data_6vv9_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 6vv9 _Structure_validation_residue.Date_analyzed 2020-07-10 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.3 tmm? . . . . . 0 C--O 1.243 0.736 0 N-CA-C 110.339 -0.245 . . . . 47.59 110.339 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 94.7 t -113.63 117.5 55.62 Favored 'Isoleucine or valine' 0 C--O 1.24 0.582 0 N-CA-C 108.443 -0.947 . . . . 40.34 108.443 174.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -120.72 163.89 14.2 Favored Glycine 0 N--CA 1.442 -0.937 0 C-N-CA 118.468 -1.825 . . . . 31.39 109.413 179.247 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 9.6 mp -119.81 137.99 53.64 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 123.646 0.779 . . . . 30.18 109.07 176.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ILE . . . . . 0.402 ' O ' ' OH ' ' A' ' 100' ' ' TYR . 16.2 tt -134.18 129.48 53.72 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 N-CA-C 108.701 -0.851 . . . . 31.2 108.701 179.743 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' TRP . . . . . . . . . . . . . 6.9 p90 -159.49 162.41 35.56 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 108.566 -0.902 . . . . 31.01 108.566 178.093 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -113.52 150.98 32.15 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 106.447 -1.686 . . . . 28.42 106.447 170.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -148.7 153.58 38.44 Favored 'General case' 0 N--CA 1.44 -0.957 0 C-N-CA 118.276 -1.37 . . . . 28.62 107.758 -178.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.99 168.0 12.71 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 118.382 -1.327 . . . . 29.41 109.56 162.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 48.5 m -52.03 -39.98 60.35 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-N 114.73 -1.123 . . . . 36.06 111.42 173.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 77.2 p -71.98 -9.73 58.77 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 124.005 0.922 . . . . 31.54 113.477 -176.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.38 -7.79 56.52 Favored Glycine 0 C--O 1.246 0.875 0 CA-C-N 119.368 0.986 . . . . 29.48 115.193 -178.361 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 63.6 t -65.84 134.56 29.62 Favored 'Isoleucine or valine' 0 C--O 1.24 0.57 0 CA-C-N 117.933 0.866 . . . . 28.98 109.736 178.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.6 pt -119.33 -25.94 2.6 Favored 'Isoleucine or valine' 0 C--O 1.247 0.936 0 N-CA-C 113.326 0.862 . . . . 26.7 113.326 174.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -149.8 161.34 28.82 Favored Glycine 0 C--N 1.333 0.378 0 N-CA-C 109.29 -1.524 . . . . 30.4 109.29 177.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 43.8 ttm180 -162.2 124.99 2.92 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 123.562 0.745 . . . . 41.1 109.495 -177.993 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 69.28 27.72 73.39 Favored Glycine 0 CA--C 1.505 -0.582 0 C-N-CA 119.361 -1.4 . . . . 36.44 113.055 -178.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 74.97 7.0 80.88 Favored Glycine 0 C--N 1.332 0.33 0 N-CA-C 115.544 0.978 . . . . 33.22 115.544 -178.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -139.42 -156.83 0.71 Allowed 'General case' 0 C--O 1.24 0.577 0 N-CA-C 107.476 -1.305 . . . . 34.25 107.476 -179.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 13.7 mt -131.94 127.58 21.21 Favored Pre-proline 0 C--O 1.234 0.253 0 N-CA-C 107.978 -1.119 . . . . 31.07 107.978 -174.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -83.65 36.68 0.61 Allowed 'Trans proline' 0 C--N 1.322 -0.864 0 CA-C-N 120.27 1.132 . . . . 27.97 113.883 -177.048 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 18.5 p90 -158.69 172.76 17.68 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.232 -1.025 . . . . 30.55 108.232 169.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 24.1 ttm180 -155.28 118.0 4.29 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 107.741 -1.207 . . . . 37.17 107.741 171.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.2 mp -117.78 108.6 42.58 Favored Pre-proline 0 C--O 1.244 0.783 0 N-CA-C 107.564 -1.273 . . . . 36.08 107.564 178.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -60.17 -32.76 94.95 Favored 'Trans proline' 0 C--O 1.237 0.469 0 CA-C-N 119.898 0.999 . . . . 38.15 111.522 -178.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 32.2 mp0 -61.81 -26.42 68.1 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 112.034 0.383 . . . . 37.85 112.034 179.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -85.5 -31.61 22.67 Favored 'General case' 0 C--O 1.242 0.683 0 C-N-CA 121.08 -0.248 . . . . 37.0 111.323 176.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -58.72 -51.82 68.31 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-O 121.264 0.554 . . . . 52.39 110.302 171.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -53.13 -51.95 60.27 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 116.064 -0.516 . . . . 33.73 111.662 174.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 40.9 t-80 -58.76 -42.27 88.5 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 119.556 -0.858 . . . . 36.94 111.029 175.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -57.99 -50.3 73.88 Favored 'General case' 0 C--O 1.239 0.546 0 O-C-N 121.826 -0.546 . . . . 41.59 110.911 177.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 12.9 ttt180 -58.58 -45.39 89.17 Favored 'General case' 0 C--N 1.346 0.436 0 N-CA-C 111.888 0.329 . . . . 55.37 111.888 179.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -56.8 -49.13 76.27 Favored 'General case' 0 C--O 1.233 0.235 0 O-C-N 121.988 -0.445 . . . . 61.61 111.467 178.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 30.8 mm -74.21 -31.27 28.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 O-C-N 121.706 -0.621 . . . . 38.18 111.06 -169.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 33.6 p -93.61 -21.72 19.23 Favored 'General case' 0 C--O 1.243 0.725 0 C-N-CA 119.273 -0.971 . . . . 32.63 113.175 -175.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 41.9 tpp -55.02 130.01 40.12 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-O 120.939 0.4 . . . . 34.94 111.704 -167.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 93.53 -23.02 32.2 Favored Glycine 0 N--CA 1.441 -0.991 0 N-CA-C 115.332 0.893 . . . . 31.3 115.332 179.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 39.2 m-70 -99.97 -171.54 2.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 118.276 1.038 . . . . 36.67 111.0 -169.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 46.6 m -84.99 138.32 32.54 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 121.57 -0.706 . . . . 33.4 109.82 173.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 11.2 pt -117.75 126.44 74.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 N-CA-C 107.782 -1.192 . . . . 33.28 107.782 171.275 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 40.3 t -112.9 123.68 68.8 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 N-CA-C 107.838 -1.171 . . . . 30.55 107.838 -177.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 6.4 ptp -133.29 156.56 47.37 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 122.007 0.908 . . . . 29.69 110.749 178.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -80.74 160.13 42.88 Favored Glycine 0 C--N 1.342 0.866 0 CA-C-N 114.503 -1.226 . . . . 31.89 111.885 169.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -59.14 -32.91 70.29 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-N 114.881 -0.66 . . . . 45.58 111.871 -175.048 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ARG . . . . . 1.067 ' NH2' ' NE2' ' A' ' 98' ' ' GLN . 1.8 mpt_? -63.4 -43.71 96.76 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 119.819 -0.752 . . . . 60.92 111.286 176.89 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 65.8 m -64.98 -41.8 95.11 Favored 'General case' 0 C--O 1.241 0.634 0 C-N-CA 120.114 -0.634 . . . . 33.06 111.685 179.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 12.3 t-105 -59.27 -39.49 83.06 Favored 'General case' 0 C--O 1.241 0.65 0 O-C-N 121.737 -0.602 . . . . 37.88 111.519 176.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -68.46 -31.33 70.55 Favored 'General case' 0 CA--C 1.51 -0.559 0 C-N-CA 120.759 -0.376 . . . . 42.27 111.916 177.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 2.2 p -66.93 -4.75 10.28 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 112.992 0.738 . . . . 41.01 112.992 174.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 12.9 mt -98.18 125.05 45.0 Favored Pre-proline 0 C--O 1.238 0.458 0 CA-C-N 118.622 0.647 . . . . 48.02 111.064 -173.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -58.64 151.74 60.88 Favored 'Trans proline' 0 C--N 1.329 -0.469 0 C-N-CA 120.472 0.781 . . . . 46.06 111.826 178.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ALA . . . . . 0.719 ' O ' ' O ' ' A' ' 303' ' ' HOH . . . -70.23 -28.18 65.06 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 115.469 -0.787 . . . . 48.78 111.616 -172.613 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 20.1 mtmm -63.21 -36.78 84.79 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 120.618 -0.433 . . . . 62.87 110.923 173.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 92.0 t -81.06 -23.31 10.71 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 N-CA-C 113.224 0.824 . . . . 49.88 113.224 -175.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ARG . . . . . . . . . . . . . 8.6 mtp180 -85.34 130.32 52.08 Favored Pre-proline 0 C--N 1.329 -0.324 0 C-N-CA 127.199 2.2 . . . . 46.51 110.972 -169.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -80.39 159.35 85.99 Favored 'Cis proline' 0 C--O 1.244 0.818 0 CA-C-N 120.234 1.119 . . . . 39.43 112.212 -9.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 82.7 mt -60.45 118.89 38.26 Favored Pre-proline 0 C--O 1.245 0.859 0 N-CA-C 108.683 -0.858 . . . . 46.83 108.683 -179.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.36 146.33 56.19 Favored 'Trans proline' 0 C--N 1.331 -0.394 0 CA-C-N 118.886 0.638 . . . . 38.23 111.351 -164.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 83.51 5.7 88.22 Favored Glycine 0 C--N 1.338 0.69 0 CA-C-N 115.464 -0.789 . . . . 34.73 115.004 175.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 32.5 mtm180 -131.13 163.78 26.93 Favored 'General case' 0 C--O 1.24 0.583 0 C-N-CA 124.878 1.271 . . . . 38.69 108.201 -174.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 43.1 ttt180 -97.48 105.87 18.09 Favored 'General case' 0 C--O 1.242 0.698 0 N-CA-C 106.431 -1.692 . . . . 40.52 106.431 176.413 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -84.23 125.33 32.11 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 114.858 -1.064 . . . . 34.19 110.387 -178.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 52.1 t -131.44 129.26 61.99 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 N-CA-C 108.251 -1.018 . . . . 30.48 108.251 -177.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' VAL . . . . . 0.444 ' N ' ' O ' ' A' ' 77' ' ' GLU . 76.9 t -111.83 131.87 62.01 Favored 'Isoleucine or valine' 0 C--O 1.244 0.771 0 N-CA-C 109.184 -0.672 . . . . 32.39 109.184 -178.084 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.9 mt -92.94 126.62 38.11 Favored 'General case' 0 C--O 1.238 0.5 0 N-CA-C 109.166 -0.679 . . . . 40.19 109.166 171.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 6.1 t -155.99 146.06 21.43 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 108.051 -1.092 . . . . 39.32 108.051 -178.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ARG . . . . . 0.715 ' NE ' ' O2 ' ' A' ' 204' ' ' PO4 . 54.4 mtt85 -89.92 -11.44 41.77 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 112.872 0.693 . . . . 54.59 112.872 177.15 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLN . . . . . 0.708 ' OE1' ' O ' ' A' ' 302' ' ' HOH . 2.5 mt-30 -79.33 116.55 19.64 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 108.781 -0.822 . . . . 50.28 108.781 173.106 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.68 -14.57 63.1 Favored 'General case' 0 C--N 1.343 0.298 0 N-CA-C 112.852 0.686 . . . . 40.07 112.852 -177.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 17.9 p-10 -114.35 11.55 17.33 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 118.519 0.6 . . . . 39.85 112.212 -179.532 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -63.56 125.96 25.96 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 118.816 -1.154 . . . . 41.33 109.977 177.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 14.9 mmm -95.9 130.02 42.99 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 110.021 -0.362 . . . . 52.74 110.021 179.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -126.26 98.47 5.47 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 106.481 -1.674 . . . . 37.81 106.481 170.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -60.79 118.96 7.29 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-O 120.741 0.305 . . . . 51.07 110.932 -177.073 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 97.19 5.39 58.19 Favored Glycine 0 N--CA 1.443 -0.857 0 N-CA-C 116.295 1.278 . . . . 38.86 116.295 179.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -143.27 171.76 13.67 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 118.601 1.201 . . . . 34.64 109.583 -174.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' GLU . . . . . 0.444 ' O ' ' N ' ' A' ' 64' ' ' VAL . 30.0 mt-10 -96.81 140.15 31.81 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 115.512 -0.767 . . . . 36.9 109.844 169.093 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 4.3 t -109.96 118.5 57.07 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 N-CA-C 106.741 -1.577 . . . . 37.01 106.741 171.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 28.0 m -118.36 153.46 20.48 Favored 'Isoleucine or valine' 0 C--O 1.242 0.67 0 N-CA-C 108.391 -0.966 . . . . 38.94 108.391 179.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -89.43 -7.67 69.16 Favored Glycine 0 C--N 1.338 0.658 0 N-CA-C 115.364 0.906 . . . . 41.96 115.364 -178.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 6.3 p -150.51 157.04 42.56 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.762 0.825 . . . . 46.51 109.37 179.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 25.7 tp -79.33 -31.76 43.19 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.287 -0.869 . . . . 46.39 112.698 -171.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLU . . . . . 0.621 ' OE2' ' OH ' ' A' ' 106' ' ' TYR . 34.1 mp0 -56.42 -28.29 59.01 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 112.116 0.413 . . . . 53.05 112.116 174.817 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -61.33 -31.08 70.93 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 119.351 -0.94 . . . . 54.49 111.586 177.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ALA . . . . . 0.606 ' O ' ' O ' ' A' ' 305' ' ' HOH . . . -88.51 0.47 56.28 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 113.577 0.954 . . . . 48.08 113.577 -169.668 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 28.3 mt -101.7 25.93 7.97 Favored 'General case' 0 CA--C 1.514 -0.434 0 N-CA-C 112.44 0.533 . . . . 54.85 112.44 -171.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 10.7 p -87.44 -13.08 44.26 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 119.326 -0.95 . . . . 65.6 112.78 -177.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 36.4 m -87.22 164.39 36.01 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 118.314 0.506 . . . . 55.24 110.199 179.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -75.32 -37.46 1.86 Allowed 'Trans proline' 0 CA--C 1.511 -0.666 0 C-N-CA 118.421 -0.586 . . . . 50.28 113.077 -174.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 44.3 tt0 -122.94 114.8 20.92 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 108.766 -0.828 . . . . 41.81 108.766 178.124 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 33.9 m -122.08 132.38 54.46 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 123.383 0.673 . . . . 36.55 109.503 -177.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 79.0 m95 -120.11 124.11 44.99 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.093 -0.706 . . . . 34.44 109.093 -179.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 42.0 t -90.12 118.19 34.9 Favored 'Isoleucine or valine' 0 C--O 1.239 0.53 0 N-CA-C 108.907 -0.775 . . . . 32.93 108.907 179.45 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 7.1 pt -107.96 8.87 9.33 Favored 'Isoleucine or valine' 0 C--O 1.242 0.694 0 N-CA-C 112.474 0.546 . . . . 34.64 112.474 -166.28 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 119.85 178.88 16.45 Favored Glycine 0 N--CA 1.449 -0.478 0 CA-C-O 122.18 0.878 . . . . 30.83 112.931 175.226 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . -96.84 -145.16 18.66 Favored Glycine 0 CA--C 1.521 0.444 0 CA-C-N 114.935 -0.632 . . . . 27.91 114.602 -4.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' GLY . . . . . 0.412 ' N ' ' O2N' ' A' ' 201' ' ' NDP . . . -55.1 -37.23 63.0 Favored Glycine 0 C--N 1.337 0.615 0 C-N-CA 120.785 -0.721 . . . . 28.91 112.937 -169.719 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' GLN . . . . . 1.067 ' NE2' ' NH2' ' A' ' 45' ' ' ARG . 57.8 mt-30 -65.37 -52.76 51.43 Favored 'General case' 0 C--O 1.24 0.571 0 O-C-N 122.378 -0.484 . . . . 40.86 110.989 179.461 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 45.3 t -71.15 -32.57 48.15 Favored 'Isoleucine or valine' 0 C--O 1.241 0.623 0 C-N-CA 119.859 -0.736 . . . . 34.06 110.996 -173.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' TYR . . . . . 0.402 ' OH ' ' O ' ' A' ' 5' ' ' ILE . 8.7 m-30 -52.67 -41.55 63.92 Favored 'General case' 0 C--N 1.35 0.595 0 O-C-N 121.78 -0.575 . . . . 32.75 111.072 171.17 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.02 -38.42 69.59 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 119.23 -0.988 . . . . 33.06 110.598 -177.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 12.2 mt -60.15 -44.87 94.63 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 120.814 0.34 . . . . 50.19 111.632 177.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -79.94 -23.97 41.34 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 113.388 0.885 . . . . 36.35 113.388 -171.56 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 16.2 tp -49.61 -36.85 18.98 Favored Pre-proline 0 C--O 1.244 0.767 0 N-CA-C 114.131 1.16 . . . . 34.18 114.131 -174.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -59.76 -27.8 85.78 Favored 'Trans proline' 0 C--O 1.24 0.604 0 CA-C-N 121.717 1.649 . . . . 34.22 113.846 175.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' TYR . . . . . 0.621 ' OH ' ' OE2' ' A' ' 83' ' ' GLU . 94.2 m-85 -90.08 -2.61 58.13 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 113.534 0.939 . . . . 41.62 113.534 -176.565 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -100.4 145.44 28.21 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-N 118.558 0.617 . . . . 37.86 111.313 -164.209 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 27.9 p -126.98 4.57 6.52 Favored 'General case' 0 C--O 1.24 0.573 0 C-N-CA 124.448 1.099 . . . . 40.37 112.452 171.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 43.6 mtp180 -143.58 135.79 26.87 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 124.135 0.974 . . . . 44.98 109.349 179.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' CYS . . . . . . . . . . . . . 63.2 m -133.94 107.17 7.66 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 107.558 -1.275 . . . . 37.8 107.558 175.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 40.6 mm-40 -92.46 107.89 19.56 Favored 'General case' 0 CA--C 1.521 -0.164 0 N-CA-C 107.383 -1.34 . . . . 40.89 107.383 174.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 41.2 t -112.38 116.15 51.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 108.96 -0.755 . . . . 34.94 108.96 -170.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' THR . . . . . . . . . . . . . 21.3 m -92.64 126.47 37.74 Favored 'General case' 0 CA--C 1.515 -0.377 0 C-N-CA 119.2 -1.0 . . . . 28.75 108.861 168.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -105.81 116.37 31.82 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 108.835 -0.802 . . . . 45.31 108.835 -178.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 4.5 t -96.9 121.45 47.43 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 N-CA-C 108.896 -0.779 . . . . 31.0 108.896 -175.123 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 39.4 t0 -67.14 64.48 0.06 Allowed 'General case' 0 C--O 1.236 0.37 0 CA-C-N 116.035 -0.53 . . . . 40.81 111.806 179.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 20.8 tt -123.96 133.08 70.26 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 N-CA-C 108.128 -1.064 . . . . 39.34 108.128 177.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -82.67 94.87 1.76 Allowed Glycine 0 C--N 1.332 0.321 0 N-CA-C 110.609 -0.996 . . . . 38.77 110.609 177.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 5.2 tp -123.89 81.12 56.27 Favored Pre-proline 0 C--N 1.33 -0.247 0 N-CA-C 109.445 -0.576 . . . . 37.14 109.445 -167.08 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' PRO . . . . . 0.649 ' O ' ' O ' ' A' ' 304' ' ' HOH . 32.3 Cg_exo -59.06 149.11 81.94 Favored 'Trans proline' 0 C--N 1.329 -0.455 0 CA-C-O 121.814 0.673 . . . . 