9 112.338 -164.422 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 111' ' ' CYS . . . . . . . . . . . . 0.3 68.9 m -103.02 -154.72 0.5 Allowed 'General case' 0 N--CA 1.479 1.019 1 N-CA-C 97.698 -4.927 . . . . 36.01 97.698 173.452 -71.803 137.782 101.141 103.926 1.933 102.695 -63.963 -65.589 3 2 . 1 . 001 ecloud build full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -32.2 124.96 0.3 Allowed 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 116.931 2.197 . . . . 39.25 116.931 179.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 31.9 mt -91.65 116.61 29.02 Favored 'General case' 0 C--O 1.214 -0.78 0 N-CA-C 107.656 -1.239 . . . . 36.98 107.656 173.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 21.5 mt -64.5 143.57 57.82 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 109.077 -0.712 . . . . 46.57 109.077 -175.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 115' ' ' SER . . . . . 0.509 ' HB2' ' HD2' ' B' ' 116' ' ' PRO . 28.4 p -154.69 174.22 4.07 Favored Pre-proline 0 N--CA 1.425 -1.715 0 N-CA-C 106.737 -1.579 . . . . 39.62 106.737 -177.512 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 116' ' ' PRO . . . . . 0.509 ' HD2' ' HB2' ' B' ' 115' ' ' SER . 49.0 Cg_endo -65.87 -11.34 30.43 Favored 'Trans proline' 0 CA--C 1.544 1.002 0 CA-C-N 119.546 0.874 . . . . 45.04 113.072 172.515 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 117' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -106.54 -12.42 15.61 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 124.137 0.975 . . . . 55.57 112.55 -178.483 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 53.9 t -136.79 111.22 9.89 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.907 0 N-CA-C 108.431 -0.952 . . . . 36.89 108.431 -172.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 119' ' ' GLN . . . . . . . . . . . . . 21.2 tp60 -154.2 131.35 6.02 Favored Pre-proline 0 N--CA 1.442 -0.849 0 N-CA-C 107.252 -1.388 . . . . 46.07 107.252 -167.272 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 120' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -70.32 168.11 23.22 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 N-CA-C 108.5 -1.385 . . . . 37.44 108.5 177.153 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 121' ' ' VAL . . . . . . . . . . . . . 4.9 p -124.9 127.7 72.69 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.906 0 N-CA-C 107.478 -1.304 . . . . 37.66 107.478 172.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 122' ' ' CYS . . . . . 0.454 ' N ' ' SG ' ' B' ' 306' ' ' CYS . 82.5 m -52.99 148.74 7.37 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 121.81 0.814 . . . . 68.02 110.381 -179.338 -59.257 -22.755 -94.455 91.207 1.985 118.89 -133.206 -76.716 2 2 . 1 . 001 ecloud build full ' B' B ' 123' ' ' LEU . . . . . . . . . . . . . 92.4 mt -75.0 162.07 74.92 Favored Pre-proline 0 N--CA 1.429 -1.493 0 N-CA-C 107.999 -1.111 . . . . 47.47 107.999 167.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 124' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -76.17 -175.68 2.66 Favored 'Trans proline' 0 CA--C 1.536 0.576 0 N-CA-C 109.238 -1.101 . . . . 56.92 109.238 173.041 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 5.0 p -122.97 -7.63 8.37 Favored 'General case' 0 N--CA 1.481 1.12 0 O-C-N 123.389 0.431 . . . . 75.17 111.221 165.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 57.03 59.91 10.0 Favored Glycine 0 C--N 1.337 0.601 0 N-CA-C 112.036 -0.426 . . . . 82.21 112.036 176.255 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 127' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.304 0 C-N-CA 124.051 0.94 . . . . 84.11 109.239 -178.728 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo . . . . . 0 CA--C 1.538 0.684 0 N-CA-C 112.783 0.263 . . . . 104.35 112.783 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 71.1 m -161.03 57.45 0.3 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.213 0.605 . . . . 109.62 110.508 -172.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 22.5 tp10 -72.61 107.11 4.93 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.601 0.76 . . . . 108.24 110.091 -179.106 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 133' ' ' THR . . . . . 0.491 ' HA ' ' O ' ' B' ' 416' ' ' HOH . 16.6 m 70.2 50.27 0.43 Allowed 'General case' 0 N--CA 1.499 1.988 0 C-N-CA 125.433 1.493 . . . . 106.18 111.527 169.531 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 134' ' ' THR . . . . . 0.559 HG21 ' O ' ' B' ' 202' ' ' GLU . 1.2 m -89.42 175.87 7.14 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 108.416 -0.957 . . . . 105.06 108.416 166.181 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 135' ' ' LEU . . . . . . . . . . . . . 2.1 tp -71.08 106.17 3.62 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 109.164 -0.68 . . . . 80.4 109.164 166.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 136' ' ' CYS . . . . . . . . . . . . . 78.4 m -120.62 128.46 53.04 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 122.868 0.467 . . . . 55.91 109.991 177.237 -63.808 -89.349 113.351 107.462 2.078 104.712 -96.999 -50.227 1 1 . 1 . 001 ecloud build full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 -110.43 144.57 39.02 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.953 -0.567 . . . . 49.13 110.013 176.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 138' ' ' VAL . . . . . . . . . . . . . 4.7 p -112.23 149.53 14.78 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 N-CA-C 107.781 -1.192 . . . . 35.81 107.781 165.756 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -141.33 151.21 43.4 Favored 'General case' 0 N--CA 1.483 1.185 0 CA-C-O 121.241 0.543 . . . . 33.9 111.396 177.368 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 140' ' ' GLY . . . . . . . . . . . . . . . 177.27 168.68 37.41 Favored Glycine 0 N--CA 1.472 1.081 0 CA-C-O 122.334 0.963 . . . . 32.37 114.189 -178.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 141' ' ' TRP . . . . . . . . . . . . . 22.6 m-90 -108.16 12.47 26.66 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-N 114.441 -0.88 . . . . 30.41 110.535 179.226 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 142' ' ' GLY . . . . . . . . . . . . . . . -70.26 -163.99 4.68 Favored Glycine 0 CA--C 1.525 0.663 0 CA-C-O 123.466 1.592 . . . . 29.74 113.484 -176.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 143' ' ' HIS . . . . . . . . . . . . . 38.6 m170 -63.83 138.87 58.67 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 114.336 -0.932 . . . . 32.24 109.719 -177.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -85.53 -10.05 56.55 Favored 'General case' 0 C--O 1.223 -0.32 0 O-C-N 124.444 1.09 . . . . 40.23 110.506 178.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 145' ' ' PHE . . . . . . . . . . . . . 50.8 p90 -163.78 145.51 9.2 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 125.647 1.579 . . . . 42.7 108.499 174.08 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 63.3 tt0 -51.67 130.85 29.3 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-O 121.296 0.57 . . . . 69.67 110.857 -176.644 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . 65.8 29.44 75.08 Favored Glycine 0 C--O 1.205 -1.671 0 CA-C-N 115.406 -0.816 . . . . 45.69 112.654 177.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -64.97 166.61 8.99 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 108.365 -0.976 . . . . 45.71 108.365 163.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 149' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -91.8 -32.12 15.48 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 122.881 0.472 . . . . 70.15 109.728 -165.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -134.46 153.08 52.11 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.727 1.211 . . . . 54.49 109.689 -178.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 151' ' ' TYR . . . . . . . . . . . . . 13.5 m-30 -65.39 158.43 26.66 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 108.316 -0.994 . . . . 36.76 108.316 167.651 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -65.03 160.06 21.74 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 116.446 -0.343 . . . . 29.34 110.31 178.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 48.2 t -92.66 -66.18 0.94 Allowed 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 122.706 0.402 . . . . 36.4 110.604 171.542 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 154' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -71.83 146.39 48.01 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 109.256 -0.646 . . . . 39.49 109.256 174.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 155' ' ' LEU . . . . . . . . . . . . . 47.6 tp -64.53 143.01 58.22 Favored 'General case' 0 N--CA 1.435 -1.22 0 O-C-N 124.491 1.119 . . . . 32.8 108.787 176.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 156' ' ' GLN . . . . . . . . . . . . . 52.9 mm-40 -115.1 153.42 30.77 Favored 'General case' 0 C--O 1.217 -0.622 0 N-CA-C 107.232 -1.395 . . . . 40.14 107.232 -179.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 157' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -134.07 152.69 51.95 Favored 'General case' 0 N--CA 1.451 -0.415 0 O-C-N 124.583 1.177 . . . . 37.03 108.048 176.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -149.85 147.9 28.51 Favored 'General case' 0 C--O 1.212 -0.87 0 CA-C-N 115.916 -0.584 . . . . 38.98 109.647 171.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 159' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -88.83 137.67 32.1 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 106.673 -1.603 . . . . 92.14 106.673 170.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 160' ' ' VAL . . . . . 0.443 ' CG2' ' HA2' ' B' ' 184' ' ' GLY . 5.4 p -149.29 129.5 6.71 Favored Pre-proline 0 N--CA 1.403 -2.795 0 N-CA-C 107.317 -1.364 . . . . 45.97 107.317 -173.313 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 161' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -86.8 144.92 7.61 Favored 'Trans proline' 0 CA--C 1.536 0.582 0 C-N-CA 121.396 1.397 . . . . 48.36 112.965 -176.834 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 162' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -57.26 161.02 3.5 Favored 'General case' 0 C--O 1.206 -1.211 0 N-CA-C 107.968 -1.123 . . . . 96.0 107.968 171.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 18.6 mt -139.72 144.79 37.67 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.904 0.383 . . . . 75.04 110.038 174.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 46.2 t -64.45 156.15 30.41 Favored 'General case' 0 N--CA 1.436 -1.151 0 N-CA-C 108.194 -1.039 . . . . 