40.73 111.551 -178.335 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 20.3 mtt85 -81.94 118.23 22.79 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 119.649 -0.821 . . . . 50.44 110.711 -173.524 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -98.02 156.82 16.46 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 107.84 -1.17 . . . . 56.32 107.84 173.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -58.11 146.78 32.07 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.446 -0.797 . . . . 39.89 109.848 176.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 80.57 -8.91 52.98 Favored Glycine 0 C--O 1.241 0.57 0 CA-C-O 119.224 -0.764 . . . . 37.21 114.95 -178.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -62.36 139.91 58.54 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 118.178 0.989 . . . . 35.36 110.707 171.388 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -84.59 154.99 22.25 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 119.313 -0.955 . . . . 31.09 109.349 169.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 84.1 mt -134.7 149.84 50.54 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.443 0.64 . . . . 32.43 111.879 -166.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -68.94 144.48 95.78 Favored Pre-proline 0 C--O 1.236 0.372 0 CA-C-N 115.004 -0.998 . . . . 30.68 111.137 172.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -70.51 142.52 44.82 Favored 'Trans proline' 0 CA--C 1.516 -0.402 0 CA-C-O 121.147 0.394 . . . . 34.51 111.464 177.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 94.6 t -69.89 135.32 28.48 Favored 'Isoleucine or valine' 0 C--O 1.239 0.536 0 N-CA-C 108.455 -0.943 . . . . 48.11 108.455 177.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 51.5 mt -106.02 116.43 31.93 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 108.671 -0.863 . . . . 42.83 108.671 177.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 18.1 p30 -77.62 -158.96 0.13 Allowed 'General case' 0 C--O 1.236 0.355 0 C-N-CA 119.368 -0.933 . . . . 49.46 110.78 -179.171 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -82.82 -10.48 58.84 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 113.128 0.788 . . . . 71.14 113.128 -173.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 80.9 p -73.26 -5.69 41.11 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 118.011 -1.476 . . . . 46.94 112.995 176.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -100.89 124.36 46.45 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 119.202 0.91 . . . . 45.87 111.091 -178.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' ARG . . . . . 0.486 ' O ' ' N ' ' A' ' 157' ' ' HIS . 19.7 mmm180 -104.78 140.87 37.46 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 109.571 -0.529 . . . . 67.1 109.571 171.161 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -153.15 134.19 4.33 Favored Glycine 0 C--N 1.336 0.541 0 N-CA-C 119.439 2.536 . . . . 60.31 119.439 -171.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 3.9 mp0 -86.35 120.17 27.41 Favored 'General case' 0 C--O 1.235 0.334 0 O-C-N 122.439 -0.448 . . . . 61.15 110.393 -179.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 59.1 m -86.25 114.96 23.49 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 115.841 -0.618 . . . . 63.87 109.853 -179.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -76.38 176.49 51.99 Favored Glycine 0 C--N 1.341 0.849 0 CA-C-O 122.32 0.955 . . . . 60.74 113.274 -178.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -88.35 146.32 25.34 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 114.824 -0.688 . . . . 67.66 110.719 -179.479 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' TRP . . . . . . . . . . . . . 37.2 m95 -55.92 135.1 52.42 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.76 -0.655 . . . . 59.65 110.485 174.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' ARG . . . . . 0.435 ' NH2' ' O ' ' A' ' 309' ' ' HOH . 3.3 mtm-85 -127.25 159.47 34.24 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.014 -1.476 . . . . 72.68 107.014 177.751 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 54.5 m-85 -101.57 123.88 46.32 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.615 -0.883 . . . . 57.27 108.615 -179.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' SER . . . . . . . . . . . . . 5.6 t -86.62 143.2 27.75 Favored 'General case' 0 C--N 1.33 -0.245 0 O-C-N 123.587 0.554 . . . . 36.25 109.614 173.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 16.3 ptt-85 -65.43 -9.04 22.03 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 117.597 -1.641 . . . . 41.65 112.492 177.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 2.7 p -79.44 -2.46 42.06 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 113.186 0.81 . . . . 39.29 113.186 173.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . 102.37 -21.54 40.84 Favored Glycine 0 N--CA 1.436 -1.355 0 CA-C-O 119.339 -0.7 . . . . 31.69 114.204 178.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 77.2 mt -90.79 145.73 24.54 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 117.654 0.727 . . . . 31.45 111.189 -177.071 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 54.2 mtm180 -82.4 154.09 25.38 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 108.94 -0.763 . . . . 50.04 108.94 168.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 23.0 p90 -151.8 161.96 41.8 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.099 -1.075 . . . . 42.37 108.099 178.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' ARG . . . . . . . . . . . . . 19.3 ptt180 -153.36 144.34 22.88 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.029 -1.1 . . . . 54.69 108.029 175.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 24.0 tp -91.39 136.49 33.07 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 121.342 0.591 . . . . 39.94 110.39 178.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' TYR . . . . . . . . . . . . . 34.4 m-85 -106.06 134.85 48.54 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 107.078 -1.453 . . . . 50.19 107.078 165.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 45.5 m -117.29 103.56 10.28 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 107.097 -1.446 . . . . 51.23 107.097 174.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' TYR . . . . . . . . . . . . . 79.8 m-85 -94.34 142.89 26.89 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 108.671 -0.863 . . . . 44.13 108.671 -178.278 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' HIS . . . . . 0.486 ' N ' ' O ' ' A' ' 136' ' ' ARG . 61.9 m-70 -141.86 140.38 32.88 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 108.533 -0.914 . . . . 61.49 108.533 -174.746 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' ARG . . . . . . . . . . . . . 17.6 ptt180 -147.51 165.58 29.89 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 107.122 -1.436 . . . . 44.19 107.122 168.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 23.4 m . . . . . 0 C--N 1.322 -0.588 0 CA-C-N 115.145 -0.934 . . . . 46.84 110.63 -179.282 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' MET . . . . . 0.466 ' N ' ' O ' ' B' ' 89' ' ' PRO . 7.9 tmm? . . . . . 0 N--CA 1.469 0.493 0 CA-C-O 119.832 -0.128 . . . . 79.1 110.711 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' VAL . . . . . 0.804 ' O ' ' O ' ' B' ' 401' ' ' HOH . 89.9 t -112.04 121.95 65.43 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.218 0 N-CA-C 108.402 -0.962 . . . . 48.19 108.402 178.182 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -116.06 160.73 13.21 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.5 -0.857 . . . . 36.81 113.462 178.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 10.8 mp -127.27 132.51 50.33 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 108.196 -1.039 . . . . 34.71 108.196 177.345 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' ILE . . . . . 0.422 ' O ' ' OH ' ' B' ' 100' ' ' TYR . 3.2 tt -132.57 123.9 50.36 Favored 'Isoleucine or valine' 0 C--O 1.239 0.547 0 N-CA-C 108.904 -0.776 . . . . 34.47 108.904 -175.245 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 8.2 p90 -151.8 155.87 39.08 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 121.346 0.593 . . . . 30.18 109.579 -178.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -111.67 132.1 54.83 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 107.791 -1.189 . . . . 32.0 107.791 167.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 21.1 pt20 -126.85 157.05 40.34 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.468 0.652 . . . . 31.66 110.067 177.583 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.51 165.84 20.13 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 114.241 -1.345 . . . . 35.69 108.889 157.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 29.5 m -52.24 -43.9 64.58 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 114.92 -1.036 . . . . 44.51 110.983 175.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 84.3 p -66.17 -11.15 47.7 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 125.581 1.552 . . . . 40.83 113.096 -177.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.29 -2.16 57.64 Favored Glycine 0 C--N 1.341 0.815 0 CA-C-O 119.327 -0.707 . . . . 33.06 114.784 177.355 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 67.2 t -72.47 130.89 35.39 Favored 'Isoleucine or valine' 0 C--O 1.245 0.836 0 CA-C-N 117.744 0.772 . . . . 34.2 109.629 -179.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 2.7 pt -112.45 -24.55 3.85 Favored 'Isoleucine or valine' 0 C--O 1.242 0.71 0 CA-C-N 115.756 -0.656 . . . . 32.89 111.691 177.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -155.61 155.04 25.98 Favored Glycine 0 CA--C 1.508 -0.405 0 C-N-CA 120.041 -1.075 . . . . 34.16 113.713 -176.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 39.3 ttm180 -159.15 124.96 4.35 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.598 -0.519 . . . . 33.2 109.598 -178.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . 73.6 26.61 69.29 Favored Glycine 0 C--O 1.238 0.395 0 C-N-CA 118.75 -1.69 . . . . 34.57 113.273 175.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' GLY . . . . . . . . . . . . . . . 72.21 13.82 76.63 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 119.848 -1.167 . . . . 36.8 113.246 -174.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -136.19 169.14 18.11 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 121.93 0.871 . . . . 37.46 109.713 -178.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 60.3 mt -99.66 121.19 55.41 Favored Pre-proline 0 C--N 1.324 -0.525 0 N-CA-C 106.65 -1.611 . . . . 41.88 106.65 168.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -77.13 34.24 0.45 Allowed 'Trans proline' 0 C--O 1.237 0.458 0 N-CA-C 116.713 1.774 . . . . 33.98 116.713 -172.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' TRP . . . . . . . . . . . . . 23.4 p90 -166.99 163.8 15.99 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 107.792 -1.188 . . . . 37.34 107.792 179.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' ARG . . . . . 0.687 ' NE ' ' O ' ' B' ' 405' ' ' HOH . 81.9 mmt-85 -130.97 125.82 34.39 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 108.122 -1.066 . . . . 46.84 108.122 175.121 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' LEU . . . . . . . . . . . . . 4.9 tp -127.44 93.7 40.09 Favored Pre-proline 0 C--O 1.248 1.012 0 N-CA-C 107.584 -1.265 . . . . 48.44 107.584 -177.317 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -60.97 -40.46 52.28 Favored 'Trans proline' 0 C--O 1.237 0.438 0 CA-C-N 118.305 0.43 . . . . 46.57 112.833 -175.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' GLU . . . . . 0.417 ' OE2' ' OG ' ' B' ' 145' ' ' SER . 58.7 mp0 -58.45 -34.72 71.15 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 119.949 -0.7 . . . . 47.08 111.206 178.183 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' ASP . . . . . 0.457 ' OD1' ' OG1' ' B' ' 113' ' ' THR . 25.6 t70 -76.51 -38.48 55.11 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 111.827 0.306 . . . . 46.64 111.827 -177.413 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' GLN . . . . . 0.521 ' NE2' ' O ' ' B' ' 406' ' ' HOH . 2.6 mt-30 -53.46 -49.54 67.19 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.094 0.473 . . . . 99.51 110.461 171.607 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.62 -31.15 72.25 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.056 -0.657 . . . . 42.08 111.295 178.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' HIS . . . . . . . . . . . . . 25.6 t-80 -68.76 -42.29 77.7 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 120.688 0.28 . . . . 40.67 111.47 171.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -61.23 -42.02 97.89 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 119.918 -0.713 . . . . 53.41 110.135 174.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 17.8 ttp180 -60.59 -46.89 88.54 Favored 'General case' 0 C--O 1.238 0.486 0 O-C-N 122.095 -0.378 . . . . 69.15 111.066 -178.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 19.9 tp10 -62.77 -36.87 84.51 Favored 'General case' 0 C--O 1.233 0.23 0 O-C-N 121.949 -0.469 . . . . 51.13 111.668 -176.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' ILE . . . . . . . . . . . . . 2.6 mt -77.11 -34.26 21.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 O-C-N 121.78 -0.575 . . . . 31.7 111.642 -172.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 70.7 p -94.83 -24.91 16.84 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 113.098 0.777 . . . . 33.05 113.098 -172.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' MET . . . . . . . . . . . . . 50.5 tpp -50.95 127.88 19.87 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-O 121.373 0.606 . . . . 35.46 112.056 -171.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.05 -13.85 65.91 Favored Glycine 0 N--CA 1.436 -1.332 0 CA-C-N 115.615 -0.72 . . . . 32.4 114.446 177.267 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' HIS . . . . . . . . . . . . . 33.1 m-70 -106.13 -173.92 2.41 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 118.523 1.162 . . . . 33.17 109.338 -173.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 22.4 m -82.92 137.56 34.18 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 108.59 -0.893 . . . . 37.07 108.59 172.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 10.9 pt -114.31 132.66 62.75 Favored 'Isoleucine or valine' 0 C--O 1.24 0.583 0 N-CA-C 108.274 -1.01 . . . . 34.55 108.274 169.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 88.7 t -113.82 136.32 50.67 Favored 'Isoleucine or valine' 0 C--O 1.242 0.66 0 N-CA-C 108.342 -0.984 . . . . 34.56 108.342 175.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' MET . . . . . . . . . . . . . 12.7 ptp -148.01 154.51 40.38 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 115.573 -0.739 . . . . 30.03 110.082 -178.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . -75.96 157.15 48.35 Favored Glycine 0 C--N 1.353 1.501 0 CA-C-N 115.555 -0.748 . . . . 31.5 112.146 172.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 8.7 tmm_? -61.7 -36.62 81.44 Favored 'General case' 0 CA--C 1.515 -0.377 0 C-N-CA 119.469 -0.893 . . . . 50.98 110.878 -173.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' ARG . . . . . 0.412 ' NE ' ' O2 ' ' B' ' 305' ' ' PO4 . 47.1 mtt85 -62.31 -37.25 84.84 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 119.685 -0.806 . . . . 63.77 111.678 176.693 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' THR . . . . . . . . . . . . . 6.3 m -68.57 -38.67 80.91 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 119.666 -0.814 . . . . 33.46 111.995 175.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' TRP . . . . . . . . . . . . . 13.4 t-105 -65.74 -30.71 71.42 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.328 -0.857 . . . . 41.94 111.374 176.008 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -66.32 -31.15 71.77 Favored 'General case' 0 C--O 1.239 0.517 0 C-N-CA 120.072 -0.651 . . . . 45.66 111.39 176.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 74.2 p -82.57 -13.13 57.1 Favored 'General case' 0 C--N 1.349 0.566 0 N-CA-C 112.937 0.717 . . . . 40.8 112.937 -174.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 35.0 mt -73.87 114.37 31.95 Favored Pre-proline 0 C--O 1.239 0.511 0 CA-C-N 118.135 0.425 . . . . 42.08 110.106 170.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -53.53 150.31 27.98 Favored 'Trans proline' 0 C--N 1.331 -0.362 0 CA-C-N 119.462 0.844 . . . . 57.97 110.807 177.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.36 -22.0 65.77 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.021 -0.672 . . . . 71.76 112.185 -169.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 8.7 pttm -65.68 -50.1 66.15 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 120.89 0.376 . . . . 90.33 111.62 177.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' VAL . . . . . . . . . . . . . 2.6 t -79.85 -5.79 8.69 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.474 0 C-N-CA 120.003 -0.679 . . . . 61.97 112.616 -176.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' ARG . . . . . . . . . . . . . 8.6 ptt180 -112.3 145.5 32.98 Favored Pre-proline 0 C--N 1.288 -2.09 1 C-N-CA 109.575 -4.85 . . . . 47.9 109.689 179.79 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -67.71 154.62 86.9 Favored 'Cis proline' 0 C--O 1.235 0.339 0 CA-C-N 118.349 0.446 . . . . 41.51 111.755 -0.162 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 55.7 mt -66.75 128.7 93.97 Favored Pre-proline 0 C--N 1.322 -0.596 0 C-N-CA 119.863 -0.735 . . . . 36.73 109.302 175.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_exo -66.22 144.2 73.9 Favored 'Trans proline' 0 N--CA 1.475 0.41 0 CA-C-N 119.27 0.775 . . . . 36.33 113.433 -170.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 79.81 1.87 87.66 Favored Glycine 0 C--N 1.339 0.735 0 N-CA-C 115.272 0.869 . . . . 29.56 115.272 172.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 33.2 mtm180 -122.93 155.93 35.72 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 117.853 0.827 . . . . 36.58 109.312 179.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' ARG . . . . . . . . . . . . . 47.6 ttt180 -90.34 97.92 11.47 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 107.531 -1.285 . . . . 46.13 107.531 176.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -76.49 121.34 22.97 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 123.58 0.752 . . . . 39.31 111.029 -176.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 20.3 t -121.95 132.18 71.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.379 0 N-CA-C 107.69 -1.226 . . . . 37.49 107.69 175.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 25.2 t -115.01 131.15 68.11 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 N-CA-C 108.779 -0.823 . . . . 35.15 108.779 178.278 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 43.9 tp -102.19 128.07 48.85 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 116.287 -0.415 . . . . 46.13 110.195 -177.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' SER . . . . . 0.653 ' O ' ' O ' ' B' ' 404' ' ' HOH . 40.8 t -152.61 145.59 24.5 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.722 0.772 . . . . 50.98 109.875 -174.697 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' ARG . . . . . 0.769 ' CG ' ' O2X' ' B' ' 302' ' ' NDP . 8.8 ptm180 -81.59 -22.29 37.82 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 113.915 -1.493 . . . . 73.2 112.41 172.92 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 45.7 tt0 -64.13 121.34 13.98 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 123.894 0.877 . . . . 60.69 109.916 170.885 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.52 -36.14 73.58 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 112.053 0.39 . . . . 63.86 112.053 -171.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -97.43 0.79 48.32 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 113.433 0.901 . . . . 71.86 113.433 -174.174 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 49.5 t80 -57.95 132.15 52.57 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 118.609 0.64 . . . . 58.25 110.2 -170.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 34.2 ttp -114.93 136.71 52.81 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.392 -0.595 . . . . 70.58 109.392 177.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' ALA . . . . . . . . . . . . . . . -124.89 110.14 13.89 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 107.679 -1.23 . . . . 44.57 107.679 173.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 15.1 m -59.9 110.96 1.3 Allowed 'General case' 0 C--O 1.236 0.349 0 C-N-CA 122.587 0.355 . . . . 42.87 111.831 -179.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 102.74 -8.26 54.25 Favored Glycine 0 N--CA 1.443 -0.89 0 CA-C-O 118.877 -0.957 . . . . 37.2 114.308 -179.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -130.0 153.78 48.06 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 118.491 1.145 . . . . 42.5 110.666 -179.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -84.78 136.31 33.75 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 114.57 -1.195 . . . . 52.93 109.661 172.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' VAL . . . . . . . . . . . . . 46.1 t -109.99 128.56 66.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 N-CA-C 107.546 -1.279 . . . . 42.45 107.546 -177.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' VAL . . . . . . . . . . . . . 