88.81 108.194 179.247 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 1.1 tp -67.18 -48.04 69.15 Favored 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 124.416 1.073 . . . . 76.18 109.488 173.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -45.29 -55.44 5.91 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 108.998 -0.742 . . . . 95.61 108.998 175.105 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 12.2 mtp180 -67.91 -38.94 83.57 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 124.051 0.844 . . . . 95.43 110.293 -173.61 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 168' ' ' CYS . . . . . . . . . . . . . 37.0 t -74.75 -37.37 62.5 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 112.064 0.394 . . . . 73.83 112.064 -177.087 -171.827 175.619 -80.708 104.573 2.008 102.396 -173.705 -45.211 1 1 . 1 . 001 ecloud build full ' B' B ' 169' ' ' SER . . . . . . . . . . . . . 89.6 p -81.01 4.51 19.39 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 119.354 -0.355 . . . . 60.24 111.558 -178.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 169' A ALA . . . . . . . . . . . . . . . -54.65 137.97 62.18 Favored Pre-proline 0 N--CA 1.449 -0.476 0 N-CA-C 109.554 -0.536 . . . . 63.43 109.554 177.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 169' B PRO . . . . . . . . . . . . . 54.9 Cg_exo -47.2 -30.77 11.16 Favored 'Trans proline' 0 C--N 1.357 1.018 0 N-CA-C 117.281 1.993 . . . . 68.8 117.281 -175.189 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 15.1 p30 -105.75 4.79 30.34 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 120.66 0.267 . . . . 76.99 110.64 -174.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 171' ' ' VAL . . . . . . . . . . . . . 73.9 t -96.03 -77.33 0.35 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.6 0 CA-C-O 118.169 -0.92 . . . . 65.26 111.371 169.441 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 172' ' ' HIS . . . . . . . . . . . . . 45.6 m-70 -138.12 -7.12 1.59 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.882 0.873 . . . . 55.44 109.894 -177.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 173' ' ' GLY . . . . . . . . . . . . . . . 58.18 -133.14 52.79 Favored Glycine 0 C--N 1.335 0.488 0 CA-C-O 121.746 0.637 . . . . 59.2 112.154 175.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 6.1 p -98.32 12.46 34.74 Favored 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 122.306 -0.526 . . . . 61.82 110.938 -174.201 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 5.1 m -60.46 -32.12 71.09 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.425 0.69 . . . . 58.76 110.884 165.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 176' ' ' ILE . . . . . . . . . . . . . 36.0 mm -78.07 105.81 7.69 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.219 0 N-CA-C 109.454 -0.573 . . . . 51.01 109.454 -177.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 177' ' ' LEU . . . . . . . . . . . . . 35.2 mt -106.71 158.36 32.97 Favored Pre-proline 0 C--O 1.234 0.273 0 O-C-N 124.041 0.838 . . . . 49.53 110.326 -179.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 178' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -46.24 138.85 12.82 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 120.902 1.068 . . . . 44.97 110.968 174.288 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 179' ' ' GLY . . . . . . . . . . . . . . . 94.05 -2.28 68.76 Favored Glycine 0 N--CA 1.467 0.733 0 C-N-CA 124.419 1.009 . . . . 40.26 111.554 -177.478 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 180' ' ' MET . . . . . . . . . . . . . 54.7 mtt -108.52 170.16 8.2 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.181 0.992 . . . . 50.42 109.971 174.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 181' ' ' LEU . . . . . 0.493 HD23 ' C ' ' B' ' 181' ' ' LEU . 4.6 tt -170.21 136.38 1.4 Allowed 'General case' 0 C--O 1.246 0.905 0 C-N-CA 125.454 1.502 . . . . 47.31 107.437 -164.396 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 182' ' ' CYS . . . . . . . . . . . . . 11.0 m -113.37 151.65 30.99 Favored 'General case' 0 C--O 1.221 -0.445 0 N-CA-C 109.862 -0.421 . . . . 58.94 109.862 -177.452 -45.211 -173.705 -80.708 102.396 2.008 104.573 175.619 -171.827 1 1 . 1 . 001 ecloud build full ' B' B ' 183' ' ' ALA . . . . . . . . . . . . . . . -165.86 124.53 1.59 Allowed 'General case' 0 N--CA 1.438 -1.036 0 N-CA-C 107.337 -1.357 . . . . 45.93 107.337 -174.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 184' ' ' GLY . . . . . 0.443 ' HA2' ' CG2' ' B' ' 160' ' ' VAL . . . 151.96 171.48 19.74 Favored Glycine 0 C--N 1.336 0.545 0 O-C-N 124.443 1.09 . . . . 55.77 111.596 -165.124 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 184' A PHE . . . . . . . . . . . . . 54.9 m-85 -102.07 130.26 48.6 Favored 'General case' 0 N--CA 1.432 -1.344 0 N-CA-C 108.442 -0.947 . . . . 58.89 108.442 174.756 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 75.9 mt -61.66 -30.28 70.62 Favored 'General case' 0 C--O 1.215 -0.715 0 O-C-N 124.64 1.213 . . . . 67.4 109.594 178.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 186' ' ' GLU . . . . . . . . . . . . . 18.7 pm0 -72.1 -15.06 62.0 Favored 'General case' 0 C--O 1.217 -0.632 0 CA-C-O 118.85 -0.595 . . . . 66.22 110.734 176.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . 87.08 -167.16 37.59 Favored Glycine 0 N--CA 1.479 1.554 0 C-N-CA 124.318 0.961 . . . . 47.68 111.162 178.047 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . 100.97 -32.92 6.89 Favored Glycine 0 C--O 1.243 0.682 0 C-N-CA 123.13 0.395 . . . . 38.84 113.089 166.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 188' A THR . . . . . . . . . . . . . 2.8 m -130.06 136.28 49.19 Favored 'General case' 0 C--O 1.256 1.423 0 N-CA-C 109.797 -0.446 . . . . 45.65 109.797 172.28 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 189' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -178.47 167.64 1.83 Allowed 'General case' 0 C--O 1.243 0.744 0 O-C-N 125.363 1.664 . . . . 38.98 111.353 -171.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -78.38 161.9 26.84 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 114.469 -1.241 . . . . 39.24 109.372 166.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 191' ' ' CYS . . . . . . . . . . . . . 1.8 t -140.84 176.56 8.7 Favored 'General case' 0 C--O 1.244 0.765 0 CA-C-O 121.7 0.762 . . . . 42.11 109.872 177.983 -149.932 42.38 80.05 108.081 2.035 101.037 -179.418 -53.043 1 1 . 1 . 001 ecloud build full ' B' B ' 192' ' ' GLN . . . . . . . . . . . . . 16.3 mp0 -52.05 128.09 23.45 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 108.672 -0.862 . . . . 37.2 108.672 173.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 104.19 -7.34 47.64 Favored Glycine 0 N--CA 1.446 -0.656 0 CA-C-N 115.107 -0.952 . . . . 32.3 112.023 -178.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 194' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -95.3 -6.19 41.85 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 120.242 -0.583 . . . . 32.75 109.95 -178.162 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 195' ' ' SER . . . . . . . . . . . . . 1.2 m -75.17 150.06 38.81 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-O 122.687 1.232 . . . . 35.73 112.5 -168.468 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 196' ' ' GLY . . . . . 0.554 ' HA3' ' O ' ' B' ' 43' ' ' ALA . . . 89.77 -18.9 44.38 Favored Glycine 0 N--CA 1.41 -3.085 0 CA-C-N 110.756 -2.929 . . . . 38.15 111.289 -166.953 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -82.75 173.42 52.54 Favored Glycine 0 N--CA 1.438 -1.22 0 C-N-CA 121.363 -0.446 . . . . 31.78 112.398 -164.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 198' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -80.64 136.87 11.11 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 122.837 2.358 . . . . 32.84 116.337 -171.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 199' ' ' LEU . . . . . . . . . . . . . 28.4 tp -108.35 114.64 28.66 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.949 1.7 . . . . 36.72 108.396 150.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 200' ' ' VAL . . . . . 0.48 ' CG1' HD11 ' B' ' 207' ' ' LEU . 2.1 t -119.63 136.58 56.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 CA-C-N 113.908 -1.496 . . . . 46.06 111.216 -172.134 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 201' ' ' CYS . . . . . . . . . . . . . 32.0 m -130.13 166.6 19.88 Favored 'General case' 0 N--CA 1.486 1.35 0 O-C-N 124.432 1.082 . . . . 62.93 109.233 179.723 -50.227 -96.999 113.351 104.712 2.078 107.462 -89.349 -63.808 1 1 . 1 . 001 ecloud build full ' B' B ' 202' ' ' GLU . . . . . 0.688 ' HA ' ' O ' ' B' ' 206' ' ' ARG . 16.7 pt-20 -130.06 156.12 45.02 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 119.742 -0.783 . . . . 94.28 112.54 -173.317 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 203' ' ' ASP . . . . . 0.931 ' HB2' ' HB3' ' B' ' 206' ' ' ARG . 1.3 t0 . . . . . 0 N--CA 1.49 1.553 0 O-C-N 125.604 1.815 . . . . 94.98 110.165 -177.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 206' ' ' ARG . . . . . 0.931 ' HB3' ' HB2' ' B' ' 203' ' ' ASP . 17.6 tpp180 . . . . . 0 CA--C 1.533 0.304 0 N-CA-C 109.134 -0.691 . . . . 89.44 109.134 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 207' ' ' LEU . . . . . 0.48 HD11 ' CG1' ' B' ' 200' ' ' VAL . 7.3 tp -112.72 122.62 48.2 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.887 0.875 . . . . 69.36 110.411 -179.164 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 208' ' ' THR . . . . . . . . . . . . . 31.1 p -133.77 144.1 48.83 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-O 121.176 0.512 . . . . 61.54 112.248 -179.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 209' ' ' LEU . . . . . 0.435 ' HG ' HG21 ' B' ' 231' ' ' VAL . 56.3 tp -80.72 99.22 8.1 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.969 0.908 . . . . 46.68 109.263 178.827 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 210' ' ' GLN . . . . . . . . . . . . . 29.6 mm100 -84.26 -34.07 23.9 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 108.613 -0.884 . . . . 53.93 108.613 -174.418 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 211' ' ' GLY . . . . . . . . . . . . . . . -142.4 152.96 24.15 Favored Glycine 0 N--CA 1.481 1.656 0 O-C-N 124.323 1.015 . . . . 36.09 114.552 -169.185 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 212' ' ' ILE . . . . . 0.414 ' HB ' ' HB ' ' B' ' 229' ' ' THR . 49.0 mt -111.23 126.4 68.61 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 124.777 1.231 . . . . 