22.3 m -127.99 168.0 21.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 N-CA-C 108.289 -1.004 . . . . 47.22 108.289 179.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . -115.13 1.05 22.63 Favored Glycine 0 C--O 1.239 0.459 0 CA-C-N 115.553 -0.748 . . . . 52.72 113.766 -174.031 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' SER . . . . . 0.534 ' OG ' ' OE2' ' B' ' 84' ' ' GLU . 29.7 p -149.74 137.27 19.99 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 107.628 -1.249 . . . . 55.73 107.628 175.927 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' LEU . . . . . . . . . . . . . 28.7 tp -52.2 -33.36 40.61 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 119.997 -0.681 . . . . 56.29 111.456 178.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' GLU . . . . . 0.679 ' N ' ' OE2' ' B' ' 83' ' ' GLU . 18.7 mp0 -65.06 -35.74 82.12 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.263 -0.575 . . . . 69.65 110.914 -175.023 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' GLU . . . . . 0.534 ' OE2' ' OG ' ' B' ' 81' ' ' SER . 6.8 mt-10 -57.71 -42.48 83.83 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 120.007 -0.677 . . . . 59.75 110.444 170.739 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.6 -22.76 67.06 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.365 -0.379 . . . . 57.07 111.969 -174.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' LEU . . . . . . . . . . . . . 13.5 mt -94.81 79.16 3.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 122.595 1.188 . . . . 67.71 109.268 -177.78 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 67.4 p -110.69 -32.65 6.8 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 115.433 -0.803 . . . . 80.75 112.532 173.033 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 10.9 t -74.9 150.82 86.28 Favored Pre-proline 0 C--N 1.346 0.456 0 CA-C-O 120.734 0.302 . . . . 75.32 110.382 174.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' PRO . . . . . 0.466 ' O ' ' N ' ' B' ' 1' ' ' MET . 3.1 Cg_exo -85.76 -10.6 7.21 Favored 'Trans proline' 0 C--O 1.238 0.512 0 N-CA-C 114.702 1.001 . . . . 70.32 114.702 -179.923 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -120.75 101.57 7.81 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 106.511 -1.663 . . . . 55.14 106.511 162.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' THR . . . . . . . . . . . . . 59.0 m -115.15 143.55 45.05 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 108.299 -1.0 . . . . 45.17 108.299 178.274 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' TRP . . . . . . . . . . . . . 80.6 m95 -125.67 115.99 20.97 Favored 'General case' 0 C--O 1.24 0.565 0 N-CA-C 109.38 -0.6 . . . . 37.88 109.38 176.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 37.2 t -77.33 122.67 32.47 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 N-CA-C 108.213 -1.032 . . . . 35.03 108.213 173.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' ILE . . . . . . . . . . . . . 23.4 pt -112.95 12.18 8.33 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 C-N-CA 119.146 -1.022 . . . . 37.52 112.384 -171.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' GLY . . . . . . . . . . . . . . . 119.76 175.13 15.73 Favored Glycine 0 C--N 1.335 0.515 0 CA-C-O 121.852 0.696 . . . . 31.52 112.525 177.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . -101.57 -149.88 23.07 Favored Glycine 0 C--O 1.243 0.685 0 C-N-CA 123.205 0.431 . . . . 32.18 112.768 1.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' GLY . . . . . . . . . . . . . . . -54.45 -38.58 63.11 Favored Glycine 0 C--N 1.339 0.708 0 C-N-CA 120.577 -0.82 . . . . 29.51 112.628 -168.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -67.25 -42.03 84.6 Favored 'General case' 0 C--O 1.243 0.722 0 C-N-CA 119.728 -0.789 . . . . 51.08 111.423 177.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' VAL . . . . . . . . . . . . . 54.8 t -74.79 -38.41 44.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.367 0 C-N-CA 119.245 -0.982 . . . . 35.44 110.756 -175.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' TYR . . . . . 0.422 ' OH ' ' O ' ' B' ' 5' ' ' ILE . 13.6 m-85 -52.44 -50.71 62.07 Favored 'General case' 0 CA--C 1.518 -0.279 0 C-N-CA 119.397 -0.921 . . . . 31.6 110.947 173.144 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.5 -36.94 85.32 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 119.079 -1.048 . . . . 36.09 110.552 -176.606 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' LEU . . . . . . . . . . . . . 49.2 tp -64.83 -33.18 75.39 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 119.955 -0.698 . . . . 42.2 112.269 177.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' ALA . . . . . . . . . . . . . . . -87.22 -28.72 22.21 Favored 'General case' 0 C--N 1.343 0.308 0 N-CA-C 115.043 1.497 . . . . 37.82 115.043 -172.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 14.2 tp -52.16 -38.39 53.4 Favored Pre-proline 0 C--O 1.246 0.914 0 N-CA-C 115.519 1.674 . . . . 41.26 115.519 -170.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -63.48 -18.64 65.39 Favored 'Trans proline' 0 CA--C 1.512 -0.584 0 CA-C-N 122.159 1.807 . . . . 45.26 113.188 176.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 60.5 m-85 -102.61 11.14 38.2 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 118.255 0.479 . . . . 76.34 112.093 179.132 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -103.87 148.14 26.49 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-O 121.378 0.609 . . . . 41.36 110.917 -174.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' THR . . . . . . . . . . . . . 6.5 t -112.31 -14.92 13.26 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 114.929 -1.032 . . . . 48.6 113.173 171.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' ARG . . . . . 0.744 ' N ' ' O ' ' B' ' 401' ' ' HOH . 75.7 mtp180 -139.98 138.34 35.43 Favored 'General case' 0 C--N 1.346 0.42 0 C-N-CA 124.176 0.991 . . . . 42.75 110.15 -176.634 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' CYS . . . . . . . . . . . . . 84.8 m -124.92 129.1 49.69 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 108.234 -1.024 . . . . 38.28 108.234 166.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' GLU . . . . . 0.455 ' OE2' ' NH2' ' B' ' 109' ' ' ARG . 76.5 mm-40 -108.69 109.5 20.69 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 106.949 -1.5 . . . . 40.87 106.949 174.903 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' VAL . . . . . . . . . . . . . 70.4 t -111.05 126.13 68.42 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.476 0 C-N-CA 123.522 0.729 . . . . 39.42 109.139 -168.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' THR . . . . . 0.457 ' OG1' ' OD1' ' B' ' 27' ' ' ASP . 56.7 m -100.11 116.87 33.14 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 107.613 -1.254 . . . . 39.02 107.613 167.891 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -101.17 118.28 36.68 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 108.683 -0.858 . . . . 45.2 108.683 178.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 17.0 t -97.29 123.48 49.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 N-CA-C 108.571 -0.9 . . . . 35.29 108.571 -178.275 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -77.04 77.69 3.58 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 122.961 1.363 . . . . 44.86 109.149 177.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' ILE . . . . . 0.705 ' O ' ' O ' ' B' ' 402' ' ' HOH . 3.2 tt -126.17 140.59 48.24 Favored 'Isoleucine or valine' 0 C--O 1.24 0.561 0 N-CA-C 107.569 -1.271 . . . . 45.53 107.569 179.907 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' GLY . . . . . . . . . . . . . . . -87.59 58.73 4.39 Favored Glycine 0 C--O 1.238 0.358 0 C-N-CA 120.184 -1.008 . . . . 51.32 113.789 -177.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 1.1 tt -103.98 106.74 54.44 Favored Pre-proline 0 C--O 1.244 0.767 0 C-N-CA 123.737 0.815 . . . . 43.54 110.12 -171.047 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -77.75 153.1 29.54 Favored 'Trans proline' 0 C--O 1.235 0.347 0 CA-C-O 122.29 0.871 . . . . 42.47 113.08 -177.087 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 77.5 mtm-85 -65.18 120.26 12.38 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 114.218 -1.355 . . . . 54.41 110.805 178.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 26.7 tp10 -108.69 143.43 37.8 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.441 -0.948 . . . . 44.36 108.441 177.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -50.54 140.37 14.22 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 119.784 -0.766 . . . . 37.13 109.906 174.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 82.24 -8.32 61.36 Favored Glycine 0 N--CA 1.444 -0.812 0 N-CA-C 115.558 0.983 . . . . 40.93 115.558 -177.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -61.76 146.05 50.62 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 118.709 1.255 . . . . 39.73 110.818 175.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' ALA . . . . . . . . . . . . . . . -81.44 134.88 35.61 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 108.719 -0.845 . . . . 35.72 108.719 165.532 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 41.7 mt -116.21 149.02 39.81 Favored 'General case' 0 C--O 1.238 0.476 0 C-N-CA 124.053 0.941 . . . . 40.98 112.719 -176.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -69.01 143.59 94.62 Favored Pre-proline 0 C--N 1.354 0.786 0 CA-C-N 115.554 -0.748 . . . . 35.85 111.435 167.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_exo -56.85 155.99 25.29 Favored 'Trans proline' 0 N--CA 1.474 0.33 0 N-CA-C 110.801 -0.5 . . . . 36.7 110.801 170.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 2.4 t -103.46 131.69 51.42 Favored 'Isoleucine or valine' 0 C--O 1.24 0.575 0 N-CA-C 108.505 -0.924 . . . . 53.84 108.505 176.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 14.8 mt -101.08 125.12 47.68 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.546 -0.752 . . . . 51.44 109.7 -173.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 9.2 p30 -76.37 -151.9 0.04 OUTLIER 'General case' 0 C--O 1.237 0.413 0 C-N-CA 118.942 -1.103 . . . . 54.64 111.786 -176.24 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -74.7 -30.83 61.68 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 112.569 0.581 . . . . 72.05 112.569 177.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 134' ' ' THR . . . . . . . . . . . . . 1.6 p -67.19 -5.43 13.68 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 113.332 0.864 . . . . 55.27 113.332 -175.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 135' ' ' TRP . . . . . . . . . . . . . 94.0 m95 -102.82 117.4 34.55 Favored 'General case' 0 CA--C 1.52 -0.193 0 N-CA-C 108.523 -0.917 . . . . 54.0 108.523 176.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 136' ' ' ARG . . . . . . . . . . . . . 6.8 mmm180 -117.78 136.16 53.58 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 110.098 -0.334 . . . . 72.67 110.098 -176.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 137' ' ' GLY . . . . . . . . . . . . . . . -169.41 171.6 43.2 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 119.474 -1.346 . . . . 68.35 112.173 178.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 138' ' ' GLU . . . . . . . . . . . . . . . -85.58 148.32 25.98 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 114.491 -0.855 . . . . 72.61 110.057 -176.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 139' ' ' THR . . . . . . . . . . . . . 19.9 m -98.06 90.1 4.77 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 106.192 -1.781 . . . . 72.47 106.192 175.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 140' ' ' GLY . . . . . . . . . . . . . . . -49.19 153.63 2.53 Favored Glycine 0 C--N 1.337 0.614 0 CA-C-N 115.437 -0.801 . . . . 64.67 112.668 178.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 141' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -74.44 161.7 29.56 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 118.341 -1.344 . . . . 77.96 110.687 -177.766 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 142' ' ' TRP . . . . . . . . . . . . . 23.0 m95 -66.39 141.2 58.03 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-N 115.657 -0.701 . . . . 58.54 109.838 176.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 2.0 mtt180 -130.6 166.13 21.3 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.265 -0.643 . . . . 59.93 109.265 177.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 144' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -120.3 120.89 37.37 Favored 'General case' 0 C--O 1.236 0.355 0 O-C-N 121.83 -0.544 . . . . 68.29 109.913 -177.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 145' ' ' SER . . . . . 0.417 ' OG ' ' OE2' ' B' ' 26' ' ' GLU . 42.3 t -78.4 155.0 30.21 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 121.606 0.717 . . . . 49.54 110.536 178.877 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 10.8 ptt180 -70.69 4.54 2.4 Favored 'General case' 0 C--O 1.24 0.589 0 CA-C-N 115.169 -0.923 . . . . 65.61 112.391 168.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 42.9 p -95.88 -14.29 23.27 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 124.215 1.006 . . . . 54.14 112.427 170.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 148' ' ' GLY . . . . . . . . . . . . . . . 104.25 1.72 44.54 Favored Glycine 0 N--CA 1.445 -0.711 0 N-CA-C 115.209 0.843 . . . . 56.46 115.209 174.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 3.2 mt -108.85 149.73 28.69 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 118.213 1.007 . . . . 53.53 110.02 -179.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 150' ' ' ARG . . . . . . . . . . . . . 3.8 ttp180 -83.48 149.8 26.41 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.29 -0.868 . . . . 61.42 110.265 172.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 151' ' ' TYR . . . . . . . . . . . . . 29.4 p90 -161.12 150.05 16.4 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-O 121.065 0.46 . . . . 57.3 110.246 -177.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 152' ' ' ARG . . . . . . . . . . . . . 24.3 ptt180 -141.21 167.46 22.13 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 118.428 -1.309 . . . . 57.06 109.734 175.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 153' ' ' LEU . . . . . . . . . . . . . 9.8 mp -116.26 139.5 50.31 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.387 -0.824 . . . . 52.13 110.463 -170.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 154' ' ' TYR . . . . . . . . . . . . . 35.5 m-85 -123.2 127.29 48.41 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 107.384 -1.339 . . . . 57.27 107.384 174.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 155' ' ' SER . . . . . . . . . . . . . 40.1 m -111.56 121.67 45.78 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 108.248 -1.019 . . . . 48.27 108.248 171.061 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 156' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -113.25 137.98 50.68 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 122.461 0.304 . . . . 56.82 110.561 -175.25 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 157' ' ' HIS . . . . . . . . . . . . . 44.7 t-80 -125.09 144.42 50.43 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 108.751 -0.833 . . . . 46.9 108.751 170.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 158' ' ' ARG . . . . . 0.823 ' NH1' ' O ' ' B' ' 403' ' ' HOH . 30.0 ttp180 -129.33 112.81 14.24 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 105.789 -1.93 . . . . 54.49 105.789 176.155 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 159' ' ' SER . . . . . . . . . . . . . 5.0 m . . . . . 0 C--N 1.322 -0.607 0 N-CA-C 109.091 -0.707 . . . . 71.58 109.091 -179.893 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' NDP . . . . . 0.558 ' C5B' ' CD ' ' A' ' 45' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' RQ1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' PO4 . . . . . 0.858 ' O3 ' ' O ' ' A' ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 301' ' ' ' CO' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 302' ' ' NDP . . . . . 0.769 ' O2X' ' CG ' ' B' ' 67' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 303' ' ' ' CO' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 304' ' ' RQ1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 305' ' ' PO4 . . . . . 0.412 ' O2 ' ' NE ' ' B' ' 45' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 306' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 307' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . 0.858 ' O ' ' O3 ' ' A' ' 204' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . 0.708 ' O ' ' OE1' ' A' ' 68' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . 0.719 ' O ' ' O ' ' A' ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . 0.649 ' O ' ' O ' ' A' ' 120' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' HOH . . . . . 0.606 ' O ' ' O ' ' A' ' 85' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 309' ' ' HOH . . . . . 0.435 ' O ' ' NH2' ' A' ' 143' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 347' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 348' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 349' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 350' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 351' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 401' ' ' HOH . . . . . 0.804 ' O ' ' O ' ' B' ' 2' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 402' ' ' HOH . . . . . 0.705 ' O ' ' O ' ' B' ' 117' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 403' ' ' HOH . . . . . 0.823 ' O ' ' NH1' ' B' ' 158' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 404' ' ' HOH . . . . . 0.653 ' O ' ' O ' ' B' ' 66' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 405' ' ' HOH . . . . . 0.687 ' O ' ' NE ' ' B' ' 23' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 406' ' ' HOH . . . . . 0.521 ' O ' ' NE2' ' B' ' 28' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.3 tmm? . . . . . 0 C--O 1.243 0.736 0 N-CA-C 110.339 -0.245 . . . . 47.59 110.339 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 94.7 t -113.63 117.5 55.62 Favored 'Isoleucine or valine' 0 C--O 1.24 0.582 0 N-CA-C 108.443 -0.947 . . . . 40.34 108.443 174.279 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -120.72 163.89 14.2 Favored Glycine 0 N--CA 1.442 -0.937 0 C-N-CA 118.468 -1.825 . . . . 31.39 109.413 179.247 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 9.6 mp -119.81 137.99 53.64 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 123.646 0.779 . . . . 30.18 109.07 176.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 16.2 tt -134.18 129.48 53.72 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 N-CA-C 108.701 -0.851 . . . . 31.2 108.701 179.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' TRP . . . . . 0.441 ' HB3' ' CZ ' ' A' ' 100' ' ' TYR . 6.9 p90 -159.49 162.41 35.56 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 108.566 -0.902 . . . . 31.01 108.566 178.093 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ALA . . . . . 0.406 ' HA ' ' O ' ' A' ' 113' ' ' THR . . . -113.52 150.98 32.15 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 106.447 -1.686 . . . . 28.42 106.447 170.147 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -148.7 153.58 38.44 Favored 'General case' 0 N--CA 1.44 -0.957 0 C-N-CA 118.276 -1.37 . . . . 28.62 107.758 -178.245 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.99 168.0 12.71 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 118.382 -1.327 . . . . 29.41 109.56 162.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 48.5 m -52.03 -39.98 60.35 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-N 114.73 -1.123 . . . . 36.06 111.42 173.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 77.2 p -71.98 -9.73 58.77 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 124.005 0.922 . . . . 31.54 113.477 -176.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.38 -7.79 56.52 Favored Glycine 0 C--O 1.246 0.875 0 CA-C-N 119.368 0.986 . . . . 29.48 115.193 -178.361 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 63.6 t -65.84 134.56 29.62 Favored 'Isoleucine or valine' 0 C--O 1.24 0.57 0 CA-C-N 117.933 0.866 . . . . 28.98 109.736 178.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.6 pt -119.33 -25.94 2.6 Favored 'Isoleucine or valine' 0 C--O 1.247 0.936 0 N-CA-C 113.326 0.862 . . . . 26.7 113.326 174.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -149.8 161.34 28.82 Favored Glycine 0 C--N 1.333 0.378 0 N-CA-C 109.29 -1.524 . . . . 30.4 109.29 177.51 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 43.8 ttm180 -162.2 124.99 2.92 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 123.562 0.745 . . . . 41.1 109.495 -177.993 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 69.28 27.72 73.39 Favored Glycine 0 CA--C 1.505 -0.582 0 C-N-CA 119.361 -1.4 . . . . 36.44 113.055 -178.088 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 74.97 7.0 80.88 Favored Glycine 0 C--N 1.332 0.33 0 N-CA-C 115.544 0.978 . . . . 33.22 115.544 -178.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -139.42 -156.83 0.71 Allowed 'General case' 0 C--O 1.24 0.577 0 N-CA-C 107.476 -1.305 . . . . 34.25 107.476 -179.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 13.7 mt -131.94 127.58 21.21 Favored Pre-proline 0 C--O 1.234 0.253 0 N-CA-C 107.978 -1.119 . . . . 31.07 107.978 -174.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' PRO . . . . . 0.419 ' HG2' HD21 ' A' ' 119' ' ' LEU . 59.4 Cg_endo -83.65 36.68 0.61 Allowed 'Trans proline' 0 C--N 1.322 -0.864 0 CA-C-N 120.27 1.132 . . . . 27.97 113.883 -177.048 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 18.5 p90 -158.69 172.76 17.68 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.232 -1.025 . . . . 30.55 108.232 169.367 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 24.1 ttm180 -155.28 118.0 4.29 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 107.741 -1.207 . . . . 37.17 107.741 171.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.2 mp -117.78 108.6 42.58 Favored Pre-proline 0 C--O 1.244 0.783 0 N-CA-C 107.564 -1.273 . . . . 36.08 107.564 178.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -60.17 -32.76 94.95 Favored 'Trans proline' 0 C--O 1.237 0.469 0 CA-C-N 119.898 0.999 . . . . 38.15 111.522 -178.461 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 32.2 mp0 -61.81 -26.42 68.1 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 112.034 0.383 . . . . 37.85 112.034 179.489 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -85.5 -31.61 22.67 Favored 'General case' 0 C--O 1.242 0.683 0 C-N-CA 121.08 -0.248 . . . . 37.0 111.323 176.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -58.72 -51.82 68.31 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-O 121.264 0.554 . . . . 52.39 110.302 171.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -53.13 -51.95 60.27 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 116.064 -0.516 . . . . 33.73 111.662 174.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 40.9 t-80 -58.76 -42.27 88.5 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 119.556 -0.858 . . . . 36.94 111.029 175.815 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -57.99 -50.3 73.88 Favored 'General case' 0 C--O 1.239 0.546 0 O-C-N 121.826 -0.546 . . . . 41.59 110.911 177.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 12.9 ttt180 -58.58 -45.39 89.17 Favored 'General case' 0 C--N 1.346 0.436 0 N-CA-C 111.888 0.329 . . . . 55.37 111.888 179.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -56.8 -49.13 76.27 Favored 'General case' 0 C--O 1.233 0.235 0 O-C-N 121.988 -0.445 . . . . 61.61 111.467 178.379 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 30.8 mm -74.21 -31.27 28.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 O-C-N 121.706 -0.621 . . . . 38.18 111.06 -169.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 33.6 p -93.61 -21.72 19.23 Favored 'General case' 0 C--O 1.243 0.725 0 C-N-CA 119.273 -0.971 . . . . 32.63 113.175 -175.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 41.9 tpp -55.02 130.01 40.12 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-O 120.939 0.4 . . . . 34.94 111.704 -167.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 93.53 -23.02 32.2 Favored Glycine 0 N--CA 1.441 -0.991 0 N-CA-C 115.332 0.893 . . . . 31.3 115.332 179.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' HIS . . . . . 0.449 ' HB3' ' O ' ' A' ' 90' ' ' GLU . 39.2 m-70 -99.97 -171.54 2.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 118.276 1.038 . . . . 36.67 111.0 -169.424 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 46.6 m -84.99 138.32 32.54 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 121.57 -0.706 . . . . 33.4 109.82 173.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 11.2 pt -117.75 126.44 74.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 N-CA-C 107.782 -1.192 . . . . 33.28 107.782 171.275 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 40.3 t -112.9 123.68 68.8 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 N-CA-C 107.838 -1.171 . . . . 30.55 107.838 -177.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 6.4 ptp -133.29 156.56 47.37 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 122.007 0.908 . . . . 29.69 110.749 178.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -80.74 160.13 42.88 Favored Glycine 0 C--N 1.342 0.866 0 CA-C-N 114.503 -1.226 . . . . 31.89 111.885 169.071 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -59.14 -32.91 70.29 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-N 114.881 -0.66 . . . . 45.58 111.871 -175.048 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ARG . . . . . 0.979 HH22 ' CD ' ' A' ' 98' ' ' GLN . 1.8 mpt_? -63.4 -43.71 96.76 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 119.819 -0.752 . . . . 60.92 111.286 176.89 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 65.8 m -64.98 -41.8 95.11 Favored 'General case' 0 C--O 1.241 0.634 0 C-N-CA 120.114 -0.634 . . . . 33.06 111.685 179.024 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 12.3 t-105 -59.27 -39.49 83.06 Favored 'General case' 0 C--O 1.241 0.65 0 O-C-N 121.737 -0.602 . . . . 37.88 111.519 176.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -68.46 -31.33 70.55 Favored 'General case' 0 CA--C 1.51 -0.559 0 C-N-CA 120.759 -0.376 . . . . 42.27 111.916 177.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 2.2 p -66.93 -4.75 10.28 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 112.992 0.738 . . . . 41.01 112.992 174.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LEU . . . . . 0.466 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 12.9 mt -98.18 125.05 45.0 Favored Pre-proline 0 C--O 1.238 0.458 0 CA-C-N 118.622 0.647 . . . . 48.02 111.064 -173.833 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -58.64 151.74 60.88 Favored 'Trans proline' 0 C--N 1.329 -0.469 0 C-N-CA 120.472 0.781 . . . . 46.06 111.826 178.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ALA . . . . . 0.719 ' O ' ' O ' ' A' ' 303' ' ' HOH . . . -70.23 -28.18 65.06 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 115.469 -0.787 . . . . 48.78 111.616 -172.613 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 20.1 mtmm -63.21 -36.78 84.79 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 120.618 -0.433 . . . . 62.87 110.923 173.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 92.0 t -81.06 -23.31 10.71 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 N-CA-C 113.224 0.824 . . . . 49.88 113.224 -175.654 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ARG . . . . . 0.466 ' HD3' ' O ' ' A' ' 50' ' ' LEU . 8.6 mtp180 -85.34 130.32 52.08 Favored Pre-proline 0 C--N 1.329 -0.324 0 C-N-CA 127.199 2.2 . . . . 46.51 110.972 -169.727 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -80.39 159.35 85.99 Favored 'Cis proline' 0 C--O 1.244 0.818 0 CA-C-N 120.234 1.119 . . . . 39.43 112.212 -9.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 82.7 mt -60.45 118.89 38.26 Favored Pre-proline 0 C--O 1.245 0.859 0 N-CA-C 108.683 -0.858 . . . . 46.83 108.683 -179.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.36 146.33 56.19 Favored 'Trans proline' 0 C--N 1.331 -0.394 0 CA-C-N 118.886 0.638 . . . . 38.23 111.351 -164.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 83.51 5.7 88.22 Favored Glycine 0 C--N 1.338 0.69 0 CA-C-N 115.464 -0.789 . . . . 34.73 115.004 175.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 32.5 mtm180 -131.13 163.78 26.93 Favored 'General case' 0 C--O 1.24 0.583 0 C-N-CA 124.878 1.271 . . . . 38.69 108.201 -174.782 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 43.1 ttt180 -97.48 105.87 18.09 Favored 'General case' 0 C--O 1.242 0.698 0 N-CA-C 106.431 -1.692 . . . . 40.52 106.431 176.413 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -84.23 125.33 32.11 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 114.858 -1.064 . . . . 34.19 110.387 -178.18 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 52.1 t -131.44 129.26 61.99 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 N-CA-C 108.251 -1.018 . . . . 30.48 108.251 -177.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 76.9 t -111.83 131.87 62.01 Favored 'Isoleucine or valine' 0 C--O 1.244 0.771 0 N-CA-C 109.184 -0.672 . . . . 32.39 109.184 -178.084 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.9 mt -92.94 126.62 38.11 Favored 'General case' 0 C--O 1.238 0.5 0 N-CA-C 109.166 -0.679 . . . . 40.19 109.166 171.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 6.1 t -155.99 146.06 21.43 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 108.051 -1.092 . . . . 39.32 108.051 -178.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ARG . . . . . 0.701 ' NE ' ' O2 ' ' A' ' 204' ' ' PO4 . 54.4 mtt85 -89.92 -11.44 41.77 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 112.872 0.693 . . . . 54.59 112.872 177.15 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLN . . . . . 0.708 ' OE1' ' O ' ' A' ' 302' ' ' HOH . 2.5 mt-30 -79.33 116.55 19.64 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 108.781 -0.822 . . . . 50.28 108.781 173.106 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.68 -14.57 63.1 Favored 'General case' 0 C--N 1.343 0.298 0 N-CA-C 112.852 0.686 . . . . 40.07 112.852 -177.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 17.9 p-10 -114.35 11.55 17.33 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 118.519 0.6 . . . . 39.85 112.212 -179.532 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -63.56 125.96 25.96 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 118.816 -1.154 . . . . 41.33 109.977 177.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 14.9 mmm -95.9 130.02 42.99 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 110.021 -0.362 . . . . 52.74 110.021 179.026 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -126.26 98.47 5.47 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 106.481 -1.674 . . . . 37.81 106.481 170.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -60.79 118.96 7.29 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-O 120.741 0.305 . . . . 51.07 110.932 -177.073 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 97.19 5.39 58.19 Favored Glycine 0 N--CA 1.443 -0.857 0 N-CA-C 116.295 1.278 . . . . 38.86 116.295 179.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -143.27 171.76 13.67 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 118.601 1.201 . . . . 34.64 109.583 -174.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -96.81 140.15 31.81 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 115.512 -0.767 . . . . 36.9 109.844 169.093 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 4.3 t -109.96 118.5 57.07 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 N-CA-C 106.741 -1.577 . . . . 37.01 106.741 171.366 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 28.0 m -118.36 153.46 20.48 Favored 'Isoleucine or valine' 0 C--O 1.242 0.67 0 N-CA-C 108.391 -0.966 . . . . 38.94 108.391 179.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -89.43 -7.67 69.16 Favored Glycine 0 C--N 1.338 0.658 0 N-CA-C 115.364 0.906 . . . . 41.96 115.364 -178.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 6.3 p -150.51 157.04 42.56 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.762 0.825 . . . . 46.51 109.37 179.764 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 25.7 tp -79.33 -31.76 43.19 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.287 -0.869 . . . . 46.39 112.698 -171.108 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLU . . . . . 0.572 ' OE2' ' OH ' ' A' ' 106' ' ' TYR . 34.1 mp0 -56.42 -28.29 59.01 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 112.116 0.413 . . . . 53.05 112.116 174.817 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -61.33 -31.08 70.93 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 119.351 -0.94 . . . . 54.49 111.586 177.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ALA . . . . . 0.606 ' O ' ' O ' ' A' ' 305' ' ' HOH . . . -88.51 0.47 56.28 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 113.577 0.954 . . . . 48.08 113.577 -169.668 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 28.3 mt -101.7 25.93 7.97 Favored 'General case' 0 CA--C 1.514 -0.434 0 N-CA-C 112.44 0.533 . . . . 54.85 112.44 -171.203 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 10.7 p -87.44 -13.08 44.26 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 119.326 -0.95 . . . . 65.6 112.78 -177.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 36.4 m -87.22 164.39 36.01 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 118.314 0.506 . . . . 55.24 110.199 179.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -75.32 -37.46 1.86 Allowed 'Trans proline' 0 CA--C 1.511 -0.666 0 C-N-CA 118.421 -0.586 . . . . 50.28 113.077 -174.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' GLU . . . . . 0.449 ' O ' ' HB3' ' A' ' 38' ' ' HIS . 44.3 tt0 -122.94 114.8 20.92 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 108.766 -0.828 . . . . 41.81 108.766 178.124 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 33.9 m -122.08 132.38 54.46 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 123.383 0.673 . . . . 36.55 109.503 -177.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 79.0 m95 -120.11 124.11 44.99 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.093 -0.706 . . . . 34.44 109.093 -179.168 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 42.0 t -90.12 118.19 34.9 Favored 'Isoleucine or valine' 0 C--O 1.239 0.53 0 N-CA-C 108.907 -0.775 . . . . 32.93 108.907 179.45 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ILE . . . . . 0.403 ' O ' ' H5N' ' A' ' 201' ' ' NDP . 7.1 pt -107.96 8.87 9.33 Favored 'Isoleucine or valine' 0 C--O 1.242 0.694 0 N-CA-C 112.474 0.546 . . . . 34.64 112.474 -166.28 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLY . . . . . 0.734 ' HA3' ' H5N' ' A' ' 201' ' ' NDP . . . 119.85 178.88 16.45 Favored Glycine 0 N--CA 1.449 -0.478 0 CA-C-O 122.18 0.878 . . . . 30.83 112.931 175.226 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' GLY . . . . . 0.783 ' HA3' H52N ' A' ' 201' ' ' NDP . . . -96.84 -145.16 18.66 Favored Glycine 0 CA--C 1.521 0.444 0 CA-C-N 114.935 -0.632 . . . . 27.91 114.602 -4.835 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' GLY . . . . . 0.412 ' N ' ' O2N' ' A' ' 201' ' ' NDP . . . -55.1 -37.23 63.0 Favored Glycine 0 C--N 1.337 0.615 0 C-N-CA 120.785 -0.721 . . . . 28.91 112.937 -169.719 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' GLN . . . . . 0.979 ' CD ' HH22 ' A' ' 45' ' ' ARG . 18.3 mt-30 -65.37 -52.76 51.43 Favored 'General case' 0 C--O 1.24 0.571 0 O-C-N 122.378 -0.484 . . . . 40.86 110.989 179.461 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 45.3 t -71.15 -32.57 48.15 Favored 'Isoleucine or valine' 0 C--O 1.241 0.623 0 C-N-CA 119.859 -0.736 . . . . 34.06 110.996 -173.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' TYR . . . . . 0.441 ' CZ ' ' HB3' ' A' ' 6' ' ' TRP . 8.7 m-30 -52.67 -41.55 63.92 Favored 'General case' 0 C--N 1.35 0.595 0 O-C-N 121.78 -0.575 . . . . 32.75 111.072 171.17 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.02 -38.42 69.59 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 119.23 -0.988 . . . . 33.06 110.598 -177.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 12.2 mt -60.15 -44.87 94.63 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 120.814 0.34 . . . . 50.19 111.632 177.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -79.94 -23.97 41.34 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 113.388 0.885 . . . . 36.35 113.388 -171.56 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 16.2 tp -49.61 -36.85 18.98 Favored Pre-proline 0 C--O 1.244 0.767 0 N-CA-C 114.131 1.16 . . . . 34.18 114.131 -174.082 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -59.76 -27.8 85.78 Favored 'Trans proline' 0 C--O 1.24 0.604 0 CA-C-N 121.717 1.649 . . . . 34.22 113.846 175.189 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' TYR . . . . . 0.572 ' OH ' ' OE2' ' A' ' 83' ' ' GLU . 94.2 m-85 -90.08 -2.61 58.13 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 113.534 0.939 . . . . 41.62 113.534 -176.565 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -100.4 145.44 28.21 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-N 118.558 0.617 . . . . 37.86 111.313 -164.209 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 27.9 p -126.98 4.57 6.52 Favored 'General case' 0 C--O 1.24 0.573 0 C-N-CA 124.448 1.099 . . . . 40.37 112.452 171.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 43.6 mtp180 -143.58 135.79 26.87 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 124.135 0.974 . . . . 44.98 109.349 179.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' CYS . . . . . 0.47 ' HB2' ' HB2' ' A' ' 156' ' ' TYR . 63.2 m -133.94 107.17 7.66 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 107.558 -1.275 . . . . 37.8 107.558 175.248 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 40.6 mm-40 -92.46 107.89 19.56 Favored 'General case' 0 CA--C 1.521 -0.164 0 N-CA-C 107.383 -1.34 . . . . 40.89 107.383 174.709 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' VAL . . . . . 0.438 ' HB ' ' HB2' ' A' ' 154' ' ' TYR . 41.2 t -112.38 116.15 51.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 108.96 -0.755 . . . . 34.94 108.96 -170.615 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 113' ' ' THR . . . . . 0.406 ' O ' ' HA ' ' A' ' 7' ' ' ALA . 21.3 m -92.64 126.47 37.74 Favored 'General case' 0 CA--C 1.515 -0.377 0 C-N-CA 119.2 -1.0 . . . . 28.75 108.861 168.856 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -105.81 116.37 31.82 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 108.835 -0.802 . . . . 45.31 108.835 -178.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 4.5 t -96.9 121.45 47.43 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 N-CA-C 108.896 -0.779 . . . . 31.0 108.896 -175.123 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 39.4 t0 -67.14 64.48 0.06 Allowed 'General case' 0 C--O 1.236 0.37 0 CA-C-N 116.035 -0.53 . . . . 40.81 111.806 179.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 20.8 tt -123.96 133.08 70.26 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 N-CA-C 108.128 -1.064 . . . . 39.34 108.128 177.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -82.67 94.87 1.76 Allowed Glycine 0 C--N 1.332 0.321 0 N-CA-C 110.609 -0.996 . . . . 38.77 110.609 177.673 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' LEU . . . . . 0.428 HD12 ' HA ' ' A' ' 119' ' ' LEU . 5.2 tp -123.89 81.12 56.27 Favored Pre-proline 0 C--N 1.33 -0.247 0 N-CA-C 109.445 -0.576 . . . . 37.14 109.445 -167.08 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 120' ' ' PRO . . . . . 0.649 ' O ' ' O ' ' A' ' 304' ' ' HOH . 32.3 Cg_exo -59.06 149.11 81.94 Favored 'Trans proline' 0 C--N 1.329 -0.455 0 CA-C-O 121.814 0.673 . . . . 40.73 111.551 -178.335 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 20.3 mtt85 -81.94 118.23 22.79 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 119.649 -0.821 . . . . 50.44 110.711 -173.524 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -98.02 156.82 16.46 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 107.84 -1.17 . . . . 56.32 107.84 173.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -58.11 146.78 32.07 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.446 -0.797 . . . . 39.89 109.848 176.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 80.57 -8.91 52.98 Favored Glycine 0 C--O 1.241 0.57 0 CA-C-O 119.224 -0.764 . . . . 37.21 114.95 -178.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -62.36 139.91 58.54 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 118.178 0.989 . . . . 35.36 110.707 171.388 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -84.59 154.99 22.25 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 119.313 -0.955 . . . . 31.09 109.349 169.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 84.1 mt -134.7 149.84 50.54 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.443 0.64 . . . . 32.43 111.879 -166.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -68.94 144.48 95.78 Favored Pre-proline 0 C--O 1.236 0.372 0 CA-C-N 115.004 -0.998 . . . . 30.68 111.137 172.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -70.51 142.52 44.82 Favored 'Trans proline' 0 CA--C 1.516 -0.402 0 CA-C-O 121.147 0.394 . . . . 34.51 111.464 177.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 94.6 t -69.89 135.32 28.48 Favored 'Isoleucine or valine' 0 C--O 1.239 0.536 0 N-CA-C 108.455 -0.943 . . . . 48.11 108.455 177.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 51.5 mt -106.02 116.43 31.93 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 108.671 -0.863 . . . . 42.83 108.671 177.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 18.1 p30 -77.62 -158.96 0.13 Allowed 'General case' 0 C--O 1.236 0.355 0 C-N-CA 119.368 -0.933 . . . . 49.46 110.78 -179.171 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -82.82 -10.48 58.84 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 113.128 0.788 . . . . 71.14 113.128 -173.026 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 80.9 p -73.26 -5.69 41.11 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 118.011 -1.476 . . . . 46.94 112.995 176.372 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -100.89 124.36 46.45 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 119.202 0.91 . . . . 45.87 111.091 -178.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' ARG . . . . . 0.408 ' O ' ' N ' ' A' ' 157' ' ' HIS . 19.7 mmm180 -104.78 140.87 37.46 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 109.571 -0.529 . . . . 67.1 109.571 171.161 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -153.15 134.19 4.33 Favored Glycine 0 C--N 1.336 0.541 0 N-CA-C 119.439 2.536 . . . . 60.31 119.439 -171.