38.72 108.338 168.645 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 213' ' ' ILE . . . . . . . . . . . . . 36.9 mt -60.97 123.89 14.47 Favored 'Isoleucine or valine' 0 C--O 1.24 0.575 0 N-CA-C 106.806 -1.553 . . . . 33.02 106.806 -179.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 214' ' ' SER . . . . . . . . . . . . . 42.6 t -125.69 -78.73 0.6 Allowed 'General case' 0 N--CA 1.442 -0.842 0 O-C-N 123.992 0.807 . . . . 33.59 110.389 -166.269 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 215' ' ' TRP . . . . . . . . . . . . . 60.3 p-90 -143.99 -179.27 6.39 Favored 'General case' 0 N--CA 1.437 -1.104 0 C-N-CA 118.753 -1.179 . . . . 44.9 111.805 -175.899 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 216' ' ' GLY . . . . . . . . . . . . . . . 175.22 164.88 30.56 Favored Glycine 0 C--O 1.213 -1.186 0 CA-C-N 115.024 -0.989 . . . . 47.06 112.569 174.024 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 217' ' ' SER . . . . . . . . . . . . . 14.6 t -96.23 118.04 32.0 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 105.091 -2.189 . . . . 51.28 105.091 174.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 219' ' ' GLY . . . . . . . . . . . . . . . 57.63 -163.3 7.94 Favored Glycine 0 N--CA 1.448 -0.514 0 N-CA-C 110.152 -1.179 . . . . 43.6 110.152 -173.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 220' ' ' CYS . . . . . . . . . . . . . 48.5 m -134.12 109.59 9.03 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 110.007 -0.368 . . . . 41.67 110.007 173.104 -53.043 -179.418 80.05 101.037 2.035 108.081 42.38 -149.932 1 1 . 1 . 001 ecloud build full ' B' B ' 221' ' ' GLY . . . . . . . . . . . . . . . 64.5 41.45 97.94 Favored Glycine 0 N--CA 1.444 -0.796 0 CA-C-N 115.282 -0.872 . . . . 50.73 112.073 -177.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 221' A ASP . . . . . . . . . . . . . 87.2 m-20 -83.5 151.57 25.35 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 109.107 -0.701 . . . . 57.21 109.107 169.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 222' ' ' ARG . . . . . 0.474 ' NH2' ' O ' ' B' ' 405' ' ' HOH . 10.5 ttp85 -52.38 126.51 19.42 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.776 1.23 . . . . 85.18 109.427 174.875 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 223' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 67.39 27.17 8.2 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 125.843 1.657 . . . . 67.21 110.598 174.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 224' ' ' LYS . . . . . . . . . . . . . 24.1 mmtt -137.92 70.46 49.95 Favored Pre-proline 0 C--N 1.34 0.16 0 C-N-CA 123.959 0.904 . . . . 58.19 109.138 -178.016 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 225' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -71.15 154.4 62.1 Favored 'Trans proline' 0 CA--C 1.54 0.78 0 C-N-CA 120.877 1.052 . . . . 46.91 110.82 175.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 226' ' ' GLY . . . . . . . . . . . . . . . -61.37 142.34 48.31 Favored Glycine 0 N--CA 1.442 -0.964 0 N-CA-C 110.613 -0.995 . . . . 46.58 110.613 176.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 227' ' ' VAL . . . . . . . . . . . . . 21.0 t -103.64 148.03 9.12 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.85 0 N-CA-C 107.472 -1.307 . . . . 40.43 107.472 173.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 228' ' ' TYR . . . . . . . . . . . . . 42.0 m-85 -136.91 146.04 45.02 Favored 'General case' 0 N--CA 1.442 -0.847 0 C-N-CA 126.056 1.742 . . . . 38.18 110.025 -169.591 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 229' ' ' THR . . . . . 0.414 ' HB ' ' HB ' ' B' ' 212' ' ' ILE . 35.8 m -70.77 124.84 25.25 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 108.308 -0.997 . . . . 34.77 108.308 166.836 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 230' ' ' ASP . . . . . . . . . . . . . 52.8 t0 -74.12 95.46 2.57 Favored 'General case' 0 C--O 1.204 -1.296 0 C-N-CA 125.841 1.656 . . . . 40.44 109.337 179.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 231' ' ' VAL . . . . . 0.435 HG21 ' HG ' ' B' ' 209' ' ' LEU . 77.3 t -57.05 -44.45 82.95 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.687 0 N-CA-C 109.935 -0.395 . . . . 39.72 109.935 -169.863 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -56.17 -35.51 67.31 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.839 0.856 . . . . 40.46 110.536 -173.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 233' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -59.52 -18.98 44.86 Favored 'General case' 0 C--O 1.208 -1.093 0 C-N-CA 124.639 1.175 . . . . 42.09 112.028 178.718 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 234' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 -122.02 13.69 10.58 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 118.829 0.74 . . . . 35.83 110.216 -164.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 235' ' ' LEU . . . . . . . . . . . . . 60.9 mt -55.1 -43.68 74.25 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 123.234 0.334 . . . . 43.09 111.284 -177.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 236' ' ' ALA . . . . . . . . . . . . . . . -65.36 -48.02 74.41 Favored 'General case' 0 C--O 1.246 0.888 0 N-CA-C 109.746 -0.465 . . . . 37.27 109.746 178.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 237' ' ' TRP . . . . . . . . . . . . . 86.3 t90 -53.41 -45.26 69.29 Favored 'General case' 0 N--CA 1.437 -1.099 0 N-CA-C 108.842 -0.799 . . . . 39.98 108.842 178.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 238' ' ' ILE . . . . . . . . . . . . . 96.3 mt -63.58 -46.91 93.64 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 CA-C-O 119.039 -0.505 . . . . 42.82 110.663 -177.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 239' ' ' ARG . . . . . . . . . . . . . 51.6 mtt180 -56.07 -50.92 69.63 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.223 0.609 . . . . 83.79 110.354 178.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 240' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -76.74 -9.05 58.4 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 122.209 -0.307 . . . . 84.73 110.751 -169.5 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 241' ' ' HIS . . . . . . . . . . . . . 48.2 m80 -108.59 31.37 5.67 Favored 'General case' 0 C--O 1.21 -0.999 0 C-N-CA 122.678 0.391 . . . . 48.67 111.623 177.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 30.0 p -101.62 38.2 1.66 Allowed 'General case' 0 C--O 1.239 0.547 0 CA-C-O 121.009 0.433 . . . . 51.47 110.043 176.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 243' ' ' VAL . . . . . . . . . . . . . 1.7 m -86.98 151.07 3.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 N-CA-C 106.181 -1.785 . . . . 54.99 106.181 172.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 244' ' ' SER . . . . . . . . . . . . . 22.7 t -157.28 155.98 31.67 Favored 'General case' 0 N--CA 1.429 -1.476 0 CA-C-O 122.569 1.176 . . . . 56.63 111.25 -175.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 245' ' ' THR . . . . . . . . . . . . . 67.8 p -69.57 168.57 14.44 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 111.538 -2.574 . . . . 38.8 106.286 171.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 246' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 . . . . . 0 N--CA 1.502 2.136 0 CA-C-O 117.062 -1.447 . . . . 38.68 112.423 -168.78 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 301' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 302' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 303' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 304' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 305' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 306' ' ' CYS . . . . . 0.454 ' SG ' ' N ' ' B' ' 122' ' ' CYS . 47.3 m . . . . . 0 N--CA 1.487 1.404 0 CA-C-O 117.324 -1.322 . . . . 105.23 109.435 . -76.716 -133.206 -94.455 118.89 1.985 91.207 -22.755 -59.257 1 1 . 1 . 001 ecloud build full ' B' B ' 401' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 405' ' ' HOH . . . . . 0.474 ' O ' ' NH2' ' B' ' 222' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 416' ' ' HOH . . . . . 0.491 ' O ' ' HA ' ' B' ' 133' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 422' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 426' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 428' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 431' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 432' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 435' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 436' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 438' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 439' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 440' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 441' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 442' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 443' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 444' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 445' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 446' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 447' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 448' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 449' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 453' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 454' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 455' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 456' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 457' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 458' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 459' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 39.5 t . . . . . 0 N--CA 1.49 1.562 0 CA-C-O 117.932 -1.033 . . . . 37.44 108.417 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 2.6 m -94.61 143.69 11.24 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 O-C-N 123.931 0.769 . . . . 37.6 109.562 177.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' GLY . . . . . . . . . . . . . . . 59.19 42.92 97.42 Favored Glycine 0 CA--C 1.525 0.668 0 CA-C-O 119.191 -0.783 . . . . 39.01 112.304 -176.417 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . -117.76 -170.29 15.07 Favored Glycine 0 N--CA 1.485 1.926 0 CA-C-O 118.77 -1.017 . . . . 33.72 111.41 179.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 18.1 mt -136.36 144.03 44.37 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 118.134 0.967 . . . . 32.13 109.608 -174.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 38.6 t -52.93 133.95 15.18 Favored 'Isoleucine or valine' 0 C--O 1.205 -1.281 0 N-CA-C 107.038 -1.467 . . . . 