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' GLU . . . . . 0.459 ' HG2' HD22 ' B' ' 153' ' ' LEU . 3.9 mp0 -86.35 120.17 27.41 Favored 'General case' 0 C--O 1.235 0.334 0 O-C-N 122.439 -0.448 . . . . 61.15 110.393 -179.196 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 59.1 m -86.25 114.96 23.49 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 115.841 -0.618 . . . . 63.87 109.853 -179.366 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -76.38 176.49 51.99 Favored Glycine 0 C--N 1.341 0.849 0 CA-C-O 122.32 0.955 . . . . 60.74 113.274 -178.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -88.35 146.32 25.34 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 114.824 -0.688 . . . . 67.66 110.719 -179.479 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 142' ' ' TRP . . . . . 0.496 ' CE2' ' HD3' ' A' ' 152' ' ' ARG . 37.2 m95 -55.92 135.1 52.42 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.76 -0.655 . . . . 59.65 110.485 174.526 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 143' ' ' ARG . . . . . 0.432 ' NH2' ' O ' ' A' ' 309' ' ' HOH . 3.3 mtm-85 -127.25 159.47 34.24 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.014 -1.476 . . . . 72.68 107.014 177.751 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 54.5 m-85 -101.57 123.88 46.32 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.615 -0.883 . . . . 57.27 108.615 -179.521 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' SER . . . . . 0.431 ' HB3' ' O ' ' A' ' 149' ' ' LEU . 5.6 t -86.62 143.2 27.75 Favored 'General case' 0 C--N 1.33 -0.245 0 O-C-N 123.587 0.554 . . . . 36.25 109.614 173.609 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 16.3 ptt-85 -65.43 -9.04 22.03 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 117.597 -1.641 . . . . 41.65 112.492 177.709 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 2.7 p -79.44 -2.46 42.06 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 113.186 0.81 . . . . 39.29 113.186 173.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . 102.37 -21.54 40.84 Favored Glycine 0 N--CA 1.436 -1.355 0 CA-C-O 119.339 -0.7 . . . . 31.69 114.204 178.418 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 149' ' ' LEU . . . . . 0.431 ' O ' ' HB3' ' A' ' 145' ' ' SER . 77.2 mt -90.79 145.73 24.54 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 117.654 0.727 . . . . 31.45 111.189 -177.071 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 54.2 mtm180 -82.4 154.09 25.38 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 108.94 -0.763 . . . . 50.04 108.94 168.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 23.0 p90 -151.8 161.96 41.8 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.099 -1.075 . . . . 42.37 108.099 178.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 152' ' ' ARG . . . . . 0.496 ' HD3' ' CE2' ' A' ' 142' ' ' TRP . 19.3 ptt180 -153.36 144.34 22.88 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.029 -1.1 . . . . 54.69 108.029 175.543 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 24.0 tp -91.39 136.49 33.07 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 121.342 0.591 . . . . 39.94 110.39 178.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 154' ' ' TYR . . . . . 0.438 ' HB2' ' HB ' ' A' ' 112' ' ' VAL . 34.4 m-85 -106.06 134.85 48.54 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 107.078 -1.453 . . . . 50.19 107.078 165.595 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 45.5 m -117.29 103.56 10.28 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 107.097 -1.446 . . . . 51.23 107.097 174.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' TYR . . . . . 0.47 ' HB2' ' HB2' ' A' ' 110' ' ' CYS . 79.8 m-85 -94.34 142.89 26.89 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 108.671 -0.863 . . . . 44.13 108.671 -178.278 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 157' ' ' HIS . . . . . 0.408 ' N ' ' O ' ' A' ' 136' ' ' ARG . 61.9 m-70 -141.86 140.38 32.88 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 108.533 -0.914 . . . . 61.49 108.533 -174.746 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 158' ' ' ARG . . . . . . . . . . . . . 17.6 ptt180 -147.51 165.58 29.89 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 107.122 -1.436 . . . . 44.19 107.122 168.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 23.4 m . . . . . 0 C--N 1.322 -0.588 0 CA-C-N 115.145 -0.934 . . . . 46.84 110.63 -179.282 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 7.9 tmm? . . . . . 0 N--CA 1.469 0.493 0 CA-C-O 119.832 -0.128 . . . . 79.1 110.711 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 2' ' ' VAL . . . . . 0.804 ' O ' ' O ' ' B' ' 401' ' ' HOH . 89.9 t -112.04 121.95 65.43 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.218 0 N-CA-C 108.402 -0.962 . . . . 48.19 108.402 178.182 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -116.06 160.73 13.21 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.5 -0.857 . . . . 36.81 113.462 178.199 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 10.8 mp -127.27 132.51 50.33 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 108.196 -1.039 . . . . 34.71 108.196 177.345 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 3.2 tt -132.57 123.9 50.36 Favored 'Isoleucine or valine' 0 C--O 1.239 0.547 0 N-CA-C 108.904 -0.776 . . . . 34.47 108.904 -175.245 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 8.2 p90 -151.8 155.87 39.08 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 121.346 0.593 . . . . 30.18 109.579 -178.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -111.67 132.1 54.83 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 107.791 -1.189 . . . . 32.0 107.791 167.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 21.1 pt20 -126.85 157.05 40.34 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.468 0.652 . . . . 31.66 110.067 177.583 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.51 165.84 20.13 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 114.241 -1.345 . . . . 35.69 108.889 157.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 29.5 m -52.24 -43.9 64.58 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 114.92 -1.036 . . . . 44.51 110.983 175.85 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 84.3 p -66.17 -11.15 47.7 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 125.581 1.552 . . . . 40.83 113.096 -177.138 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.29 -2.16 57.64 Favored Glycine 0 C--N 1.341 0.815 0 CA-C-O 119.327 -0.707 . . . . 33.06 114.784 177.355 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 67.2 t -72.47 130.89 35.39 Favored 'Isoleucine or valine' 0 C--O 1.245 0.836 0 CA-C-N 117.744 0.772 . . . . 34.2 109.629 -179.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 2.7 pt -112.45 -24.55 3.85 Favored 'Isoleucine or valine' 0 C--O 1.242 0.71 0 CA-C-N 115.756 -0.656 . . . . 32.89 111.691 177.128 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -155.61 155.04 25.98 Favored Glycine 0 CA--C 1.508 -0.405 0 C-N-CA 120.041 -1.075 . . . . 34.16 113.713 -176.584 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 39.3 ttm180 -159.15 124.96 4.35 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.598 -0.519 . . . . 33.2 109.598 -178.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . 73.6 26.61 69.29 Favored Glycine 0 C--O 1.238 0.395 0 C-N-CA 118.75 -1.69 . . . . 34.57 113.273 175.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' GLY . . . . . . . . . . . . . . . 72.21 13.82 76.63 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 119.848 -1.167 . . . . 36.8 113.246 -174.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -136.19 169.14 18.11 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 121.93 0.871 . . . . 37.46 109.713 -178.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 60.3 mt -99.66 121.19 55.41 Favored Pre-proline 0 C--N 1.324 -0.525 0 N-CA-C 106.65 -1.611 . . . . 41.88 106.65 168.471 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -77.13 34.24 0.45 Allowed 'Trans proline' 0 C--O 1.237 0.458 0 N-CA-C 116.713 1.774 . . . . 33.98 116.713 -172.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' TRP . . . . . . . . . . . . . 23.4 p90 -166.99 163.8 15.99 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 107.792 -1.188 . . . . 37.34 107.792 179.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 81.9 mmt-85 -130.97 125.82 34.39 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 108.122 -1.066 . . . . 46.84 108.122 175.121 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' LEU . . . . . 0.417 HD23 ' HB2' ' B' ' 27' ' ' ASP . 4.9 tp -127.44 93.7 40.09 Favored Pre-proline 0 C--O 1.248 1.012 0 N-CA-C 107.584 -1.265 . . . . 48.44 107.584 -177.317 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -60.97 -40.46 52.28 Favored 'Trans proline' 0 C--O 1.237 0.438 0 CA-C-N 118.305 0.43 . . . . 46.57 112.833 -175.822 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 58.7 mp0 -58.45 -34.72 71.15 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 119.949 -0.7 . . . . 47.08 111.206 178.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' ASP . . . . . 0.417 ' HB2' HD23 ' B' ' 24' ' ' LEU . 25.6 t70 -76.51 -38.48 55.11 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 111.827 0.306 . . . . 46.64 111.827 -177.413 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -53.46 -49.54 67.19 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.094 0.473 . . . . 99.51 110.461 171.607 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.62 -31.15 72.25 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.056 -0.657 . . . . 42.08 111.295 178.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' HIS . . . . . 0.426 ' O ' HG13 ' B' ' 34' ' ' ILE . 25.6 t-80 -68.76 -42.29 77.7 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 120.688 0.28 . . . . 40.67 111.47 171.918 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 31' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -61.23 -42.02 97.89 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 119.918 -0.713 . . . . 53.41 110.135 174.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 17.8 ttp180 -60.59 -46.89 88.54 Favored 'General case' 0 C--O 1.238 0.486 0 O-C-N 122.095 -0.378 . . . . 69.15 111.066 -178.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 19.9 tp10 -62.77 -36.87 84.51 Favored 'General case' 0 C--O 1.233 0.23 0 O-C-N 121.949 -0.469 . . . . 51.13 111.668 -176.363 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' ILE . . . . . 0.426 HG13 ' O ' ' B' ' 30' ' ' HIS . 2.6 mt -77.11 -34.26 21.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 O-C-N 121.78 -0.575 . . . . 31.7 111.642 -172.725 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 70.7 p -94.83 -24.91 16.84 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 113.098 0.777 . . . . 33.05 113.098 -172.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' MET . . . . . . . . . . . . . 50.5 tpp -50.95 127.88 19.87 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-O 121.373 0.606 . . . . 35.46 112.056 -171.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.05 -13.85 65.91 Favored Glycine 0 N--CA 1.436 -1.332 0 CA-C-N 115.615 -0.72 . . . . 32.4 114.446 177.267 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' HIS . . . . . 0.466 ' CG ' ' HG2' ' B' ' 90' ' ' GLU . 33.1 m-70 -106.13 -173.92 2.41 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 118.523 1.162 . . . . 33.17 109.338 -173.539 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 22.4 m -82.92 137.56 34.18 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 108.59 -0.893 . . . . 37.07 108.59 172.156 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 10.9 pt -114.31 132.66 62.75 Favored 'Isoleucine or valine' 0 C--O 1.24 0.583 0 N-CA-C 108.274 -1.01 . . . . 34.55 108.274 169.014 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 88.7 t -113.82 136.32 50.67 Favored 'Isoleucine or valine' 0 C--O 1.242 0.66 0 N-CA-C 108.342 -0.984 . . . . 34.56 108.342 175.499 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' MET . . . . . 0.441 ' HA ' ' O ' ' B' ' 95' ' ' GLY . 12.7 ptp -148.01 154.51 40.38 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 115.573 -0.739 . . . . 30.03 110.082 -178.019 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . -75.96 157.15 48.35 Favored Glycine 0 C--N 1.353 1.501 0 CA-C-N 115.555 -0.748 . . . . 31.5 112.146 172.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 8.7 tmm_? -61.7 -36.62 81.44 Favored 'General case' 0 CA--C 1.515 -0.377 0 C-N-CA 119.469 -0.893 . . . . 50.98 110.878 -173.312 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 47.1 mtt85 -62.31 -37.25 84.84 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 119.685 -0.806 . . . . 63.77 111.678 176.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' THR . . . . . . . . . . . . . 6.3 m -68.57 -38.67 80.91 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 119.666 -0.814 . . . . 33.46 111.995 175.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' TRP . . . . . 0.451 ' CE2' ' HB1' ' B' ' 73' ' ' ALA . 13.4 t-105 -65.74 -30.71 71.42 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.328 -0.857 . . . . 41.94 111.374 176.008 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -66.32 -31.15 71.77 Favored 'General case' 0 C--O 1.239 0.517 0 C-N-CA 120.072 -0.651 . . . . 45.66 111.39 176.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 74.2 p -82.57 -13.13 57.1 Favored 'General case' 0 C--N 1.349 0.566 0 N-CA-C 112.937 0.717 . . . . 40.8 112.937 -174.329 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' LEU . . . . . 0.411 ' O ' ' HD3' ' B' ' 55' ' ' ARG . 35.0 mt -73.87 114.37 31.95 Favored Pre-proline 0 C--O 1.239 0.511 0 CA-C-N 118.135 0.425 . . . . 42.08 110.106 170.921 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 51' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -53.53 150.31 27.98 Favored 'Trans proline' 0 C--N 1.331 -0.362 0 CA-C-N 119.462 0.844 . . . . 57.97 110.807 177.292 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.36 -22.0 65.77 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.021 -0.672 . . . . 71.76 112.185 -169.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 8.7 pttm -65.68 -50.1 66.15 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 120.89 0.376 . . . . 90.33 111.62 177.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' VAL . . . . . 0.4 HG12 ' O ' ' B' ' 54' ' ' VAL . 2.6 t -79.85 -5.79 8.69 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.474 0 C-N-CA 120.003 -0.679 . . . . 61.97 112.616 -176.385 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 55' ' ' ARG . . . . . 0.411 ' HD3' ' O ' ' B' ' 50' ' ' LEU . 8.6 ptt180 -112.3 145.5 32.98 Favored Pre-proline 0 C--N 1.288 -2.09 1 C-N-CA 109.575 -4.85 . . . . 47.9 109.689 179.79 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 56' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -67.71 154.62 86.9 Favored 'Cis proline' 0 C--O 1.235 0.339 0 CA-C-N 118.349 0.446 . . . . 41.51 111.755 -0.162 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 55.7 mt -66.75 128.7 93.97 Favored Pre-proline 0 C--N 1.322 -0.596 0 C-N-CA 119.863 -0.735 . . . . 36.73 109.302 175.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_exo -66.22 144.2 73.9 Favored 'Trans proline' 0 N--CA 1.475 0.41 0 CA-C-N 119.27 0.775 . . . . 36.33 113.433 -170.446 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 79.81 1.87 87.66 Favored Glycine 0 C--N 1.339 0.735 0 N-CA-C 115.272 0.869 . . . . 29.56 115.272 172.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 33.2 mtm180 -122.93 155.93 35.72 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 117.853 0.827 . . . . 36.58 109.312 179.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' ARG . . . . . . . . . . . . . 47.6 ttt180 -90.34 97.92 11.47 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 107.531 -1.285 . . . . 46.13 107.531 176.657 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -76.49 121.34 22.97 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 123.58 0.752 . . . . 39.31 111.029 -176.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 20.3 t -121.95 132.18 71.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.379 0 N-CA-C 107.69 -1.226 . . . . 37.49 107.69 175.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 25.2 t -115.01 131.15 68.11 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 N-CA-C 108.779 -0.823 . . . . 35.15 108.779 178.278 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 43.9 tp -102.19 128.07 48.85 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 116.287 -0.415 . . . . 46.13 110.195 -177.588 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' SER . . . . . 0.653 ' O ' ' O ' ' B' ' 404' ' ' HOH . 40.8 t -152.61 145.59 24.5 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.722 0.772 . . . . 50.98 109.875 -174.697 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 67' ' ' ARG . . . . . 1.2 ' HG2' ' O2X' ' B' ' 302' ' ' NDP . 8.8 ptm180 -81.59 -22.29 37.82 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 113.915 -1.493 . . . . 73.2 112.41 172.92 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 45.7 tt0 -64.13 121.34 13.98 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 123.894 0.877 . . . . 60.69 109.916 170.885 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.52 -36.14 73.58 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 112.053 0.39 . . . . 63.86 112.053 -171.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -97.43 0.79 48.32 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 113.433 0.901 . . . . 71.86 113.433 -174.174 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 49.5 t80 -57.95 132.15 52.57 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 118.609 0.64 . . . . 58.25 110.2 -170.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 34.2 ttp -114.93 136.71 52.81 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.392 -0.595 . . . . 70.58 109.392 177.216 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' ALA . . . . . 0.451 ' HB1' ' CE2' ' B' ' 47' ' ' TRP . . . -124.89 110.14 13.89 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 107.679 -1.23 . . . . 44.57 107.679 173.936 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 15.1 m -59.9 110.96 1.3 Allowed 'General case' 0 C--O 1.236 0.349 0 C-N-CA 122.587 0.355 . . . . 42.87 111.831 -179.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 102.74 -8.26 54.25 Favored Glycine 0 N--CA 1.443 -0.89 0 CA-C-O 118.877 -0.957 . . . . 37.2 114.308 -179.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -130.0 153.78 48.06 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 118.491 1.145 . . . . 42.5 110.666 -179.679 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -84.78 136.31 33.75 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 114.57 -1.195 . . . . 52.93 109.661 172.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' VAL . . . . . . . . . . . . . 46.1 t -109.99 128.56 66.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 N-CA-C 107.546 -1.279 . . . . 42.45 107.546 -177.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' VAL . . . . . . . . . . . . . 22.3 m -127.99 168.0 21.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 N-CA-C 108.289 -1.004 . . . . 47.22 108.289 179.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . -115.13 1.05 22.63 Favored Glycine 0 C--O 1.239 0.459 0 CA-C-N 115.553 -0.748 . . . . 52.72 113.766 -174.031 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 81' ' ' SER . . . . . 0.444 ' OG ' ' OE2' ' B' ' 84' ' ' GLU . 29.7 p -149.74 137.27 19.99 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 107.628 -1.249 . . . . 55.73 107.628 175.927 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 82' ' ' LEU . . . . . 0.408 ' O ' ' HG ' ' B' ' 86' ' ' LEU . 28.7 tp -52.2 -33.36 40.61 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 119.997 -0.681 . . . . 56.29 111.456 178.628 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 83' ' ' GLU . . . . . 0.593 ' OE2' ' N ' ' B' ' 83' ' ' GLU . 18.7 mp0 -65.06 -35.74 82.12 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.263 -0.575 . . . . 69.65 110.914 -175.023 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 84' ' ' GLU . . . . . 0.444 ' OE2' ' OG ' ' B' ' 81' ' ' SER . 6.8 mt-10 -57.71 -42.48 83.83 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 120.007 -0.677 . . . . 59.75 110.444 170.739 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.6 -22.76 67.06 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.365 -0.379 . . . . 57.07 111.969 -174.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' B' ' 82' ' ' LEU . 13.5 mt -94.81 79.16 3.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 122.595 1.188 . . . . 67.71 109.268 -177.78 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 67.4 p -110.69 -32.65 6.8 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 115.433 -0.803 . . . . 80.75 112.532 173.033 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 10.9 t -74.9 150.82 86.28 Favored Pre-proline 0 C--N 1.346 0.456 0 CA-C-O 120.734 0.302 . . . . 75.32 110.382 174.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -85.76 -10.6 7.21 Favored 'Trans proline' 0 C--O 1.238 0.512 0 N-CA-C 114.702 1.001 . . . . 70.32 114.702 -179.923 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' GLU . . . . . 0.466 ' HG2' ' CG ' ' B' ' 38' ' ' HIS . 5.0 tt0 -120.75 101.57 7.81 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 106.511 -1.663 . . . . 55.14 106.511 162.194 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 91' ' ' THR . . . . . . . . . . . . . 59.0 m -115.15 143.55 45.05 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 108.299 -1.0 . . . . 45.17 108.299 178.274 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' TRP . . . . . . . . . . . . . 80.6 m95 -125.67 115.99 20.97 Favored 'General case' 0 C--O 1.24 0.565 0 N-CA-C 109.38 -0.6 . . . . 37.88 109.38 176.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 37.2 t -77.33 122.67 32.47 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 N-CA-C 108.213 -1.032 . . . . 35.03 108.213 173.232 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' ILE . . . . . . . . . . . . . 23.4 pt -112.95 12.18 8.33 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 C-N-CA 119.146 -1.022 . . . . 37.52 112.384 -171.141 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 95' ' ' GLY . . . . . 0.441 ' O ' ' HA ' ' B' ' 42' ' ' MET . . . 119.76 175.13 15.73 Favored Glycine 0 C--N 1.335 0.515 0 CA-C-O 121.852 0.696 . . . . 31.52 112.525 177.425 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . -101.57 -149.88 23.07 Favored Glycine 0 C--O 1.243 0.685 0 C-N-CA 123.205 0.431 . . . . 32.18 112.768 1.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' GLY . . . . . . . . . . . . . . . -54.45 -38.58 63.11 Favored Glycine 0 C--N 1.339 0.708 0 C-N-CA 120.577 -0.82 . . . . 29.51 112.628 -168.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -67.25 -42.03 84.6 Favored 'General case' 0 C--O 1.243 0.722 0 C-N-CA 119.728 -0.789 . . . . 51.08 111.423 177.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' VAL . . . . . . . . . . . . . 54.8 t -74.79 -38.41 44.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.367 0 C-N-CA 119.245 -0.982 . . . . 35.44 110.756 -175.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' TYR . . . . . 0.457 ' HB3' ' CG ' ' B' ' 129' ' ' PRO . 13.6 m-85 -52.44 -50.71 62.07 Favored 'General case' 0 CA--C 1.518 -0.279 0 C-N-CA 119.397 -0.921 . . . . 31.6 110.947 173.144 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.5 -36.94 85.32 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 119.079 -1.048 . . . . 36.09 110.552 -176.606 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' LEU . . . . . . . . . . . . . 49.2 tp -64.83 -33.18 75.39 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 119.955 -0.698 . . . . 42.2 112.269 177.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 103' ' ' ALA . . . . . . . . . . . . . . . -87.22 -28.72 22.21 Favored 'General case' 0 C--N 1.343 0.308 0 N-CA-C 115.043 1.497 . . . . 37.82 115.043 -172.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 14.2 tp -52.16 -38.39 53.4 Favored Pre-proline 0 C--O 1.246 0.914 0 N-CA-C 115.519 1.674 . . . . 41.26 115.519 -170.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -63.48 -18.64 65.39 Favored 'Trans proline' 0 CA--C 1.512 -0.584 0 CA-C-N 122.159 1.807 . . . . 45.26 113.188 176.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 60.5 m-85 -102.61 11.14 38.2 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 118.255 0.479 . . . . 76.34 112.093 179.132 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -103.87 148.14 26.49 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-O 121.378 0.609 . . . . 41.36 110.917 -174.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 108' ' ' THR . . . . . . . . . . . . . 6.5 t -112.31 -14.92 13.26 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 114.929 -1.032 . . . . 48.6 113.173 171.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 109' ' ' ARG . . . . . 0.696 ' N ' ' O ' ' B' ' 401' ' ' HOH . 75.7 mtp180 -139.98 138.34 35.43 Favored 'General case' 0 C--N 1.346 0.42 0 C-N-CA 124.176 0.991 . . . . 42.75 110.15 -176.634 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 110' ' ' CYS . . . . . . . . . . . . . 84.8 m -124.92 129.1 49.69 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 108.234 -1.024 . . . . 38.28 108.234 166.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -108.69 109.5 20.69 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 106.949 -1.5 . . . . 40.87 106.949 174.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 112' ' ' VAL . . . . . 0.429 ' HB ' ' HB2' ' B' ' 154' ' ' TYR . 70.4 t -111.05 126.13 68.42 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.476 0 C-N-CA 123.522 0.729 . . . . 39.42 109.139 -168.782 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 113' ' ' THR . . . . . . . . . . . . . 56.7 m -100.11 116.87 33.14 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 107.613 -1.254 . . . . 39.02 107.613 167.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -101.17 118.28 36.68 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 108.683 -0.858 . . . . 45.2 108.683 178.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 17.0 t -97.29 123.48 49.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 N-CA-C 108.571 -0.9 . . . . 35.29 108.571 -178.275 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 116' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -77.04 77.69 3.58 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 122.961 1.363 . . . . 44.86 109.149 177.775 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 117' ' ' ILE . . . . . 0.705 ' O ' ' O ' ' B' ' 402' ' ' HOH . 3.2 tt -126.17 140.59 48.24 Favored 'Isoleucine or valine' 0 C--O 1.24 0.561 0 N-CA-C 107.569 -1.271 . . . . 45.53 107.569 179.907 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 118' ' ' GLY . . . . . . . . . . . . . . . -87.59 58.73 4.39 Favored Glycine 0 C--O 1.238 0.358 0 C-N-CA 120.184 -1.008 . . . . 51.32 113.789 -177.645 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 1.1 tt -103.98 106.74 54.44 Favored Pre-proline 0 C--O 1.244 0.767 0 C-N-CA 123.737 0.815 . . . . 43.54 110.12 -171.047 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 120' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -77.75 153.1 29.54 Favored 'Trans proline' 0 C--O 1.235 0.347 0 CA-C-O 122.29 0.871 . . . . 42.47 113.08 -177.087 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 77.5 mtm-85 -65.18 120.26 12.38 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 114.218 -1.355 . . . . 54.41 110.805 178.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 26.7 tp10 -108.69 143.43 37.8 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.441 -0.948 . . . . 44.36 108.441 177.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -50.54 140.37 14.22 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 119.784 -0.766 . . . . 37.13 109.906 174.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 82.24 -8.32 61.36 Favored Glycine 0 N--CA 1.444 -0.812 0 N-CA-C 115.558 0.983 . . . . 40.93 115.558 -177.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 125' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -61.76 146.05 50.62 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 118.709 1.255 . . . . 39.73 110.818 175.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 126' ' ' ALA . . . . . . . . . . . . . . . -81.44 134.88 35.61 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 108.719 -0.845 . . . . 35.72 108.719 165.532 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 41.7 mt -116.21 149.02 39.81 Favored 'General case' 0 C--O 1.238 0.476 0 C-N-CA 124.053 0.941 . . . . 40.98 112.719 -176.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -69.01 143.59 94.62 Favored Pre-proline 0 C--N 1.354 0.786 0 CA-C-N 115.554 -0.748 . . . . 35.85 111.435 167.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 129' ' ' PRO . . . . . 0.457 ' CG ' ' HB3' ' B' ' 100' ' ' TYR . 25.6 Cg_exo -56.85 155.99 25.29 Favored 'Trans proline' 0 N--CA 1.474 0.33 0 N-CA-C 110.801 -0.5 . . . . 36.7 110.801 170.801 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 2.4 t -103.46 131.69 51.42 Favored 'Isoleucine or valine' 0 C--O 1.24 0.575 0 N-CA-C 108.505 -0.924 . . . . 53.84 108.505 176.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 14.8 mt -101.08 125.12 47.68 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.546 -0.752 . . . . 51.44 109.7 -173.243 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 9.2 p30 -76.37 -151.9 0.04 OUTLIER 'General case' 0 C--O 1.237 0.413 0 C-N-CA 118.942 -1.103 . . . . 54.64 111.786 -176.24 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 133' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -74.7 -30.83 61.68 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 112.569 0.581 . . . . 72.05 112.569 177.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 134' ' ' THR . . . . . . . . . . . . . 1.6 p -67.19 -5.43 13.68 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 113.332 0.864 . . . . 55.27 113.332 -175.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 135' ' ' TRP . . . . . . . . . . . . . 94.0 m95 -102.82 117.4 34.55 Favored 'General case' 0 CA--C 1.52 -0.193 0 N-CA-C 108.523 -0.917 . . . . 54.0 108.523 176.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 136' ' ' ARG . . . . . . . . . . . . . 6.8 mmm180 -117.78 136.16 53.58 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 110.098 -0.334 . . . . 72.67 110.098 -176.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 137' ' ' GLY . . . . . . . . . . . . . . . -169.41 171.6 43.2 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 119.474 -1.346 . . . . 68.35 112.173 178.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 138' ' ' GLU . . . . . . . . . . . . . . . -85.58 148.32 25.98 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 114.491 -0.855 . . . . 72.61 110.057 -176.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 139' ' ' THR . . . . . . . . . . . . . 19.9 m -98.06 90.1 4.77 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 106.192 -1.781 . . . . 72.47 106.192 175.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 140' ' ' GLY . . . . . . . . . . . . . . . -49.19 153.63 2.53 Favored Glycine 0 C--N 1.337 0.614 0 CA-C-N 115.437 -0.801 . . . . 64.67 112.668 178.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 141' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -74.44 161.7 29.56 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 118.341 -1.344 . . . . 77.96 110.687 -177.766 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 142' ' ' TRP . . . . . . . . . . . . . 23.0 m95 -66.39 141.2 58.03 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-N 115.657 -0.701 . . . . 58.54 109.838 176.894 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 2.0 mtt180 -130.6 166.13 21.3 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.265 -0.643 . . . . 59.93 109.265 177.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 144' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -120.3 120.89 37.37 Favored 'General case' 0 C--O 1.236 0.355 0 O-C-N 121.83 -0.544 . . . . 68.29 109.913 -177.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 42.3 t -78.4 155.0 30.21 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 121.606 0.717 . . . . 49.54 110.536 178.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 10.8 ptt180 -70.69 4.54 2.4 Favored 'General case' 0 C--O 1.24 0.589 0 CA-C-N 115.169 -0.923 . . . . 65.61 112.391 168.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 42.9 p -95.88 -14.29 23.27 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 124.215 1.006 . . . . 54.14 112.427 170.642 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 148' ' ' GLY . . . . . . . . . . . . . . . 104.25 1.72 44.54 Favored Glycine 0 N--CA 1.445 -0.711 0 N-CA-C 115.209 0.843 . . . . 56.46 115.209 174.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 3.2 mt -108.85 149.73 28.69 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 118.213 1.007 . . . . 53.53 110.02 -179.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 150' ' ' ARG . . . . . . . . . . . . . 3.8 ttp180 -83.48 149.8 26.41 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.29 -0.868 . . . . 61.42 110.265 172.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 151' ' ' TYR . . . . . . . . . . . . . 29.4 p90 -161.12 150.05 16.4 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-O 121.065 0.46 . . . . 57.3 110.246 -177.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 152' ' ' ARG . . . . . . . . . . . . . 24.3 ptt180 -141.21 167.46 22.13 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 118.428 -1.309 . . . . 57.06 109.734 175.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 153' ' ' LEU . . . . . 0.459 HD22 ' HG2' ' A' ' 138' ' ' GLU . 9.8 mp -116.26 139.5 50.31 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.387 -0.824 . . . . 52.13 110.463 -170.668 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 154' ' ' TYR . . . . . 0.429 ' HB2' ' HB ' ' B' ' 112' ' ' VAL . 35.5 m-85 -123.2 127.29 48.41 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 107.384 -1.339 . . . . 57.27 107.384 174.4 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 155' ' ' SER . . . . . . . . . . . . . 40.1 m -111.56 121.67 45.78 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 108.248 -1.019 . . . . 48.27 108.248 171.061 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 156' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -113.25 137.98 50.68 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 122.461 0.304 . . . . 56.82 110.561 -175.25 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 157' ' ' HIS . . . . . . . . . . . . . 44.7 t-80 -125.09 144.42 50.43 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 108.751 -0.833 . . . . 46.9 108.751 170.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 158' ' ' ARG . . . . . 0.477 ' NH1' ' O ' ' B' ' 403' ' ' HOH . 30.0 ttp180 -129.33 112.81 14.24 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 105.789 -1.93 . . . . 54.49 105.789 176.155 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 159' ' ' SER . . . . . . . . . . . . . 5.0 m . . . . . 0 C--N 1.322 -0.607 0 N-CA-C 109.091 -0.707 . . . . 71.58 109.091 -179.893 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' NDP . . . . . 0.854 ' O3 ' ' HD3' ' A' ' 45' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 202' ' ' RQ1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' PO4 . . . . . 0.858 ' O3 ' ' O ' ' A' ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 301' ' ' ' CO' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 302' ' ' NDP . . . . . 1.2 ' O2X' ' HG2' ' B' ' 67' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 303' ' ' ' CO' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 304' ' ' RQ1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 305' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 306' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 307' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . 0.858 ' O ' ' O3 ' ' A' ' 204' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . 0.708 ' O ' ' OE1' ' A' ' 68' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . 0.719 ' O ' ' O ' ' A' ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . 0.649 ' O ' ' O ' ' A' ' 120' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 305' ' ' HOH . . . . . 0.606 ' O ' ' O ' ' A' ' 85' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 309' ' ' HOH . . . . . 0.432 ' O ' ' NH2' ' A' ' 143' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 347' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 348' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 349' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 350' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 351' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 401' ' ' HOH . . . . . 0.804 ' O ' ' O ' ' B' ' 2' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 402' ' ' HOH . . . . . 0.705 ' O ' ' O ' ' B' ' 117' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 403' ' ' HOH . . . . . 0.477 ' O ' ' NH1' ' B' ' 158' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 404' ' ' HOH . . . . . 0.653 ' O ' ' O ' ' B' ' 66' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 0 . 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 nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.3 tmm? . . . . . 0 C--O 1.243 0.736 0 N-CA-C 110.339 -0.245 . . . . 47.59 110.339 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 94.7 t -113.63 117.5 55.62 Favored 'Isoleucine or valine' 0 C--O 1.24 0.582 0 N-CA-C 108.443 -0.947 . . . . 40.34 108.443 174.279 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' GLY . . . . . . . . . . . . . . . -120.72 163.89 14.2 Favored Glycine 0 N--CA 1.442 -0.937 0 C-N-CA 118.468 -1.825 . . . . 31.39 109.413 179.247 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 9.6 mp -119.81 137.99 53.64 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 123.646 0.779 . . . . 30.18 109.07 176.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 16.2 tt -134.18 129.48 53.72 Favored 'Isoleucine or valine' 0 C--O 1.238 0.498 0 N-CA-C 108.701 -0.851 . . . . 31.2 108.701 179.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' TRP . . . . . 0.441 ' HB3' ' CZ ' ' A' ' 100' ' ' TYR . 6.9 p90 -159.49 162.41 35.56 Favored 'General case' 0 CA--C 1.512 -0.485 0 N-CA-C 108.566 -0.902 . . . . 31.01 108.566 178.093 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.406 ' HA ' ' O ' ' A' ' 113' ' ' THR . . . -113.52 150.98 32.15 Favored 'General case' 0 N--CA 1.449 -0.518 0 N-CA-C 106.447 -1.686 . . . . 28.42 106.447 170.147 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 16.5 pt20 -148.7 153.58 38.44 Favored 'General case' 0 N--CA 1.44 -0.957 0 C-N-CA 118.276 -1.37 . . . . 28.62 107.758 -178.245 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.99 168.0 12.71 Favored 'General case' 0 N--CA 1.446 -0.665 0 C-N-CA 118.382 -1.327 . . . . 29.41 109.56 162.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' THR . . . . . . . . . . . . . 48.5 m -52.03 -39.98 60.35 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-N 114.73 -1.123 . . . . 36.06 111.42 173.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' SER . . . . . . . . . . . . . 77.2 p -71.98 -9.73 58.77 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 124.005 0.922 . . . . 31.54 113.477 -176.664 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.38 -7.79 56.52 Favored Glycine 0 C--O 1.246 0.875 0 CA-C-N 119.368 0.986 . . . . 29.48 115.193 -178.361 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 63.6 t -65.84 134.56 29.62 Favored 'Isoleucine or valine' 0 C--O 1.24 0.57 0 CA-C-N 117.933 0.866 . . . . 28.98 109.736 178.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ILE . . . . . . . . . . . . . 1.6 pt -119.33 -25.94 2.6 Favored 'Isoleucine or valine' 0 C--O 1.247 0.936 0 N-CA-C 113.326 0.862 . . . . 26.7 113.326 174.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -149.8 161.34 28.82 Favored Glycine 0 C--N 1.333 0.378 0 N-CA-C 109.29 -1.524 . . . . 30.4 109.29 177.51 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 43.8 ttm180 -162.2 124.99 2.92 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 123.562 0.745 . . . . 41.1 109.495 -177.993 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . 69.28 27.72 73.39 Favored Glycine 0 CA--C 1.505 -0.582 0 C-N-CA 119.361 -1.4 . . . . 36.44 113.055 -178.088 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 74.97 7.0 80.88 Favored Glycine 0 C--N 1.332 0.33 0 N-CA-C 115.544 0.978 . . . . 33.22 115.544 -178.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.2 t70 -139.42 -156.83 0.71 Allowed 'General case' 0 C--O 1.24 0.577 0 N-CA-C 107.476 -1.305 . . . . 34.25 107.476 -179.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 13.7 mt -131.94 127.58 21.21 Favored Pre-proline 0 C--O 1.234 0.253 0 N-CA-C 107.978 -1.119 . . . . 31.07 107.978 -174.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.419 ' HG2' HD21 ' A' ' 119' ' ' LEU . 59.4 Cg_endo -83.65 36.68 0.61 Allowed 'Trans proline' 0 C--N 1.322 -0.864 0 CA-C-N 120.27 1.132 . . . . 27.97 113.883 -177.048 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' TRP . . . . . . . . . . . . . 18.5 p90 -158.69 172.76 17.68 Favored 'General case' 0 C--N 1.323 -0.578 0 N-CA-C 108.232 -1.025 . . . . 30.55 108.232 169.367 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 24.1 ttm180 -155.28 118.0 4.29 Favored 'General case' 0 C--N 1.319 -0.723 0 N-CA-C 107.741 -1.207 . . . . 37.17 107.741 171.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 5.2 mp -117.78 108.6 42.58 Favored Pre-proline 0 C--O 1.244 0.783 0 N-CA-C 107.564 -1.273 . . . . 36.08 107.564 178.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 22.1 Cg_exo -60.17 -32.76 94.95 Favored 'Trans proline' 0 C--O 1.237 0.469 0 CA-C-N 119.898 0.999 . . . . 38.15 111.522 -178.461 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 32.2 mp0 -61.81 -26.42 68.1 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 112.034 0.383 . . . . 37.85 112.034 179.489 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -85.5 -31.61 22.67 Favored 'General case' 0 C--O 1.242 0.683 0 C-N-CA 121.08 -0.248 . . . . 37.0 111.323 176.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 44.0 mt-30 -58.72 -51.82 68.31 Favored 'General case' 0 C--O 1.239 0.513 0 CA-C-O 121.264 0.554 . . . . 52.39 110.302 171.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -53.13 -51.95 60.27 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 116.064 -0.516 . . . . 33.73 111.662 174.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 40.9 t-80 -58.76 -42.27 88.5 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 119.556 -0.858 . . . . 36.94 111.029 175.815 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 66.5 t80 -57.99 -50.3 73.88 Favored 'General case' 0 C--O 1.239 0.546 0 O-C-N 121.826 -0.546 . . . . 41.59 110.911 177.