31.74 107.038 169.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' ALA . . . . . . . . . . . . . . . -96.63 154.36 17.32 Favored 'General case' 0 C--O 1.225 -0.189 0 C-N-CA 123.109 0.563 . . . . 36.23 109.568 -178.372 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 87.5 mt -64.73 154.74 35.87 Favored 'General case' 0 C--O 1.211 -0.931 0 N-CA-C 108.687 -0.857 . . . . 39.67 108.687 171.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' ARG . . . . . . . . . . . . . 15.3 mtt-85 -53.09 128.84 28.99 Favored 'General case' 0 CA--C 1.538 0.513 0 CA-C-O 122.288 1.042 . . . . 71.55 108.949 164.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' GLY . . . . . . . . . . . . . . . 80.54 7.7 88.28 Favored Glycine 0 N--CA 1.449 -0.468 0 CA-C-O 119.298 -0.723 . . . . 41.49 112.567 174.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' ALA . . . . . . . . . . . . . . . -59.63 -39.5 84.51 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 117.548 0.674 . . . . 36.63 109.813 -178.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' HIS . . . . . . . . . . . . . 75.2 m-70 -130.78 79.54 71.61 Favored Pre-proline 0 N--CA 1.488 1.457 0 N-CA-C 107.768 -1.197 . . . . 38.54 107.768 -178.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 80.5 Cg_endo -78.87 0.97 9.54 Favored 'Trans proline' 0 CA--C 1.539 0.757 0 C-N-CA 121.556 1.504 . . . . 33.66 113.615 -172.152 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' TYR . . . . . . . . . . . . . 2.5 p90 -97.08 -2.41 43.3 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 124.167 0.987 . . . . 36.31 112.247 178.155 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' ILE . . . . . . . . . . . . . 13.2 tt -85.11 137.33 21.02 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 CA-C-O 121.784 0.802 . . . . 30.49 109.197 -175.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -113.96 137.53 51.57 Favored 'General case' 0 N--CA 1.425 -1.697 0 CA-C-N 114.049 -1.432 . . . . 30.65 108.353 -177.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' ALA . . . . . . . . . . . . . . . -102.55 126.38 49.59 Favored 'General case' 0 N--CA 1.443 -0.78 0 O-C-N 124.61 1.194 . . . . 29.92 108.519 170.414 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 10.9 mp -108.27 122.69 47.48 Favored 'General case' 0 C--O 1.212 -0.907 0 C-N-CA 124.478 1.111 . . . . 35.25 109.829 179.848 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' TYR . . . . . . . . . . . . . 46.6 m-85 -124.92 130.94 53.37 Favored 'General case' 0 C--O 1.243 0.753 0 N-CA-C 109.327 -0.619 . . . . 31.9 109.327 177.467 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' TRP . . . . . . . . . . . . . 12.0 p90 -152.29 146.05 25.09 Favored 'General case' 0 N--CA 1.448 -0.527 0 CA-C-N 114.874 -1.057 . . . . 35.9 108.917 166.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' GLY . . . . . . . . . . . . . . . 48.92 -126.7 18.47 Favored Glycine 0 C--N 1.337 0.616 0 N-CA-C 110.666 -0.974 . . . . 43.39 110.666 174.815 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' HIS . . . . . . . . . . . . . 34.3 m80 -107.06 38.16 2.18 Favored 'General case' 0 C--O 1.22 -0.448 0 N-CA-C 109.384 -0.598 . . . . 65.83 109.384 174.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' SER . . . . . . . . . . . . . 37.5 m -126.66 162.37 25.9 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 124.098 0.959 . . . . 35.07 110.988 -173.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' PHE . . . . . . . . . . . . . 69.7 t80 -155.45 141.55 18.34 Favored 'General case' 0 N--CA 1.448 -0.551 0 CA-C-N 114.669 -1.151 . . . . 35.35 110.683 -176.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' CYS . . . . . . . . . . . . . 1.3 m -152.92 170.97 19.08 Favored 'General case' 0 C--O 1.225 -0.193 0 CA-C-O 122.4 1.095 . . . . 40.83 111.173 167.488 -94.888 -141.381 -87.659 104.332 2.04 102.861 -80.821 -90.605 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' ALA . . . . . 0.554 ' O ' ' HA3' ' B' ' 196' ' ' GLY . . . -110.15 163.67 13.38 Favored 'General case' 0 N--CA 1.433 -1.314 0 CA-C-N 114.355 -1.293 . . . . 30.48 108.512 176.046 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' GLY . . . . . . . . . . . . . . . -156.76 178.09 33.36 Favored Glycine 0 N--CA 1.423 -2.19 0 CA-C-N 114.587 -1.188 . . . . 31.74 111.166 174.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' SER . . . . . . . . . . . . . 36.7 m -126.15 119.24 27.01 Favored 'General case' 0 N--CA 1.43 -1.468 0 N-CA-C 109.357 -0.609 . . . . 31.45 109.357 -175.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 23.9 tp -70.11 117.64 11.93 Favored 'General case' 0 C--O 1.209 -1.07 0 N-CA-C 108.538 -0.912 . . . . 30.82 108.538 174.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' ILE . . . . . . . . . . . . . 22.6 pt -105.5 -15.58 8.45 Favored 'Isoleucine or valine' 0 C--O 1.198 -1.614 0 C-N-CA 123.367 0.667 . . . . 31.92 110.938 -179.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' ALA . . . . . . . . . . . . . . . -156.88 162.25 27.97 Favored Pre-proline 0 C--N 1.322 -0.595 0 N-CA-C 106.875 -1.528 . . . . 29.29 106.875 173.299 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_exo -49.54 -32.85 28.72 Favored 'Trans proline' 0 C--N 1.348 0.521 0 CA-C-N 120.722 1.294 . . . . 31.78 114.236 -176.037 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' CYS . . . . . . . . . . . . . 99.3 m -106.79 5.44 28.58 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 124.825 1.328 . . . . 35.23 114.165 -178.129 -65.589 -63.963 101.141 102.695 1.933 103.926 137.782 -71.803 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' TRP . . . . . 0.425 ' CZ2' ' HD3' ' B' ' 107' ' ' ARG . 99.0 m95 -131.1 132.03 44.57 Favored 'General case' 0 C--O 1.245 0.852 0 O-C-N 121.154 -0.967 . . . . 32.8 111.678 -169.526 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' VAL . . . . . . . . . . . . . 37.6 t -126.32 137.87 56.42 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 CA-C-N 115.393 -0.821 . . . . 24.17 109.005 178.454 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' LEU . . . . . . . . . . . . . 8.5 tp -110.52 140.18 45.06 Favored 'General case' 0 C--O 1.217 -0.608 0 N-CA-C 108.974 -0.75 . . . . 34.59 108.974 177.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' THR . . . . . . . . . . . . . 9.5 t -151.34 -171.29 3.89 Favored 'General case' 0 C--O 1.216 -0.676 0 C-N-CA 123.279 0.632 . . . . 30.49 109.327 178.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' ALA . . . . . . . . . . . . . . . -88.76 153.79 20.8 Favored 'General case' 0 N--CA 1.44 -0.972 0 N-CA-C 107.957 -1.127 . . . . 33.64 107.957 179.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.75 -42.36 73.99 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-N 115.618 -0.719 . . . . 34.38 109.364 176.522 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' HIS . . . . . . . . . . . . . 5.3 p-80 -59.26 -34.26 72.04 Favored 'General case' 0 C--O 1.212 -0.918 0 O-C-N 123.61 0.569 . . . . 30.41 110.387 -173.499 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' CYS . . . . . . . . . . . . . 1.7 m -52.68 -43.31 65.47 Favored 'General case' 0 N--CA 1.439 -1.006 0 C-N-CA 124.232 1.013 . . . . 34.56 111.932 179.171 -90.605 -80.821 -87.659 102.861 2.04 104.332 -141.381 -94.888 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' LEU . . . . . . . . . . . . . 43.4 mt -113.28 18.79 17.58 Favored 'General case' 0 C--O 1.217 -0.644 0 O-C-N 125.149 1.531 . . . . 30.1 111.595 -174.926 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -33.04 -43.55 0.1 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.983 1.713 . . . . 39.4 111.954 166.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' A ASP . . . . . . . . . . . . . 17.3 p-10 -78.56 -3.56 44.33 Favored 'General case' 0 C--O 1.209 -1.067 0 CA-C-N 115.875 -0.602 . . . . 47.24 110.209 -169.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' B ARG . . . . . . . . . . . . . 6.8 mpt_? 58.47 48.36 2.46 Favored Pre-proline 0 N--CA 1.47 0.549 0 C-N-CA 124.533 1.133 . . . . 42.9 111.138 169.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' C PRO . . . . . . . . . . . . . 37.6 Cg_endo -59.6 146.16 96.05 Favored 'Trans proline' 0 N--CA 1.46 -0.461 0 CA-C-N 120.434 1.191 . . . . 33.63 110.508 179.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' D ALA . . . . . . . . . . . . . . . -58.59 142.57 82.85 Favored Pre-proline 0 N--CA 1.457 -0.108 0 N-CA-C 107.514 -1.291 . . . . 32.12 107.514 173.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' PRO . . . . . . . . . . . . . 26.6 Cg_endo -62.5 -27.99 77.32 Favored 'Trans proline' 0 CA--C 1.538 0.716 0 C-N-CA 120.853 1.035 . . . . 27.16 111.598 -172.011 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' GLU . . . . . . . . . . . . . 17.5 pm0 -64.61 -21.35 66.69 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 123.528 0.518 . . . . 30.17 110.277 179.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' ASP . . . . . . . . . . . . . 88.6 m-20 -82.53 -11.66 58.3 Favored 'General case' 0 N--CA 1.438 -1.055 0 C-N-CA 123.381 0.672 . . . . 38.27 111.308 -176.161 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' LEU . . . . . . . . . . . . . 47.3 mt -88.74 139.9 29.99 Favored 'General case' 0 N--CA 1.47 0.543 0 CA-C-N 118.653 0.66 . . . . 32.8 109.87 -176.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' THR . . . . . . . . . . . . . 26.6 m -118.49 127.58 53.77 Favored 'General case' 0 C--O 1.246 0.904 0 C-N-CA 123.726 0.81 . . . . 28.19 109.605 163.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 92.5 t -108.31 128.71 63.61 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 N-CA-C 107.506 -1.294 . . . . 31.47 107.506 172.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' VAL . . . . . . . . . . . . . 18.4 t -114.25 123.0 69.48 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.545 0 N-CA-C 107.3 -1.37 . . . . 30.36 107.3 178.061 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 83.7 mt -108.15 147.6 31.05 Favored 'General case' 0 C--O 1.244 0.773 0 O-C-N 123.682 0.614 . . . . 32.65 109.943 176.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' GLY . . . . . . . . . . . . . . . 72.86 38.06 56.59 Favored Glycine 0 C--N 1.344 1.024 0 O-C-N 124.745 1.278 . . . . 36.31 111.912 174.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' GLN . . . . . . . . . . . . . 31.5 tt0 -101.69 133.11 46.9 Favored 'General case' 0 C--O 1.21 -0.997 0 C-N-CA 124.6 1.16 . . . . 37.86 108.934 -172.605 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 56.5 tt0 -89.38 -47.43 8.02 Favored 'General case' 0 C--O 1.217 -0.611 0 C-N-CA 123.554 0.742 . . . . 53.63 110.444 179.