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 12.9 ttt180 -58.58 -45.39 89.17 Favored 'General case' 0 C--N 1.346 0.436 0 N-CA-C 111.888 0.329 . . . . 55.37 111.888 179.33 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -56.8 -49.13 76.27 Favored 'General case' 0 C--O 1.233 0.235 0 O-C-N 121.988 -0.445 . . . . 61.61 111.467 178.379 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 30.8 mm -74.21 -31.27 28.76 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 O-C-N 121.706 -0.621 . . . . 38.18 111.06 -169.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 33.6 p -93.61 -21.72 19.23 Favored 'General case' 0 C--O 1.243 0.725 0 C-N-CA 119.273 -0.971 . . . . 32.63 113.175 -175.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' MET . . . . . . . . . . . . . 41.9 tpp -55.02 130.01 40.12 Favored 'General case' 0 CA--C 1.514 -0.409 0 CA-C-O 120.939 0.4 . . . . 34.94 111.704 -167.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 93.53 -23.02 32.2 Favored Glycine 0 N--CA 1.441 -0.991 0 N-CA-C 115.332 0.893 . . . . 31.3 115.332 179.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.449 ' HB3' ' O ' ' A' ' 90' ' ' GLU . 39.2 m-70 -99.97 -171.54 2.07 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 118.276 1.038 . . . . 36.67 111.0 -169.424 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 46.6 m -84.99 138.32 32.54 Favored 'General case' 0 C--O 1.236 0.359 0 O-C-N 121.57 -0.706 . . . . 33.4 109.82 173.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 11.2 pt -117.75 126.44 74.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 N-CA-C 107.782 -1.192 . . . . 33.28 107.782 171.275 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 40.3 t -112.9 123.68 68.8 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 N-CA-C 107.838 -1.171 . . . . 30.55 107.838 -177.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' MET . . . . . . . . . . . . . 6.4 ptp -133.29 156.56 47.37 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-O 122.007 0.908 . . . . 29.69 110.749 178.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . -80.74 160.13 42.88 Favored Glycine 0 C--N 1.342 0.866 0 CA-C-N 114.503 -1.226 . . . . 31.89 111.885 169.071 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -59.14 -32.91 70.29 Favored 'General case' 0 C--O 1.238 0.463 0 CA-C-N 114.881 -0.66 . . . . 45.58 111.871 -175.048 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ARG . . . . . 1.369 HH22 ' NE2' ' A' ' 98' ' ' GLN . 1.8 mpt_? -63.4 -43.71 96.76 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 119.819 -0.752 . . . . 60.92 111.286 176.89 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 65.8 m -64.98 -41.8 95.11 Favored 'General case' 0 C--O 1.241 0.634 0 C-N-CA 120.114 -0.634 . . . . 33.06 111.685 179.024 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' TRP . . . . . . . . . . . . . 12.3 t-105 -59.27 -39.49 83.06 Favored 'General case' 0 C--O 1.241 0.65 0 O-C-N 121.737 -0.602 . . . . 37.88 111.519 176.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 44.8 m-20 -68.46 -31.33 70.55 Favored 'General case' 0 CA--C 1.51 -0.559 0 C-N-CA 120.759 -0.376 . . . . 42.27 111.916 177.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 2.2 p -66.93 -4.75 10.28 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 112.992 0.738 . . . . 41.01 112.992 174.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.466 ' O ' ' HD3' ' A' ' 55' ' ' ARG . 12.9 mt -98.18 125.05 45.0 Favored Pre-proline 0 C--O 1.238 0.458 0 CA-C-N 118.622 0.647 . . . . 48.02 111.064 -173.833 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 50.2 Cg_exo -58.64 151.74 60.88 Favored 'Trans proline' 0 C--N 1.329 -0.469 0 C-N-CA 120.472 0.781 . . . . 46.06 111.826 178.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ALA . . . . . 0.719 ' O ' ' O ' ' A' ' 303' ' ' HOH . . . -70.23 -28.18 65.06 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 115.469 -0.787 . . . . 48.78 111.616 -172.613 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 20.1 mtmm -63.21 -36.78 84.79 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 120.618 -0.433 . . . . 62.87 110.923 173.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 92.0 t -81.06 -23.31 10.71 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 N-CA-C 113.224 0.824 . . . . 49.88 113.224 -175.654 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ARG . . . . . 0.466 ' HD3' ' O ' ' A' ' 50' ' ' LEU . 8.6 mtp180 -85.34 130.32 52.08 Favored Pre-proline 0 C--N 1.329 -0.324 0 C-N-CA 127.199 2.2 . . . . 46.51 110.972 -169.727 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -80.39 159.35 85.99 Favored 'Cis proline' 0 C--O 1.244 0.818 0 CA-C-N 120.234 1.119 . . . . 39.43 112.212 -9.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 82.7 mt -60.45 118.89 38.26 Favored Pre-proline 0 C--O 1.245 0.859 0 N-CA-C 108.683 -0.858 . . . . 46.83 108.683 -179.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.36 146.33 56.19 Favored 'Trans proline' 0 C--N 1.331 -0.394 0 CA-C-N 118.886 0.638 . . . . 38.23 111.351 -164.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 83.51 5.7 88.22 Favored Glycine 0 C--N 1.338 0.69 0 CA-C-N 115.464 -0.789 . . . . 34.73 115.004 175.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ARG . . . . . . . . . . . . . 32.5 mtm180 -131.13 163.78 26.93 Favored 'General case' 0 C--O 1.24 0.583 0 C-N-CA 124.878 1.271 . . . . 38.69 108.201 -174.782 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ARG . . . . . . . . . . . . . 43.1 ttt180 -97.48 105.87 18.09 Favored 'General case' 0 C--O 1.242 0.698 0 N-CA-C 106.431 -1.692 . . . . 40.52 106.431 176.413 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ASN . . . . . . . . . . . . . 1.9 m-80 -84.23 125.33 32.11 Favored 'General case' 0 C--O 1.237 0.424 0 CA-C-N 114.858 -1.064 . . . . 34.19 110.387 -178.18 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 52.1 t -131.44 129.26 61.99 Favored 'Isoleucine or valine' 0 C--O 1.236 0.343 0 N-CA-C 108.251 -1.018 . . . . 30.48 108.251 -177.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 76.9 t -111.83 131.87 62.01 Favored 'Isoleucine or valine' 0 C--O 1.244 0.771 0 N-CA-C 109.184 -0.672 . . . . 32.39 109.184 -178.084 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 5.9 mt -92.94 126.62 38.11 Favored 'General case' 0 C--O 1.238 0.5 0 N-CA-C 109.166 -0.679 . . . . 40.19 109.166 171.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 6.1 t -155.99 146.06 21.43 Favored 'General case' 0 N--CA 1.45 -0.473 0 N-CA-C 108.051 -1.092 . . . . 39.32 108.051 -178.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.701 ' NE ' ' O2 ' ' A' ' 204' ' ' PO4 . 54.4 mtt85 -89.92 -11.44 41.77 Favored 'General case' 0 CA--C 1.517 -0.312 0 N-CA-C 112.872 0.693 . . . . 54.59 112.872 177.15 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLN . . . . . 0.708 ' OE1' ' O ' ' A' ' 302' ' ' HOH . 2.5 mt-30 -79.33 116.55 19.64 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 108.781 -0.822 . . . . 50.28 108.781 173.106 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.68 -14.57 63.1 Favored 'General case' 0 C--N 1.343 0.298 0 N-CA-C 112.852 0.686 . . . . 40.07 112.852 -177.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 17.9 p-10 -114.35 11.55 17.33 Favored 'General case' 0 N--CA 1.448 -0.565 0 CA-C-N 118.519 0.6 . . . . 39.85 112.212 -179.532 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -63.56 125.96 25.96 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 118.816 -1.154 . . . . 41.33 109.977 177.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' MET . . . . . . . . . . . . . 14.9 mmm -95.9 130.02 42.99 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 110.021 -0.362 . . . . 52.74 110.021 179.026 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ALA . . . . . . . . . . . . . . . -126.26 98.47 5.47 Favored 'General case' 0 N--CA 1.463 0.187 0 N-CA-C 106.481 -1.674 . . . . 37.81 106.481 170.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -60.79 118.96 7.29 Favored 'General case' 0 C--O 1.24 0.602 0 CA-C-O 120.741 0.305 . . . . 51.07 110.932 -177.073 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . 97.19 5.39 58.19 Favored Glycine 0 N--CA 1.443 -0.857 0 N-CA-C 116.295 1.278 . . . . 38.86 116.295 179.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -143.27 171.76 13.67 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 118.601 1.201 . . . . 34.64 109.583 -174.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 30.0 mt-10 -96.81 140.15 31.81 Favored 'General case' 0 CA--C 1.512 -0.51 0 CA-C-N 115.512 -0.767 . . . . 36.9 109.844 169.093 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 4.3 t -109.96 118.5 57.07 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.48 0 N-CA-C 106.741 -1.577 . . . . 37.01 106.741 171.366 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' VAL . . . . . . . . . . . . . 28.0 m -118.36 153.46 20.48 Favored 'Isoleucine or valine' 0 C--O 1.242 0.67 0 N-CA-C 108.391 -0.966 . . . . 38.94 108.391 179.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . -89.43 -7.67 69.16 Favored Glycine 0 C--N 1.338 0.658 0 N-CA-C 115.364 0.906 . . . . 41.96 115.364 -178.476 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' SER . . . . . . . . . . . . . 6.3 p -150.51 157.04 42.56 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 123.762 0.825 . . . . 46.51 109.37 179.764 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' LEU . . . . . . . . . . . . . 25.7 tp -79.33 -31.76 43.19 Favored 'General case' 0 C--O 1.236 0.39 0 CA-C-N 115.287 -0.869 . . . . 46.39 112.698 -171.108 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLU . . . . . 0.572 ' OE2' ' OH ' ' A' ' 106' ' ' TYR . 34.1 mp0 -56.42 -28.29 59.01 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 112.116 0.413 . . . . 53.05 112.116 174.817 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -61.33 -31.08 70.93 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 119.351 -0.94 . . . . 54.49 111.586 177.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ALA . . . . . 0.606 ' O ' ' O ' ' A' ' 305' ' ' HOH . . . -88.51 0.47 56.28 Favored 'General case' 0 C--N 1.324 -0.525 0 N-CA-C 113.577 0.954 . . . . 48.08 113.577 -169.668 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 28.3 mt -101.7 25.93 7.97 Favored 'General case' 0 CA--C 1.514 -0.434 0 N-CA-C 112.44 0.533 . . . . 54.85 112.44 -171.203 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 10.7 p -87.44 -13.08 44.26 Favored 'General case' 0 C--N 1.321 -0.672 0 C-N-CA 119.326 -0.95 . . . . 65.6 112.78 -177.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' SER . . . . . . . . . . . . . 36.4 m -87.22 164.39 36.01 Favored Pre-proline 0 C--N 1.325 -0.49 0 CA-C-N 118.314 0.506 . . . . 55.24 110.199 179.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 17.4 Cg_exo -75.32 -37.46 1.86 Allowed 'Trans proline' 0 CA--C 1.511 -0.666 0 C-N-CA 118.421 -0.586 . . . . 50.28 113.077 -174.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' GLU . . . . . 0.449 ' O ' ' HB3' ' A' ' 38' ' ' HIS . 44.3 tt0 -122.94 114.8 20.92 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 108.766 -0.828 . . . . 41.81 108.766 178.124 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' THR . . . . . . . . . . . . . 33.9 m -122.08 132.38 54.46 Favored 'General case' 0 C--O 1.238 0.494 0 C-N-CA 123.383 0.673 . . . . 36.55 109.503 -177.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 79.0 m95 -120.11 124.11 44.99 Favored 'General case' 0 C--N 1.329 -0.325 0 N-CA-C 109.093 -0.706 . . . . 34.44 109.093 -179.168 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 42.0 t -90.12 118.19 34.9 Favored 'Isoleucine or valine' 0 C--O 1.239 0.53 0 N-CA-C 108.907 -0.775 . . . . 32.93 108.907 179.45 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.403 ' O ' ' H5N' ' A' ' 201' ' ' NDP . 7.1 pt -107.96 8.87 9.33 Favored 'Isoleucine or valine' 0 C--O 1.242 0.694 0 N-CA-C 112.474 0.546 . . . . 34.64 112.474 -166.28 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLY . . . . . 0.734 ' HA3' ' H5N' ' A' ' 201' ' ' NDP . . . 119.85 178.88 16.45 Favored Glycine 0 N--CA 1.449 -0.478 0 CA-C-O 122.18 0.878 . . . . 30.83 112.931 175.226 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' GLY . . . . . 0.783 ' HA3' H52N ' A' ' 201' ' ' NDP . . . -96.84 -145.16 18.66 Favored Glycine 0 CA--C 1.521 0.444 0 CA-C-N 114.935 -0.632 . . . . 27.91 114.602 -4.835 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' GLY . . . . . 0.412 ' N ' ' O2N' ' A' ' 201' ' ' NDP . . . -55.1 -37.23 63.0 Favored Glycine 0 C--N 1.337 0.615 0 C-N-CA 120.785 -0.721 . . . . 28.91 112.937 -169.719 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' GLN . . . . . 1.369 ' NE2' HH22 ' A' ' 45' ' ' ARG . 57.8 mt-30 -65.37 -52.76 51.43 Favored 'General case' 0 C--O 1.24 0.571 0 O-C-N 122.378 -0.484 . . . . 40.86 110.989 179.461 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 45.3 t -71.15 -32.57 48.15 Favored 'Isoleucine or valine' 0 C--O 1.241 0.623 0 C-N-CA 119.859 -0.736 . . . . 34.06 110.996 -173.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' TYR . . . . . 0.441 ' CZ ' ' HB3' ' A' ' 6' ' ' TRP . 8.7 m-30 -52.67 -41.55 63.92 Favored 'General case' 0 C--N 1.35 0.595 0 O-C-N 121.78 -0.575 . . . . 32.75 111.072 171.17 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -72.02 -38.42 69.59 Favored 'General case' 0 C--N 1.327 -0.413 0 C-N-CA 119.23 -0.988 . . . . 33.06 110.598 -177.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' LEU . . . . . . . . . . . . . 12.2 mt -60.15 -44.87 94.63 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-O 120.814 0.34 . . . . 50.19 111.632 177.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -79.94 -23.97 41.34 Favored 'General case' 0 N--CA 1.451 -0.393 0 N-CA-C 113.388 0.885 . . . . 36.35 113.388 -171.56 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 16.2 tp -49.61 -36.85 18.98 Favored Pre-proline 0 C--O 1.244 0.767 0 N-CA-C 114.131 1.16 . . . . 34.18 114.131 -174.082 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_exo -59.76 -27.8 85.78 Favored 'Trans proline' 0 C--O 1.24 0.604 0 CA-C-N 121.717 1.649 . . . . 34.22 113.846 175.189 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' TYR . . . . . 0.572 ' OH ' ' OE2' ' A' ' 83' ' ' GLU . 94.2 m-85 -90.08 -2.61 58.13 Favored 'General case' 0 CA--C 1.516 -0.332 0 N-CA-C 113.534 0.939 . . . . 41.62 113.534 -176.565 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ALA . . . . . . . . . . . . . . . -100.4 145.44 28.21 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-N 118.558 0.617 . . . . 37.86 111.313 -164.209 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 27.9 p -126.98 4.57 6.52 Favored 'General case' 0 C--O 1.24 0.573 0 C-N-CA 124.448 1.099 . . . . 40.37 112.452 171.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 43.6 mtp180 -143.58 135.79 26.87 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 124.135 0.974 . . . . 44.98 109.349 179.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' CYS . . . . . 0.47 ' HB2' ' HB2' ' A' ' 156' ' ' TYR . 63.2 m -133.94 107.17 7.66 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 107.558 -1.275 . . . . 37.8 107.558 175.248 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 40.6 mm-40 -92.46 107.89 19.56 Favored 'General case' 0 CA--C 1.521 -0.164 0 N-CA-C 107.383 -1.34 . . . . 40.89 107.383 174.709 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.438 ' HB ' ' HB2' ' A' ' 154' ' ' TYR . 41.2 t -112.38 116.15 51.8 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 108.96 -0.755 . . . . 34.94 108.96 -170.615 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' THR . . . . . 0.406 ' O ' ' HA ' ' A' ' 7' ' ' ALA . 21.3 m -92.64 126.47 37.74 Favored 'General case' 0 CA--C 1.515 -0.377 0 C-N-CA 119.2 -1.0 . . . . 28.75 108.861 168.856 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 12.5 tt0 -105.81 116.37 31.82 Favored 'General case' 0 C--N 1.319 -0.746 0 N-CA-C 108.835 -0.802 . . . . 45.31 108.835 -178.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 4.5 t -96.9 121.45 47.43 Favored 'Isoleucine or valine' 0 C--O 1.239 0.528 0 N-CA-C 108.896 -0.779 . . . . 31.0 108.896 -175.123 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' ASP . . . . . . . . . . . . . 39.4 t0 -67.14 64.48 0.06 Allowed 'General case' 0 C--O 1.236 0.37 0 CA-C-N 116.035 -0.53 . . . . 40.81 111.806 179.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' ILE . . . . . . . . . . . . . 20.8 tt -123.96 133.08 70.26 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 N-CA-C 108.128 -1.064 . . . . 39.34 108.128 177.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' GLY . . . . . . . . . . . . . . . -82.67 94.87 1.76 Allowed Glycine 0 C--N 1.332 0.321 0 N-CA-C 110.609 -0.996 . . . . 38.77 110.609 177.673 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.428 HD12 ' HA ' ' A' ' 119' ' ' LEU . 5.2 tp -123.89 81.12 56.27 Favored Pre-proline 0 C--N 1.33 -0.247 0 N-CA-C 109.445 -0.576 . . . . 37.14 109.445 -167.08 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' PRO . . . . . 0.649 ' O ' ' O ' ' A' ' 304' ' ' HOH . 32.3 Cg_exo -59.06 149.11 81.94 Favored 'Trans proline' 0 C--N 1.329 -0.455 0 CA-C-O 121.814 0.673 . . . . 40.73 111.551 -178.335 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 20.3 mtt85 -81.94 118.23 22.79 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 119.649 -0.821 . . . . 50.44 110.711 -173.524 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -98.02 156.82 16.46 Favored 'General case' 0 N--CA 1.446 -0.654 0 N-CA-C 107.84 -1.17 . . . . 56.32 107.84 173.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -58.11 146.78 32.07 Favored 'General case' 0 C--N 1.323 -0.564 0 CA-C-N 115.446 -0.797 . . . . 39.89 109.848 176.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . 80.57 -8.91 52.98 Favored Glycine 0 C--O 1.241 0.57 0 CA-C-O 119.224 -0.764 . . . . 37.21 114.95 -178.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -62.36 139.91 58.54 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 118.178 0.989 . . . . 35.36 110.707 171.388 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' ALA . . . . . . . . . . . . . . . -84.59 154.99 22.25 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 119.313 -0.955 . . . . 31.09 109.349 169.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' LEU . . . . . . . . . . . . . 84.1 mt -134.7 149.84 50.54 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.443 0.64 . . . . 32.43 111.879 -166.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' ALA . . . . . . . . . . . . . . . -68.94 144.48 95.78 Favored Pre-proline 0 C--O 1.236 0.372 0 CA-C-N 115.004 -0.998 . . . . 30.68 111.137 172.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -70.51 142.52 44.82 Favored 'Trans proline' 0 CA--C 1.516 -0.402 0 CA-C-O 121.147 0.394 . . . . 34.51 111.464 177.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' VAL . . . . . . . . . . . . . 94.6 t -69.89 135.32 28.48 Favored 'Isoleucine or valine' 0 C--O 1.239 0.536 0 N-CA-C 108.455 -0.943 . . . . 48.11 108.455 177.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' LEU . . . . . . . . . . . . . 51.5 mt -106.02 116.43 31.93 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 108.671 -0.863 . . . . 42.83 108.671 177.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' ASP . . . . . . . . . . . . . 18.1 p30 -77.62 -158.96 0.13 Allowed 'General case' 0 C--O 1.236 0.355 0 C-N-CA 119.368 -0.933 . . . . 49.46 110.78 -179.171 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 74.9 mm-40 -82.82 -10.48 58.84 Favored 'General case' 0 C--N 1.325 -0.47 0 N-CA-C 113.128 0.788 . . . . 71.14 113.128 -173.026 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' THR . . . . . . . . . . . . . 80.9 p -73.26 -5.69 41.11 Favored 'General case' 0 C--N 1.322 -0.627 0 C-N-CA 118.011 -1.476 . . . . 46.94 112.995 176.372 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -100.89 124.36 46.45 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 119.202 0.91 . . . . 45.87 111.091 -178.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' ARG . . . . . 0.408 ' O ' ' N ' ' A' ' 157' ' ' HIS . 19.7 mmm180 -104.78 140.87 37.46 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 109.571 -0.529 . . . . 67.1 109.571 171.161 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -153.15 134.19 4.33 Favored Glycine 0 C--N 1.336 0.541 0 N-CA-C 119.439 2.536 . . . . 60.31 119.439 -171.794 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' GLU . . . . . 0.459 ' HG2' HD22 ' B' ' 153' ' ' LEU . 3.9 mp0 -86.35 120.17 27.41 Favored 'General case' 0 C--O 1.235 0.334 0 O-C-N 122.439 -0.448 . . . . 61.15 110.393 -179.196 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' THR . . . . . . . . . . . . . 59.1 m -86.25 114.96 23.49 Favored 'General case' 0 C--O 1.237 0.427 0 CA-C-N 115.841 -0.618 . . . . 63.87 109.853 -179.366 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' GLY . . . . . . . . . . . . . . . -76.38 176.49 51.99 Favored Glycine 0 C--N 1.341 0.849 0 CA-C-O 122.32 0.955 . . . . 60.74 113.274 -178.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -88.35 146.32 25.34 Favored 'General case' 0 C--O 1.235 0.32 0 CA-C-N 114.824 -0.688 . . . . 67.66 110.719 -179.479 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' TRP . . . . . 0.496 ' CE2' ' HD3' ' A' ' 152' ' ' ARG . 37.2 m95 -55.92 135.1 52.42 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-N 115.76 -0.655 . . . . 59.65 110.485 174.526 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' ARG . . . . . 0.432 ' NH2' ' O ' ' A' ' 309' ' ' HOH . 3.3 mtm-85 -127.25 159.47 34.24 Favored 'General case' 0 C--N 1.323 -0.556 0 N-CA-C 107.014 -1.476 . . . . 