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' ARG . . . . . 0.41 ' HB2' ' HB2' ' B' ' 75' ' ' HIS . 67.2 mtp180 -119.6 133.17 55.77 Favored 'General case' 0 N--CA 1.472 0.642 0 O-C-N 124.552 1.157 . . . . 47.77 111.412 -174.772 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' ARG . . . . . . . . . . . . . 24.5 ttp180 -45.75 113.34 0.59 Allowed 'General case' 0 N--CA 1.451 -0.415 0 C-N-CA 125.349 1.46 . . . . 44.78 109.068 177.44 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 71.94 20.82 4.31 Favored 'General case' 0 N--CA 1.44 -0.929 0 C-N-CA 125.235 1.414 . . . . 39.89 110.781 167.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' HIS . . . . . 0.41 ' HB2' ' HB2' ' B' ' 72' ' ' ARG . 28.3 m80 -107.36 138.95 42.61 Favored 'General case' 0 C--O 1.246 0.905 0 C-N-CA 122.818 0.447 . . . . 65.96 110.854 174.264 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' SER . . . . . . . . . . . . . 1.4 m -71.72 155.24 40.7 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 113.699 -1.591 . . . . 52.41 106.984 171.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' CYS . . . . . . . . . . . . . 7.2 p -161.73 149.38 14.72 Favored 'General case' 0 C--O 1.213 -0.826 0 N-CA-C 108.284 -1.006 . . . . 42.87 108.284 -174.139 80.764 -72.017 108.062 111.236 2.121 106.724 57.615 -77.524 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' GLU . . . . . 0.483 ' HB3' ' HD3' ' B' ' 79' ' ' PRO . 2.9 tp10 -46.76 -56.04 12.84 Favored Pre-proline 0 N--CA 1.475 0.797 0 CA-C-O 119.391 -0.338 . . . . 82.4 110.818 -178.453 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' PRO . . . . . 0.483 ' HD3' ' HB3' ' B' ' 78' ' ' GLU . 37.4 Cg_endo -88.14 7.77 4.38 Favored 'Trans proline' 0 CA--C 1.543 0.969 0 N-CA-C 117.222 1.97 . . . . 42.62 117.222 -176.646 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' CYS . . . . . . . . . . . . . 36.5 m -61.33 142.68 56.72 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-O 120.876 0.369 . . . . 41.29 110.134 174.821 -77.524 57.615 108.062 106.724 2.121 111.236 -72.017 80.764 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' GLN . . . . . . . . . . . . . 43.9 mt-30 -129.17 126.84 40.12 Favored 'General case' 0 N--CA 1.451 -0.41 0 N-CA-C 108.623 -0.88 . . . . 33.99 108.623 175.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' THR . . . . . . . . . . . . . 55.1 m -111.93 115.18 28.55 Favored 'General case' 0 C--O 1.211 -0.922 0 O-C-N 124.245 0.965 . . . . 31.8 109.625 -174.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 6.3 mp -120.03 155.03 33.72 Favored 'General case' 0 C--O 1.225 -0.214 0 O-C-N 123.672 0.607 . . . . 34.56 109.528 -179.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -86.98 176.41 7.66 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 125.415 1.486 . . . . 30.62 108.957 167.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' VAL . . . . . . . . . . . . . 91.4 t -121.65 131.93 71.94 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.972 0 N-CA-C 107.962 -1.125 . . . . 29.47 107.962 -178.178 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' ARG . . . . . . . . . . . . . 34.7 mtt-85 -71.88 -51.08 24.08 Favored 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 123.372 0.669 . . . . 31.4 109.819 177.489 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' SER . . . . . . . . . . . . . 96.9 p -168.17 161.77 12.56 Favored 'General case' 0 C--O 1.209 -1.031 0 CA-C-N 113.908 -1.497 . . . . 35.82 106.965 -164.122 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' TYR . . . . . . . . . . . . . 33.0 p90 -159.82 160.96 34.4 Favored 'General case' 0 N--CA 1.446 -0.67 0 O-C-N 123.339 0.399 . . . . 33.28 110.381 173.481 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' ARG . . . . . . . . . . . . . 1.1 mmt85 -138.92 126.68 22.1 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-N 116.301 -0.409 . . . . 83.94 109.973 -175.086 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' LEU . . . . . . . . . . . . . 11.2 mp -81.95 152.28 26.82 Favored 'General case' 0 C--O 1.21 -1.005 0 N-CA-C 107.684 -1.228 . . . . 33.48 107.684 166.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' HIS . . . . . . . . . . . . . 62.9 t-80 -64.43 122.23 16.23 Favored 'General case' 0 N--CA 1.439 -0.991 0 O-C-N 124.06 0.85 . . . . 37.92 109.303 170.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' GLU . . . . . . . . . . . . . 59.7 mp0 -44.87 -35.47 2.82 Favored 'General case' 0 N--CA 1.468 0.465 0 C-N-CA 127.152 2.181 . . . . 47.08 113.126 -179.655 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' ALA . . . . . . . . . . . . . . . -102.82 9.96 38.68 Favored 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 118.147 -0.93 . . . . 36.49 112.031 -170.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' PHE . . . . . . . . . . . . . 25.9 t80 -57.53 119.22 6.16 Favored 'General case' 0 C--O 1.205 -1.271 0 CA-C-O 118.774 -0.631 . . . . 35.76 110.051 -179.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' SER . . . . . . . . . . . . . 10.8 t -103.45 121.19 49.35 Favored Pre-proline 0 C--N 1.34 0.172 0 O-C-N 123.904 0.752 . . . . 40.96 110.746 -179.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' PRO . . . . . . . . . . . . . 73.8 Cg_endo -80.54 2.04 8.82 Favored 'Trans proline' 0 C--N 1.352 0.736 0 C-N-CA 121.544 1.496 . . . . 41.76 114.989 171.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' VAL . . . . . . . . . . . . . 51.2 t -86.33 -55.95 5.97 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.214 0 CA-C-O 121.905 0.859 . . . . 38.9 109.602 168.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' SER . . . . . . . . . . . . . 87.2 p -91.38 -20.55 21.69 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.585 1.154 . . . . 37.91 111.832 -173.206 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' TYR . . . . . . . . . . . . . 22.9 m-30 71.77 12.78 6.24 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 126.914 2.086 . . . . 39.4 111.065 -175.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' GLN . . . . . . . . . . . . . 62.5 tt0 -75.66 150.59 37.91 Favored 'General case' 0 C--O 1.207 -1.139 0 CA-C-O 121.234 0.54 . . . . 44.31 110.006 -173.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' HIS . . . . . . . . . . . . . 35.2 m-70 61.6 46.54 7.18 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 123.746 0.818 . . . . 36.78 110.405 179.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' ASP . . . . . . . . . . . . . 48.5 t0 -89.18 76.01 7.76 Favored 'General case' 0 N--CA 1.447 -0.592 0 CA-C-O 121.001 0.429 . . . . 31.91 110.205 -174.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' LEU . . . . . . . . . . . . . 1.7 pt? -151.78 167.07 29.4 Favored 'General case' 0 C--O 1.221 -0.426 0 C-N-CA 118.504 -1.278 . . . . 42.04 110.91 167.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' ALA . . . . . . . . . . . . . . . -153.51 152.86 31.43 Favored 'General case' 0 N--CA 1.44 -0.972 0 O-C-N 125.677 1.861 . . . . 28.2 109.449 -177.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' LEU . . . . . . . . . . . . . 59.4 tp -127.29 124.68 39.33 Favored 'General case' 0 N--CA 1.445 -0.724 0 N-CA-C 108.06 -1.089 . . . . 31.23 108.06 -173.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' LEU . . . . . . . . . . . . . 8.6 mp -108.05 131.9 54.11 Favored 'General case' 0 C--O 1.214 -0.815 0 O-C-N 124.091 0.87 . . . . 31.34 109.205 -179.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' ARG . . . . . 0.425 ' HD3' ' CZ2' ' B' ' 51' ' ' TRP . 32.2 tpt85 -94.97 120.36 35.05 Favored 'General case' 0 C--O 1.203 -1.366 0 N-CA-C 107.478 -1.304 . . . . 29.57 107.478 166.081 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' LEU . . . . . 0.424 ' O ' ' NH2' ' B' ' 107' ' ' ARG . 35.9 mt -77.02 163.47 26.65 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 123.26 0.35 . . . . 34.51 110.586 177.954 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' GLN . . . . . . . . . . . . . 66.2 tp60 -95.81 121.28 37.37 Favored 'General case' 0 C--O 1.212 -0.877 0 C-N-CA 124.891 1.276 . . . . 36.77 110.518 179.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 109' A GLU . . . . . . . . . . . . . 53.3 mp0 -56.94 138.54 53.89 Favored 'General case' 0 C--O 1.21 -1.006 0 C-N-CA 123.862 0.865 . . . . 30.58 109.437 172.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 109' B ASP . . . . . 0.728 ' O ' ' O ' ' B' ' 109' D ASP . 11.2 p30 -68.52 -178.08 1.06 Allowed 'General case' 0 N--CA 1.48 1.063 0 N-CA-C 107.978 -1.119 . . . . 33.63 107.978 170.562 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 109' C ALA . . . . . . . . . . . . . . . -69.03 -27.12 65.37 Favored 'General case' 0 C--O 1.217 -0.643 0 N-CA-C 114.111 1.152 . . . . 34.03 114.111 -171.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 109' D ASP . . . . . 0.728 ' O ' ' O ' ' B' ' 109' B ASP . 14.7 m-20 -71.22 178.06 3.52 Favored 'General case' 0 N--CA 1.474 0.746 0 N-CA-C 103.35 -2.833 . . . . 51.64 103.35 153.897 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 109' E GLY . . . . . . . . . . . . . . . -93.35 25.18 21.83 Favored Glycine 0 N--CA 1.486 2.005 1 C-N-CA 113.186 -4.34 . . . . 37.11 115.503 -170.499 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' SER . . . . . . . . . . . . . 2.6 p -107.9 147.2 31.3 Favored 'General case' 0 N--CA 1.492 1.654 0 CA-C-N 119.028 1.414 . . . . 39.9 112.338 -164.422 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' CYS . . . . . . . . . . . . 0.3 68.9 m -103.02 -154.72 0.5 Allowed 'General case' 0 N--CA 1.479 1.019 1 N-CA-C 97.698 -4.927 . . . . 36.01 97.698 173.452 -71.803 137.782 101.141 103.926 1.933 102.695 -63.963 -65.589 3 2 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' ALA . . . . . . . . . . . . . . . -32.2 124.96 0.3 Allowed 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 116.931 2.197 . . . . 39.25 116.931 179.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' LEU . . . . . . . . . . . . . 31.9 mt -91.65 116.61 29.02 Favored 'General case' 0 C--O 1.214 -0.78 0 N-CA-C 107.656 -1.239 . . . . 36.98 107.656 173.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' LEU . . . . . . . . . . . . . 21.5 mt -64.5 143.57 57.82 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 109.077 -0.712 . . . . 46.57 109.077 -175.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' SER . . . . . 0.509 ' HB2' ' HD2' ' B' ' 116' ' ' PRO . 28.4 p -154.69 174.22 4.07 Favored Pre-proline 0 N--CA 1.425 -1.715 0 N-CA-C 106.737 -1.579 . . . . 39.62 106.737 -177.512 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' PRO . . . . . 0.509 ' HD2' ' HB2' ' B' ' 115' ' ' SER . 49.0 Cg_endo -65.87 -11.34 30.43 Favored 'Trans proline' 0 CA--C 1.544 1.002 0 CA-C-N 119.546 0.874 . . . . 45.04 113.072 172.515 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -106.54 -12.42 15.61 Favored 'General case' 0 N--CA 1.487 1.393 0 C-N-CA 124.137 0.975 . . . . 55.57 112.55 -178.483 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' VAL . . . . . . . . . . . . . 53.9 t -136.79 111.22 9.89 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.907 0 N-CA-C 108.431 -0.952 . . . . 36.89 108.431 -172.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' GLN . . . . . . . . . . . . . 21.2 tp60 -154.2 131.35 6.02 Favored Pre-proline 0 N--CA 1.442 -0.849 0 N-CA-C 107.252 -1.388 . . . . 46.07 107.252 -167.272 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_exo -70.32 168.11 23.22 Favored 'Trans proline' 0 N--CA 1.458 -0.608 0 N-CA-C 108.5 -1.385 . . . . 37.44 108.5 177.153 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' VAL . . . . . . . . . . . . . 4.9 p -124.9 127.7 72.69 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.906 0 N-CA-C 107.478 -1.304 . . . . 37.66 107.478 172.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' CYS . . . . . 0.454 ' N ' ' SG ' ' B' ' 306' ' ' CYS . 82.5 m -52.99 148.74 7.37 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 121.81 0.814 . . . . 68.02 110.381 -179.338 -59.257 -22.755 -94.455 91.207 1.985 118.89 -133.206 -76.716 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' LEU . . . . . . . . . . . . . 92.4 mt -75.0 162.07 74.92 Favored Pre-proline 0 N--CA 1.429 -1.493 0 N-CA-C 107.999 -1.111 . . . . 47.47 107.999 167.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -76.17 -175.68 2.66 Favored 'Trans proline' 0 CA--C 1.536 0.576 0 N-CA-C 109.238 -1.101 . . . . 56.92 109.238 173.041 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' SER . . . . . . . . . . . . . 5.0 p -122.97 -7.63 8.37 Favored 'General case' 0 N--CA 1.481 1.12 0 O-C-N 123.389 0.431 . . . . 75.17 111.221 165.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' GLY . . . . . . . . . . . . . . . 57.03 59.91 10.0 Favored Glycine 0 C--N 1.337 0.601 0 N-CA-C 112.036 -0.426 . . . . 82.21 112.036 176.255 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 0.304 0 C-N-CA 124.051 0.94 . . . . 84.11 109.239 -178.728 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' PRO . . . . . . . . . . . . . 75.4 Cg_exo . . . . . 0 CA--C 1.538 0.684 0 N-CA-C 112.783 0.263 . . . . 104.35 112.783 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' SER . . . . . . . . . . . . . 71.1 m -161.03 57.45 0.3 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 123.213 0.605 . . . . 109.62 110.508 -172.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' GLU . . . . . . . . . . . . . 22.5 tp10 -72.61 107.11 4.93 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.601 0.76 . . . . 108.24 110.091 -179.106 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' THR . . . . . 0.491 ' HA ' ' O ' ' B' ' 416' ' ' HOH . 16.6 m 70.2 50.27 0.43 Allowed 'General case' 0 N--CA 1.499 1.988 0 C-N-CA 125.433 1.493 . . . . 106.18 111.527 169.531 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 134' ' ' THR . . . . . 0.559 HG21 ' O ' ' B' ' 202' ' ' GLU . 1.2 m -89.42 175.87 7.14 Favored 'General case' 0 N--CA 1.468 0.46 0 N-CA-C 108.416 -0.957 . . . . 105.06 108.416 166.181 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 135' ' ' LEU . . . . . . . . . . . . . 2.1 tp -71.08 106.17 3.62 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 109.164 -0.68 . . . . 80.4 109.164 166.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 136' ' ' CYS . . . . . . . . . . . . . 78.4 m -120.62 128.46 53.04 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 122.868 0.467 . . . . 55.91 109.991 177.237 -63.808 -89.349 113.351 107.462 2.078 104.712 -96.999 -50.227 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 137' ' ' GLN . . . . . . . . . . . . . 11.2 mt-30 -110.43 144.57 39.02 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 115.953 -0.567 . . . . 49.13 110.013 176.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 138' ' ' VAL . . . . . . . . . . . . . 4.7 p -112.23 149.53 14.78 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.641 0 N-CA-C 107.781 -1.192 . . . . 35.81 107.781 165.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 139' ' ' ALA . . . . . . . . . . . . . . . -141.33 151.21 43.4 Favored 'General case' 0 N--CA 1.483 1.185 0 CA-C-O 121.241 0.543 . . . . 33.9 111.396 177.368 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 140' ' ' GLY . . . . . . . . . . . . . . . 177.27 168.68 37.41 Favored Glycine 0 N--CA 1.472 1.081 0 CA-C-O 122.334 0.963 . . . . 32.37 114.189 -178.306 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 141' ' ' TRP . . . . . . . . . . . . . 22.6 m-90 -108.16 12.47 26.66 Favored 'General case' 0 N--CA 1.438 -1.07 0 CA-C-N 114.441 -0.88 . . . . 30.41 110.535 179.226 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 142' ' ' GLY . . . . . . . . . . . . . . . -70.26 -163.99 4.68 Favored Glycine 0 CA--C 1.525 0.663 0 CA-C-O 123.466 1.592 . . . . 29.74 113.484 -176.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 143' ' ' HIS . . . . . . . . . . . . . 38.6 m170 -63.83 138.87 58.67 Favored 'General case' 0 N--CA 1.44 -0.94 0 CA-C-N 114.336 -0.932 . . . . 32.24 109.719 -177.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 144' ' ' GLN . . . . . . . . . . . . . 8.2 mt-30 -85.53 -10.05 56.55 Favored 'General case' 0 C--O 1.223 -0.32 0 O-C-N 124.444 1.09 . . . . 40.23 110.506 178.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 145' ' ' PHE . . . . . . . . . . . . . 50.8 p90 -163.78 145.51 9.2 Favored 'General case' 0 N--CA 1.491 1.588 0 C-N-CA 125.647 1.579 . . . . 42.7 108.499 174.08 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 146' ' ' GLU . . . . . . . . . . . . . 63.3 tt0 -51.67 130.85 29.3 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-O 121.296 0.57 . . . . 69.67 110.857 -176.644 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 147' ' ' GLY . . . . . . . . . . . . . . . 65.8 29.44 75.08 Favored Glycine 0 C--O 1.205 -1.671 0 CA-C-N 115.406 -0.816 . . . . 45.69 112.654 177.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 148' ' ' ALA . . . . . . . . . . . . . . . -64.97 166.61 8.99 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 108.365 -0.976 . . . . 45.71 108.365 163.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 149' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -91.8 -32.12 15.48 Favored 'General case' 0 C--O 1.233 0.186 0 C-N-CA 122.881 0.472 . . . . 70.15 109.728 -165.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 150' ' ' GLU . . . . . . . . . . . . . 10.3 mt-10 -134.46 153.08 52.11 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.727 1.211 . . . . 54.49 109.689 -178.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 151' ' ' TYR . . . . . . . . . . . . . 13.5 m-30 -65.39 158.43 26.66 Favored 'General case' 0 C--O 1.239 0.527 0 N-CA-C 108.316 -0.994 . . . . 36.76 108.316 167.651 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 152' ' ' ALA . . . . . . . . . . . . . . . -65.03 160.06 21.74 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 116.446 -0.343 . . . . 29.34 110.31 178.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 153' ' ' SER . . . . . . . . . . . . . 48.2 t -92.66 -66.18 0.94 Allowed 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 122.706 0.402 . . . . 36.4 110.604 171.542 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 154' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -71.83 146.39 48.01 Favored 'General case' 0 N--CA 1.483 1.196 0 N-CA-C 109.256 -0.646 . . . . 39.49 109.256 174.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 155' ' ' LEU . . . . . . . . . . . . . 47.6 tp -64.53 143.01 58.22 Favored 'General case' 0 N--CA 1.435 -1.22 0 O-C-N 124.491 1.119 . . . . 32.8 108.787 176.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 156' ' ' GLN . . . . . . . . . . . . . 52.9 mm-40 -115.1 153.42 30.77 Favored 'General case' 0 C--O 1.217 -0.622 0 N-CA-C 107.232 -1.395 . . . . 40.14 107.232 -179.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 157' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -134.07 152.69 51.95 Favored 'General case' 0 N--CA 1.451 -0.415 0 O-C-N 124.583 1.177 . . . . 37.03 108.048 176.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 158' ' ' ALA . . . . . . . . . . . . . . . -149.85 147.9 28.51 Favored 'General case' 0 C--O 1.212 -0.87 0 CA-C-N 115.916 -0.584 . . . . 38.98 109.647 171.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 159' ' ' GLN . . . . . . . . . . . . . 2.2 mt-30 -88.83 137.67 32.1 Favored 'General case' 0 N--CA 1.443 -0.786 0 N-CA-C 106.673 -1.603 . . . . 92.14 106.673 170.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 160' ' ' VAL . . . . . 0.443 ' CG2' ' HA2' ' B' ' 184' ' ' GLY . 5.4 p -149.29 129.5 6.71 Favored Pre-proline 0 N--CA 1.403 -2.795 0 N-CA-C 107.317 -1.364 . . . . 45.97 107.317 -173.313 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 161' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -86.8 144.92 7.61 Favored 'Trans proline' 0 CA--C 1.536 0.582 0 C-N-CA 121.396 1.397 . . . . 48.36 112.965 -176.834 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 162' ' ' PHE . . . . . . . . . . . . . 25.6 t80 -57.26 161.02 3.5 Favored 'General case' 0 C--O 1.206 -1.211 0 N-CA-C 107.968 -1.123 . . . . 96.0 107.968 171.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 163' ' ' LEU . . . . . . . . . . . . . 18.6 mt -139.72 144.79 37.67 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-O 120.904 0.383 . . . . 75.04 110.038 174.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 164' ' ' SER . . . . . . . . . . . . . 46.2 t -64.45 156.15 30.41 Favored 'General case' 0 N--CA 1.436 -1.151 0 N-CA-C 108.194 -1.039 . . . . 88.81 108.194 179.247 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 165' ' ' LEU . . . . . . . . . . . . . 1.1 tp -67.18 -48.04 69.15 Favored 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 124.416 1.073 . . . . 76.18 109.488 173.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 166' ' ' GLU . . . . . . . . . . . . . 2.8 mt-10 -45.29 -55.44 5.91 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 108.998 -0.742 . . . . 95.61 108.998 175.105 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 167' ' ' ARG . . . . . . . . . . . . . 12.2 mtp180 -67.91 -38.94 83.57 Favored 'General case' 0 N--CA 1.473 0.679 0 O-C-N 124.051 0.844 . . . . 95.43 110.293 -173.61 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 168' ' ' CYS . . . . . . . . . . . . . 37.0 t -74.75 -37.37 62.5 Favored 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 112.064 0.394 . . . . 73.83 112.064 -177.087 -171.827 175.619 -80.708 104.573 2.008 102.396 -173.705 -45.211 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 169' ' ' SER . . . . . . . . . . . . . 89.6 p -81.01 4.51 19.39 Favored 'General case' 0 N--CA 1.469 0.487 0 CA-C-O 119.354 -0.355 . . . . 60.24 111.558 -178.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 169' A ALA . . . . . . . . . . . . . . . -54.65 137.97 62.18 Favored Pre-proline 0 N--CA 1.449 -0.476 0 N-CA-C 109.554 -0.536 . . . . 63.43 109.554 177.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 169' B PRO . . . . . . . . . . . . . 54.9 Cg_exo -47.2 -30.77 11.16 Favored 'Trans proline' 0 C--N 1.357 1.018 0 N-CA-C 117.281 1.993 . . . . 68.8 117.281 -175.189 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 170' ' ' ASP . . . . . . . . . . . . . 15.1 p30 -105.75 4.79 30.34 Favored 'General case' 0 N--CA 1.47 0.565 0 CA-C-O 120.66 0.267 . . . . 76.99 110.64 -174.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 171' ' ' VAL . . . . . . . . . . . . . 73.9 t -96.03 -77.33 0.35 Allowed 'Isoleucine or valine' 0 C--O 1.218 -0.6 0 CA-C-O 118.169 -0.92 . . . . 65.26 111.371 169.441 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 172' ' ' HIS . . . . . . . . . . . . . 45.6 m-70 -138.12 -7.12 1.59 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.882 0.873 . . . . 55.44 109.894 -177.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 173' ' ' GLY . . . . . . . . . . . . . . . 58.18 -133.14 52.79 Favored Glycine 0 C--N 1.335 0.488 0 CA-C-O 121.746 0.637 . . . . 59.2 112.154 175.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 174' ' ' SER . . . . . . . . . . . . . 6.1 p -98.32 12.46 34.74 Favored 'General case' 0 N--CA 1.447 -0.613 0 O-C-N 122.306 -0.526 . . . . 61.82 110.938 -174.201 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 175' ' ' SER . . . . . . . . . . . . . 5.1 m -60.46 -32.12 71.09 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.425 0.69 . . . . 58.76 110.884 165.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 176' ' ' ILE . . . . . . . . . . . . . 36.0 mm -78.07 105.81 7.69 Favored 'Isoleucine or valine' 0 C--O 1.206 -1.219 0 N-CA-C 109.454 -0.573 . . . . 51.01 109.454 -177.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 177' ' ' LEU . . . . . . . . . . . . . 35.2 mt -106.71 158.36 32.97 Favored Pre-proline 0 C--O 1.234 0.273 0 O-C-N 124.041 0.838 . . . . 49.53 110.326 -179.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 178' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -46.24 138.85 12.82 Favored 'Trans proline' 0 CA--C 1.541 0.859 0 C-N-CA 120.902 1.068 . . . . 44.97 110.968 174.288 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 179' ' ' GLY . . . . . . . . . . . . . . . 94.05 -2.28 68.76 Favored Glycine 0 N--CA 1.467 0.733 0 C-N-CA 124.419 1.009 . . . . 40.26 111.554 -177.478 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 180' ' ' MET . . . . . . . . . . . . . 54.7 mtt -108.52 170.16 8.2 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.181 0.992 . . . . 50.42 109.971 174.807 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 181' ' ' LEU . . . . . 0.493 HD23 ' C ' ' B' ' 181' ' ' LEU . 4.6 tt -170.21 136.38 1.4 Allowed 'General case' 0 C--O 1.246 0.905 0 C-N-CA 125.454 1.502 . . . . 47.31 107.437 -164.396 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 182' ' ' CYS . . . . . . . . . . . . . 11.0 m -113.37 151.65 30.99 Favored 'General case' 0 C--O 1.221 -0.445 0 N-CA-C 109.862 -0.421 . . . . 58.94 109.862 -177.452 -45.211 -173.705 -80.708 102.396 2.008 104.573 175.619 -171.827 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 183' ' ' ALA . . . . . . . . . . . . . . . -165.86 124.53 1.59 Allowed 'General case' 0 N--CA 1.438 -1.036 0 N-CA-C 107.337 -1.357 . . . . 45.93 107.337 -174.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 184' ' ' GLY . . . . . 0.443 ' HA2' ' CG2' ' B' ' 160' ' ' VAL . . . 151.96 171.48 19.74 Favored Glycine 0 C--N 1.336 0.545 0 O-C-N 124.443 1.09 . . . . 55.77 111.596 -165.124 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 184' A PHE . . . . . . . . . . . . . 54.9 m-85 -102.07 130.26 48.6 Favored 'General case' 0 N--CA 1.432 -1.344 0 N-CA-C 108.442 -0.947 . . . . 58.89 108.442 174.756 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 185' ' ' LEU . . . . . . . . . . . . . 75.9 mt -61.66 -30.28 70.62 Favored 'General case' 0 C--O 1.215 -0.715 0 O-C-N 124.64 1.213 . . . . 67.4 109.594 178.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 186' ' ' GLU . . . . . . . . . . . . . 18.7 pm0 -72.1 -15.06 62.0 Favored 'General case' 0 C--O 1.217 -0.632 0 CA-C-O 118.85 -0.595 . . . . 66.22 110.734 176.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 187' ' ' GLY . . . . . . . . . . . . . . . 87.08 -167.16 37.59 Favored Glycine 0 N--CA 1.479 1.554 0 C-N-CA 124.318 0.961 . . . . 47.68 111.162 178.047 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 188' ' ' GLY . . . . . . . . . . . . . . . 100.97 -32.92 6.89 Favored Glycine 0 C--O 1.243 0.682 0 C-N-CA 123.13 0.395 . . . . 38.84 113.089 166.794 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 188' A THR . . . . . . . . . . . . . 2.8 m -130.06 136.28 49.19 Favored 'General case' 0 C--O 1.256 1.423 0 N-CA-C 109.797 -0.446 . . . . 45.65 109.797 172.28 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 189' ' ' ASP . . . . . . . . . . . . . 18.3 t0 -178.47 167.64 1.83 Allowed 'General case' 0 C--O 1.243 0.744 0 O-C-N 125.363 1.664 . . . . 38.98 111.353 -171.064 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 190' ' ' ALA . . . . . . . . . . . . . . . -78.38 161.9 26.84 Favored 'General case' 0 C--O 1.221 -0.437 0 CA-C-N 114.469 -1.241 . . . . 39.24 109.372 166.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 191' ' ' CYS . . . . . . . . . . . . . 1.8 t -140.84 176.56 8.7 Favored 'General case' 0 C--O 1.244 0.765 0 CA-C-O 121.7 0.762 . . . . 42.11 109.872 177.983 -149.932 42.38 80.05 108.081 2.035 101.037 -179.418 -53.043 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 192' ' ' GLN . . . . . . . . . . . . . 16.3 mp0 -52.05 128.09 23.45 Favored 'General case' 0 N--CA 1.45 -0.439 0 N-CA-C 108.672 -0.862 . . . . 37.2 108.672 173.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 193' ' ' GLY . . . . . . . . . . . . . . . 104.19 -7.34 47.64 Favored Glycine 0 N--CA 1.446 -0.656 0 CA-C-N 115.107 -0.952 . . . . 32.3 112.023 -178.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 194' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -95.3 -6.19 41.85 Favored 'General case' 0 CA--C 1.535 0.395 0 C-N-CA 120.242 -0.583 . . . . 32.75 109.95 -178.162 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 195' ' ' SER . . . . . . . . . . . . . 1.2 m -75.17 150.06 38.81 Favored 'General case' 0 N--CA 1.439 -0.978 0 CA-C-O 122.687 1.232 . . . . 35.73 112.5 -168.468 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 196' ' ' GLY . . . . . 0.554 ' HA3' ' O ' ' B' ' 43' ' ' ALA . . . 89.77 -18.9 44.38 Favored Glycine 0 N--CA 1.41 -3.085 0 CA-C-N 110.756 -2.929 . . . . 38.15 111.289 -166.953 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 197' ' ' GLY . . . . . . . . . . . . . . . -82.75 173.42 52.54 Favored Glycine 0 N--CA 1.438 -1.22 0 C-N-CA 121.363 -0.446 . . . . 31.78 112.398 -164.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 198' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_endo -80.64 136.87 11.11 Favored 'Trans proline' 0 C--N 1.352 0.748 0 C-N-CA 122.837 2.358 . . . . 32.84 116.337 -171.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 199' ' ' LEU . . . . . . . . . . . . . 28.4 tp -108.35 114.64 28.66 Favored 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 125.949 1.7 . . . . 36.72 108.396 150.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 200' ' ' VAL . . . . . 0.48 ' CG1' HD11 ' B' ' 207' ' ' LEU . 2.1 t -119.63 136.58 56.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 CA-C-N 113.908 -1.496 . . . . 46.06 111.216 -172.134 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' CYS . . . . . . . . . . . . . 32.0 m -130.13 166.6 19.88 Favored 'General case' 0 N--CA 1.486 1.35 0 O-C-N 124.432 1.082 . . . . 62.93 109.233 179.723 -50.227 -96.999 113.351 104.712 2.078 107.462 -89.349 -63.808 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 202' ' ' GLU . . . . . 0.688 ' HA ' ' O ' ' B' ' 206' ' ' ARG . 16.7 pt-20 -130.06 156.12 45.02 Favored 'General case' 0 N--CA 1.491 1.612 0 C-N-CA 119.742 -0.783 . . . . 94.28 112.54 -173.317 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 203' ' ' ASP . . . . . 0.931 ' HB2' ' HB3' ' B' ' 206' ' ' ARG . 1.3 t0 . . . . . 0 N--CA 1.49 1.553 0 O-C-N 125.604 1.815 . . . . 94.98 110.165 -177.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 206' ' ' ARG . . . . . 0.931 ' HB3' ' HB2' ' B' ' 203' ' ' ASP . 17.6 tpp180 . . . . . 0 CA--C 1.533 0.304 0 N-CA-C 109.134 -0.691 . . . . 89.44 109.134 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 207' ' ' LEU . . . . . 0.48 HD11 ' CG1' ' B' ' 200' ' ' VAL . 7.3 tp -112.72 122.62 48.2 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.887 0.875 . . . . 69.36 110.411 -179.164 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 208' ' ' THR . . . . . . . . . . . . . 31.1 p -133.77 144.1 48.83 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-O 121.176 0.512 . . . . 61.54 112.248 -179.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 209' ' ' LEU . . . . . 0.435 ' HG ' HG21 ' B' ' 231' ' ' VAL . 56.3 tp -80.72 99.22 8.1 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.969 0.908 . . . . 46.68 109.263 178.827 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 210' ' ' GLN . . . . . . . . . . . . . 29.6 mm100 -84.26 -34.07 23.9 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 108.613 -0.884 . . . . 53.93 108.613 -174.418 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 211' ' ' GLY . . . . . . . . . . . . . . . -142.4 152.96 24.15 Favored Glycine 0 N--CA 1.481 1.656 0 O-C-N 124.323 1.015 . . . . 36.09 114.552 -169.185 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 212' ' ' ILE . . . . . 0.414 ' HB ' ' HB ' ' B' ' 229' ' ' THR . 49.0 mt -111.23 126.4 68.61 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.179 0 C-N-CA 124.777 1.231 . . . . 38.72 108.338 168.645 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 213' ' ' ILE . . . . . . . . . . . . . 36.9 mt -60.97 123.89 14.47 Favored 'Isoleucine or valine' 0 C--O 1.24 0.575 0 N-CA-C 106.806 -1.553 . . . . 33.02 106.806 -179.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 214' ' ' SER . . . . . . . . . . . . . 42.6 t -125.69 -78.73 0.6 Allowed 'General case' 0 N--CA 1.442 -0.842 0 O-C-N 123.992 0.807 . . . . 33.59 110.389 -166.269 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 215' ' ' TRP . . . . . . . . . . . . . 60.3 p-90 -143.99 -179.27 6.39 Favored 'General case' 0 N--CA 1.437 -1.104 0 C-N-CA 118.753 -1.179 . . . . 44.9 111.805 -175.899 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 216' ' ' GLY . . . . . . . . . . . . . . . 175.22 164.88 30.56 Favored Glycine 0 C--O 1.213 -1.186 0 CA-C-N 115.024 -0.989 . . . . 47.06 112.569 174.024 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 217' ' ' SER . . . . . . . . . . . . . 14.6 t -96.23 118.04 32.0 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 105.091 -2.189 . . . . 51.28 105.091 174.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 219' ' ' GLY . . . . . . . . . . . . . . . 57.63 -163.3 7.94 Favored Glycine 0 N--CA 1.448 -0.514 0 N-CA-C 110.152 -1.179 . . . . 43.6 110.152 -173.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 220' ' ' CYS . . . . . . . . . . . . . 48.5 m -134.12 109.59 9.03 Favored 'General case' 0 CA--C 1.532 0.279 0 N-CA-C 110.007 -0.368 . . . . 41.67 110.007 173.104 -53.043 -179.418 80.05 101.037 2.035 108.081 42.38 -149.932 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 221' ' ' GLY . . . . . . . . . . . . . . . 64.5 41.45 97.94 Favored Glycine 0 N--CA 1.444 -0.796 0 CA-C-N 115.282 -0.872 . . . . 50.73 112.073 -177.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 221' A ASP . . . . . . . . . . . . . 87.2 m-20 -83.5 151.57 25.35 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 109.107 -0.701 . . . . 57.21 109.107 169.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 222' ' ' ARG . . . . . 0.474 ' NH2' ' O ' ' B' ' 405' ' ' HOH . 10.5 ttp85 -52.38 126.51 19.42 Favored 'General case' 0 N--CA 1.469 0.49 0 C-N-CA 124.776 1.23 . . . . 85.18 109.427 174.875 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 223' ' ' ASN . . . . . . . . . . . . . 99.2 m-20 67.39 27.17 8.2 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 125.843 1.657 . . . . 67.21 110.598 174.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 224' ' ' LYS . . . . . . . . . . . . . 24.1 mmtt -137.92 70.46 49.95 Favored Pre-proline 0 C--N 1.34 0.16 0 C-N-CA 123.959 0.904 . . . . 58.19 109.138 -178.016 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 225' ' ' PRO . . . . . . . . . . . . . 94.5 Cg_endo -71.15 154.4 62.1 Favored 'Trans proline' 0 CA--C 1.54 0.78 0 C-N-CA 120.877 1.052 . . . . 46.91 110.82 175.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 226' ' ' GLY . . . . . . . . . . . . . . . -61.37 142.34 48.31 Favored Glycine 0 N--CA 1.442 -0.964 0 N-CA-C 110.613 -0.995 . . . . 46.58 110.613 176.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 227' ' ' VAL . . . . . . . . . . . . . 21.0 t -103.64 148.03 9.12 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.85 0 N-CA-C 107.472 -1.307 . . . . 40.43 107.472 173.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 228' ' ' TYR . . . . . . . . . . . . . 42.0 m-85 -136.91 146.04 45.02 Favored 'General case' 0 N--CA 1.442 -0.847 0 C-N-CA 126.056 1.742 . . . . 38.18 110.025 -169.591 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 229' ' ' THR . . . . . 0.414 ' HB ' ' HB ' ' B' ' 212' ' ' ILE . 35.8 m -70.77 124.84 25.25 Favored 'General case' 0 N--CA 1.446 -0.639 0 N-CA-C 108.308 -0.997 . . . . 34.77 108.308 166.836 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 230' ' ' ASP . . . . . . . . . . . . . 52.8 t0 -74.12 95.46 2.57 Favored 'General case' 0 C--O 1.204 -1.296 0 C-N-CA 125.841 1.656 . . . . 40.44 109.337 179.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 231' ' ' VAL . . . . . 0.435 HG21 ' HG ' ' B' ' 209' ' ' LEU . 77.3 t -57.05 -44.45 82.95 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.687 0 N-CA-C 109.935 -0.395 . . . . 39.72 109.935 -169.863 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 232' ' ' ALA . . . . . . . . . . . . . . . -56.17 -35.51 67.31 Favored 'General case' 0 N--CA 1.468 0.431 0 C-N-CA 123.839 0.856 . . . . 40.46 110.536 -173.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 233' ' ' TYR . . . . . . . . . . . . . 40.3 t80 -59.52 -18.98 44.86 Favored 'General case' 0 C--O 1.208 -1.093 0 C-N-CA 124.639 1.175 . . . . 42.09 112.028 178.718 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 234' ' ' TYR . . . . . . . . . . . . . 85.4 m-85 -122.02 13.69 10.58 Favored 'General case' 0 N--CA 1.444 -0.744 0 CA-C-N 118.829 0.74 . . . . 35.83 110.216 -164.506 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 235' ' ' LEU . . . . . . . . . . . . . 60.9 mt -55.1 -43.68 74.25 Favored 'General case' 0 N--CA 1.474 0.761 0 O-C-N 123.234 0.334 . . . . 43.09 111.284 -177.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 236' ' ' ALA . . . . . . . . . . . . . . . -65.36 -48.02 74.41 Favored 'General case' 0 C--O 1.246 0.888 0 N-CA-C 109.746 -0.465 . . . . 37.27 109.746 178.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 237' ' ' TRP . . . . . . . . . . . . . 86.3 t90 -53.41 -45.26 69.29 Favored 'General case' 0 N--CA 1.437 -1.099 0 N-CA-C 108.842 -0.799 . . . . 39.98 108.842 178.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 238' ' ' ILE . . . . . . . . . . . . . 96.3 mt -63.58 -46.91 93.64 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 CA-C-O 119.039 -0.505 . . . . 42.82 110.663 -177.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 239' ' ' ARG . . . . . . . . . . . . . 51.6 mtt180 -56.07 -50.92 69.63 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.223 0.609 . . . . 83.79 110.354 178.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 240' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -76.74 -9.05 58.4 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 122.209 -0.307 . . . . 84.73 110.751 -169.5 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 241' ' ' HIS . . . . . . . . . . . . . 48.2 m80 -108.59 31.37 5.67 Favored 'General case' 0 C--O 1.21 -0.999 0 C-N-CA 122.678 0.391 . . . . 48.67 111.623 177.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 242' ' ' THR . . . . . . . . . . . . . 30.0 p -101.62 38.2 1.66 Allowed 'General case' 0 C--O 1.239 0.547 0 CA-C-O 121.009 0.433 . . . . 51.47 110.043 176.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 243' ' ' VAL . . . . . . . . . . . . . 1.7 m -86.98 151.07 3.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.193 0 N-CA-C 106.181 -1.785 . . . . 54.99 106.181 172.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 244' ' ' SER . . . . . . . . . . . . . 22.7 t -157.28 155.98 31.67 Favored 'General case' 0 N--CA 1.429 -1.476 0 CA-C-O 122.569 1.176 . . . . 56.63 111.25 -175.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 245' ' ' THR . . . . . . . . . . . . . 67.8 p -69.57 168.57 14.44 Favored 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 111.538 -2.574 . . . . 38.8 106.286 171.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 246' ' ' ARG . . . . . . . . . . . . . 96.0 mtt180 . . . . . 0 N--CA 1.502 2.136 0 CA-C-O 117.062 -1.447 . . . . 38.68 112.423 -168.78 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 301' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 302' ' ' NAG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 303' ' ' MAN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 304' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 305' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 306' ' ' CYS . . . . . 0.454 ' SG ' ' N ' ' B' ' 122' ' ' CYS . 47.3 m . . . . . 0 N--CA 1.487 1.404 0 CA-C-O 117.324 -1.322 . . . . 105.23 109.435 . -76.716 -133.206 -94.455 118.89 1.985 91.207 -22.755 -59.257 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 401' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 403' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 404' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 405' ' ' HOH . . . . . 0.474 ' O ' ' NH2' ' B' ' 222' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 406' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 407' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 409' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 410' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 412' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 413' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 414' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 415' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 416' ' ' HOH . . . . . 0.491 ' O ' ' HA ' ' B' ' 133' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 417' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 418' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 419' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 421' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 422' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 423' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 426' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 428' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 429' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 431' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 432' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 435' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 436' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 437' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 438' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 439' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 440' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 441' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 442' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 443' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 444' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 445' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 446' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 447' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 448' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 449' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 450' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 451' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 452' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 453' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 454' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 455' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 456' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 457' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 458' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 459' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_