72.68 107.014 177.751 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' PHE . . . . . . . . . . . . . 54.5 m-85 -101.57 123.88 46.32 Favored 'General case' 0 C--N 1.323 -0.568 0 N-CA-C 108.615 -0.883 . . . . 57.27 108.615 -179.521 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' SER . . . . . 0.431 ' HB3' ' O ' ' A' ' 149' ' ' LEU . 5.6 t -86.62 143.2 27.75 Favored 'General case' 0 C--N 1.33 -0.245 0 O-C-N 123.587 0.554 . . . . 36.25 109.614 173.609 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' ARG . . . . . . . . . . . . . 16.3 ptt-85 -65.43 -9.04 22.03 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 117.597 -1.641 . . . . 41.65 112.492 177.709 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' SER . . . . . . . . . . . . . 2.7 p -79.44 -2.46 42.06 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 113.186 0.81 . . . . 39.29 113.186 173.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' GLY . . . . . . . . . . . . . . . 102.37 -21.54 40.84 Favored Glycine 0 N--CA 1.436 -1.355 0 CA-C-O 119.339 -0.7 . . . . 31.69 114.204 178.418 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' LEU . . . . . 0.431 ' O ' ' HB3' ' A' ' 145' ' ' SER . 77.2 mt -90.79 145.73 24.54 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-N 117.654 0.727 . . . . 31.45 111.189 -177.071 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' ARG . . . . . . . . . . . . . 54.2 mtm180 -82.4 154.09 25.38 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 108.94 -0.763 . . . . 50.04 108.94 168.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 23.0 p90 -151.8 161.96 41.8 Favored 'General case' 0 C--N 1.324 -0.524 0 N-CA-C 108.099 -1.075 . . . . 42.37 108.099 178.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' ARG . . . . . 0.496 ' HD3' ' CE2' ' A' ' 142' ' ' TRP . 19.3 ptt180 -153.36 144.34 22.88 Favored 'General case' 0 C--N 1.324 -0.523 0 N-CA-C 108.029 -1.1 . . . . 54.69 108.029 175.543 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' LEU . . . . . . . . . . . . . 24.0 tp -91.39 136.49 33.07 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-O 121.342 0.591 . . . . 39.94 110.39 178.537 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' TYR . . . . . 0.438 ' HB2' ' HB ' ' A' ' 112' ' ' VAL . 34.4 m-85 -106.06 134.85 48.54 Favored 'General case' 0 C--N 1.323 -0.561 0 N-CA-C 107.078 -1.453 . . . . 50.19 107.078 165.595 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' SER . . . . . . . . . . . . . 45.5 m -117.29 103.56 10.28 Favored 'General case' 0 C--O 1.237 0.433 0 N-CA-C 107.097 -1.446 . . . . 51.23 107.097 174.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' TYR . . . . . 0.47 ' HB2' ' HB2' ' A' ' 110' ' ' CYS . 79.8 m-85 -94.34 142.89 26.89 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 108.671 -0.863 . . . . 44.13 108.671 -178.278 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' HIS . . . . . 0.408 ' N ' ' O ' ' A' ' 136' ' ' ARG . 61.9 m-70 -141.86 140.38 32.88 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 108.533 -0.914 . . . . 61.49 108.533 -174.746 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' ARG . . . . . . . . . . . . . 17.6 ptt180 -147.51 165.58 29.89 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 107.122 -1.436 . . . . 44.19 107.122 168.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' SER . . . . . . . . . . . . . 23.4 m . . . . . 0 C--N 1.322 -0.588 0 CA-C-N 115.145 -0.934 . . . . 46.84 110.63 -179.282 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 7.9 tmm? . . . . . 0 N--CA 1.469 0.493 0 CA-C-O 119.832 -0.128 . . . . 79.1 110.711 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' VAL . . . . . 0.804 ' O ' ' O ' ' B' ' 401' ' ' HOH . 89.9 t -112.04 121.95 65.43 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.218 0 N-CA-C 108.402 -0.962 . . . . 48.19 108.402 178.182 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' GLY . . . . . . . . . . . . . . . -116.06 160.73 13.21 Favored Glycine 0 N--CA 1.45 -0.398 0 C-N-CA 120.5 -0.857 . . . . 36.81 113.462 178.199 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' LEU . . . . . . . . . . . . . 10.8 mp -127.27 132.51 50.33 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 108.196 -1.039 . . . . 34.71 108.196 177.345 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 3.2 tt -132.57 123.9 50.36 Favored 'Isoleucine or valine' 0 C--O 1.239 0.547 0 N-CA-C 108.904 -0.776 . . . . 34.47 108.904 -175.245 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' TRP . . . . . . . . . . . . . 8.2 p90 -151.8 155.87 39.08 Favored 'General case' 0 CA--C 1.513 -0.453 0 CA-C-O 121.346 0.593 . . . . 30.18 109.579 -178.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -111.67 132.1 54.83 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 107.791 -1.189 . . . . 32.0 107.791 167.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' GLN . . . . . . . . . . . . . 21.1 pt20 -126.85 157.05 40.34 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-O 121.468 0.652 . . . . 31.66 110.067 177.583 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.51 165.84 20.13 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 114.241 -1.345 . . . . 35.69 108.889 157.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' THR . . . . . . . . . . . . . 29.5 m -52.24 -43.9 64.58 Favored 'General case' 0 C--O 1.237 0.426 0 CA-C-N 114.92 -1.036 . . . . 44.51 110.983 175.85 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' SER . . . . . . . . . . . . . 84.3 p -66.17 -11.15 47.7 Favored 'General case' 0 C--O 1.234 0.282 0 C-N-CA 125.581 1.552 . . . . 40.83 113.096 -177.138 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 99.29 -2.16 57.64 Favored Glycine 0 C--N 1.341 0.815 0 CA-C-O 119.327 -0.707 . . . . 33.06 114.784 177.355 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' VAL . . . . . . . . . . . . . 67.2 t -72.47 130.89 35.39 Favored 'Isoleucine or valine' 0 C--O 1.245 0.836 0 CA-C-N 117.744 0.772 . . . . 34.2 109.629 -179.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' ILE . . . . . . . . . . . . . 2.7 pt -112.45 -24.55 3.85 Favored 'Isoleucine or valine' 0 C--O 1.242 0.71 0 CA-C-N 115.756 -0.656 . . . . 32.89 111.691 177.128 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' GLY . . . . . . . . . . . . . . . -155.61 155.04 25.98 Favored Glycine 0 CA--C 1.508 -0.405 0 C-N-CA 120.041 -1.075 . . . . 34.16 113.713 -176.584 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' ARG . . . . . . . . . . . . . 39.3 ttm180 -159.15 124.96 4.35 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 109.598 -0.519 . . . . 33.2 109.598 -178.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' GLY . . . . . . . . . . . . . . . 73.6 26.61 69.29 Favored Glycine 0 C--O 1.238 0.395 0 C-N-CA 118.75 -1.69 . . . . 34.57 113.273 175.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' GLY . . . . . . . . . . . . . . . 72.21 13.82 76.63 Favored Glycine 0 N--CA 1.447 -0.615 0 C-N-CA 119.848 -1.167 . . . . 36.8 113.246 -174.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -136.19 169.14 18.11 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 121.93 0.871 . . . . 37.46 109.713 -178.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' ILE . . . . . . . . . . . . . 60.3 mt -99.66 121.19 55.41 Favored Pre-proline 0 C--N 1.324 -0.525 0 N-CA-C 106.65 -1.611 . . . . 41.88 106.65 168.471 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 35.0 Cg_endo -77.13 34.24 0.45 Allowed 'Trans proline' 0 C--O 1.237 0.458 0 N-CA-C 116.713 1.774 . . . . 33.98 116.713 -172.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' TRP . . . . . . . . . . . . . 23.4 p90 -166.99 163.8 15.99 Favored 'General case' 0 C--O 1.236 0.364 0 N-CA-C 107.792 -1.188 . . . . 37.34 107.792 179.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' ARG . . . . . . . . . . . . . 81.9 mmt-85 -130.97 125.82 34.39 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 108.122 -1.066 . . . . 46.84 108.122 175.121 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' LEU . . . . . 0.417 HD23 ' HB2' ' B' ' 27' ' ' ASP . 4.9 tp -127.44 93.7 40.09 Favored Pre-proline 0 C--O 1.248 1.012 0 N-CA-C 107.584 -1.265 . . . . 48.44 107.584 -177.317 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -60.97 -40.46 52.28 Favored 'Trans proline' 0 C--O 1.237 0.438 0 CA-C-N 118.305 0.43 . . . . 46.57 112.833 -175.822 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 58.7 mp0 -58.45 -34.72 71.15 Favored 'General case' 0 C--O 1.238 0.496 0 C-N-CA 119.949 -0.7 . . . . 47.08 111.206 178.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' ASP . . . . . 0.417 ' HB2' HD23 ' B' ' 24' ' ' LEU . 25.6 t70 -76.51 -38.48 55.11 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 111.827 0.306 . . . . 46.64 111.827 -177.413 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' GLN . . . . . . . . . . . . . 2.6 mt-30 -53.46 -49.54 67.19 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.094 0.473 . . . . 99.51 110.461 171.607 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -64.62 -31.15 72.25 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 120.056 -0.657 . . . . 42.08 111.295 178.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' HIS . . . . . 0.426 ' O ' HG13 ' B' ' 34' ' ' ILE . 25.6 t-80 -68.76 -42.29 77.7 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-O 120.688 0.28 . . . . 40.67 111.47 171.918 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' PHE . . . . . . . . . . . . . 41.4 t80 -61.23 -42.02 97.89 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 119.918 -0.713 . . . . 53.41 110.135 174.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' ARG . . . . . . . . . . . . . 17.8 ttp180 -60.59 -46.89 88.54 Favored 'General case' 0 C--O 1.238 0.486 0 O-C-N 122.095 -0.378 . . . . 69.15 111.066 -178.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' GLU . . . . . . . . . . . . . 19.9 tp10 -62.77 -36.87 84.51 Favored 'General case' 0 C--O 1.233 0.23 0 O-C-N 121.949 -0.469 . . . . 51.13 111.668 -176.363 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' ILE . . . . . 0.426 HG13 ' O ' ' B' ' 30' ' ' HIS . 2.6 mt -77.11 -34.26 21.37 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 O-C-N 121.78 -0.575 . . . . 31.7 111.642 -172.725 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' THR . . . . . . . . . . . . . 70.7 p -94.83 -24.91 16.84 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 113.098 0.777 . . . . 33.05 113.098 -172.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' MET . . . . . . . . . . . . . 50.5 tpp -50.95 127.88 19.87 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-O 121.373 0.606 . . . . 35.46 112.056 -171.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' GLY . . . . . . . . . . . . . . . 92.05 -13.85 65.91 Favored Glycine 0 N--CA 1.436 -1.332 0 CA-C-N 115.615 -0.72 . . . . 32.4 114.446 177.267 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' HIS . . . . . 0.466 ' CG ' ' HG2' ' B' ' 90' ' ' GLU . 33.1 m-70 -106.13 -173.92 2.41 Favored 'General case' 0 C--N 1.314 -0.976 0 CA-C-N 118.523 1.162 . . . . 33.17 109.338 -173.539 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 22.4 m -82.92 137.56 34.18 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 108.59 -0.893 . . . . 37.07 108.59 172.156 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' ILE . . . . . . . . . . . . . 10.9 pt -114.31 132.66 62.75 Favored 'Isoleucine or valine' 0 C--O 1.24 0.583 0 N-CA-C 108.274 -1.01 . . . . 34.55 108.274 169.014 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 88.7 t -113.82 136.32 50.67 Favored 'Isoleucine or valine' 0 C--O 1.242 0.66 0 N-CA-C 108.342 -0.984 . . . . 34.56 108.342 175.499 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' MET . . . . . 0.441 ' HA ' ' O ' ' B' ' 95' ' ' GLY . 12.7 ptp -148.01 154.51 40.38 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 115.573 -0.739 . . . . 30.03 110.082 -178.019 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' GLY . . . . . . . . . . . . . . . -75.96 157.15 48.35 Favored Glycine 0 C--N 1.353 1.501 0 CA-C-N 115.555 -0.748 . . . . 31.5 112.146 172.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' ARG . . . . . . . . . . . . . 8.7 tmm_? -61.7 -36.62 81.44 Favored 'General case' 0 CA--C 1.515 -0.377 0 C-N-CA 119.469 -0.893 . . . . 50.98 110.878 -173.312 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' ARG . . . . . . . . . . . . . 47.1 mtt85 -62.31 -37.25 84.84 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 119.685 -0.806 . . . . 63.77 111.678 176.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' THR . . . . . . . . . . . . . 6.3 m -68.57 -38.67 80.91 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 119.666 -0.814 . . . . 33.46 111.995 175.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' TRP . . . . . 0.451 ' CE2' ' HB1' ' B' ' 73' ' ' ALA . 13.4 t-105 -65.74 -30.71 71.42 Favored 'General case' 0 N--CA 1.469 0.506 0 O-C-N 121.328 -0.857 . . . . 41.94 111.374 176.008 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' ASP . . . . . . . . . . . . . 66.6 m-20 -66.32 -31.15 71.77 Favored 'General case' 0 C--O 1.239 0.517 0 C-N-CA 120.072 -0.651 . . . . 45.66 111.39 176.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' SER . . . . . . . . . . . . . 74.2 p -82.57 -13.13 57.1 Favored 'General case' 0 C--N 1.349 0.566 0 N-CA-C 112.937 0.717 . . . . 40.8 112.937 -174.329 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.411 ' O ' ' HD3' ' B' ' 55' ' ' ARG . 35.0 mt -73.87 114.37 31.95 Favored Pre-proline 0 C--O 1.239 0.511 0 CA-C-N 118.135 0.425 . . . . 42.08 110.106 170.921 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' PRO . . . . . . . . . . . . . 9.3 Cg_endo -53.53 150.31 27.98 Favored 'Trans proline' 0 C--N 1.331 -0.362 0 CA-C-N 119.462 0.844 . . . . 57.97 110.807 177.292 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' ALA . . . . . . . . . . . . . . . -62.36 -22.0 65.77 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.021 -0.672 . . . . 71.76 112.185 -169.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' LYS . . . . . . . . . . . . . 8.7 pttm -65.68 -50.1 66.15 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-O 120.89 0.376 . . . . 90.33 111.62 177.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' VAL . . . . . 0.4 HG12 ' O ' ' B' ' 54' ' ' VAL . 2.6 t -79.85 -5.79 8.69 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.474 0 C-N-CA 120.003 -0.679 . . . . 61.97 112.616 -176.385 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' ARG . . . . . 0.411 ' HD3' ' O ' ' B' ' 50' ' ' LEU . 8.6 ptt180 -112.3 145.5 32.98 Favored Pre-proline 0 C--N 1.288 -2.09 1 C-N-CA 109.575 -4.85 . . . . 47.9 109.689 179.79 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -67.71 154.62 86.9 Favored 'Cis proline' 0 C--O 1.235 0.339 0 CA-C-N 118.349 0.446 . . . . 41.51 111.755 -0.162 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' LEU . . . . . . . . . . . . . 55.7 mt -66.75 128.7 93.97 Favored Pre-proline 0 C--N 1.322 -0.596 0 C-N-CA 119.863 -0.735 . . . . 36.73 109.302 175.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' PRO . . . . . . . . . . . . . 44.2 Cg_exo -66.22 144.2 73.9 Favored 'Trans proline' 0 N--CA 1.475 0.41 0 CA-C-N 119.27 0.775 . . . . 36.33 113.433 -170.446 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 79.81 1.87 87.66 Favored Glycine 0 C--N 1.339 0.735 0 N-CA-C 115.272 0.869 . . . . 29.56 115.272 172.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' ARG . . . . . . . . . . . . . 33.2 mtm180 -122.93 155.93 35.72 Favored 'General case' 0 C--N 1.325 -0.465 0 CA-C-N 117.853 0.827 . . . . 36.58 109.312 179.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' ARG . . . . . . . . . . . . . 47.6 ttt180 -90.34 97.92 11.47 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 107.531 -1.285 . . . . 46.13 107.531 176.657 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' ASN . . . . . . . . . . . . . 1.6 m-80 -76.49 121.34 22.97 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 123.58 0.752 . . . . 39.31 111.029 -176.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' VAL . . . . . . . . . . . . . 20.3 t -121.95 132.18 71.48 Favored 'Isoleucine or valine' 0 C--O 1.236 0.379 0 N-CA-C 107.69 -1.226 . . . . 37.49 107.69 175.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' VAL . . . . . . . . . . . . . 25.2 t -115.01 131.15 68.11 Favored 'Isoleucine or valine' 0 C--O 1.235 0.32 0 N-CA-C 108.779 -0.823 . . . . 35.15 108.779 178.278 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' LEU . . . . . . . . . . . . . 43.9 tp -102.19 128.07 48.85 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 116.287 -0.415 . . . . 46.13 110.195 -177.588 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' SER . . . . . 0.653 ' O ' ' O ' ' B' ' 404' ' ' HOH . 40.8 t -152.61 145.59 24.5 Favored 'General case' 0 C--O 1.237 0.403 0 CA-C-O 121.722 0.772 . . . . 50.98 109.875 -174.697 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' ARG . . . . . 1.2 ' HG2' ' O2X' ' B' ' 302' ' ' NDP . 8.8 ptm180 -81.59 -22.29 37.82 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 113.915 -1.493 . . . . 73.2 112.41 172.92 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' GLN . . . . . . . . . . . . . 45.7 tt0 -64.13 121.34 13.98 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 123.894 0.877 . . . . 60.69 109.916 170.885 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -70.52 -36.14 73.58 Favored 'General case' 0 C--O 1.234 0.28 0 N-CA-C 112.053 0.39 . . . . 63.86 112.053 -171.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -97.43 0.79 48.32 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 113.433 0.901 . . . . 71.86 113.433 -174.174 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' PHE . . . . . . . . . . . . . 49.5 t80 -57.95 132.15 52.57 Favored 'General case' 0 CA--C 1.516 -0.336 0 CA-C-N 118.609 0.64 . . . . 58.25 110.2 -170.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' MET . . . . . . . . . . . . . 34.2 ttp -114.93 136.71 52.81 Favored 'General case' 0 C--N 1.324 -0.504 0 N-CA-C 109.392 -0.595 . . . . 70.58 109.392 177.216 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' ALA . . . . . 0.451 ' HB1' ' CE2' ' B' ' 47' ' ' TRP . . . -124.89 110.14 13.89 Favored 'General case' 0 C--N 1.327 -0.408 0 N-CA-C 107.679 -1.23 . . . . 44.57 107.679 173.936 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' SER . . . . . . . . . . . . . 15.1 m -59.9 110.96 1.3 Allowed 'General case' 0 C--O 1.236 0.349 0 C-N-CA 122.587 0.355 . . . . 42.87 111.831 -179.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' GLY . . . . . . . . . . . . . . . 102.74 -8.26 54.25 Favored Glycine 0 N--CA 1.443 -0.89 0 CA-C-O 118.877 -0.957 . . . . 37.2 114.308 -179.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' ALA . . . . . . . . . . . . . . . -130.0 153.78 48.06 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 118.491 1.145 . . . . 42.5 110.666 -179.679 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' GLU . . . . . . . . . . . . . 86.2 mt-10 -84.78 136.31 33.75 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 114.57 -1.195 . . . . 52.93 109.661 172.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' VAL . . . . . . . . . . . . . 46.1 t -109.99 128.56 66.04 Favored 'Isoleucine or valine' 0 C--O 1.236 0.348 0 N-CA-C 107.546 -1.279 . . . . 42.45 107.546 -177.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' VAL . . . . . . . . . . . . . 22.3 m -127.99 168.0 21.99 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.184 0 N-CA-C 108.289 -1.004 . . . . 47.22 108.289 179.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' GLY . . . . . . . . . . . . . . . -115.13 1.05 22.63 Favored Glycine 0 C--O 1.239 0.459 0 CA-C-N 115.553 -0.748 . . . . 52.72 113.766 -174.031 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' SER . . . . . 0.444 ' OG ' ' OE2' ' B' ' 84' ' ' GLU . 29.7 p -149.74 137.27 19.99 Favored 'General case' 0 CA--C 1.515 -0.367 0 N-CA-C 107.628 -1.249 . . . . 55.73 107.628 175.927 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' LEU . . . . . 0.408 ' O ' ' HG ' ' B' ' 86' ' ' LEU . 28.7 tp -52.2 -33.36 40.61 Favored 'General case' 0 C--O 1.235 0.316 0 C-N-CA 119.997 -0.681 . . . . 56.29 111.456 178.628 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' GLU . . . . . 0.593 ' OE2' ' N ' ' B' ' 83' ' ' GLU . 18.7 mp0 -65.06 -35.74 82.12 Favored 'General case' 0 C--N 1.328 -0.347 0 C-N-CA 120.263 -0.575 . . . . 69.65 110.914 -175.023 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' GLU . . . . . 0.444 ' OE2' ' OG ' ' B' ' 81' ' ' SER . 6.8 mt-10 -57.71 -42.48 83.83 Favored 'General case' 0 CA--C 1.515 -0.369 0 C-N-CA 120.007 -0.677 . . . . 59.75 110.444 170.739 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' ALA . . . . . . . . . . . . . . . -64.6 -22.76 67.06 Favored 'General case' 0 C--O 1.236 0.347 0 CA-C-N 116.365 -0.379 . . . . 57.07 111.969 -174.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' LEU . . . . . 0.408 ' HG ' ' O ' ' B' ' 82' ' ' LEU . 13.5 mt -94.81 79.16 3.69 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 122.595 1.188 . . . . 67.71 109.268 -177.78 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 67.4 p -110.69 -32.65 6.8 Favored 'General case' 0 CA--C 1.516 -0.342 0 CA-C-N 115.433 -0.803 . . . . 80.75 112.532 173.033 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' SER . . . . . . . . . . . . . 10.9 t -74.9 150.82 86.28 Favored Pre-proline 0 C--N 1.346 0.456 0 CA-C-O 120.734 0.302 . . . . 75.32 110.382 174.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo -85.76 -10.6 7.21 Favored 'Trans proline' 0 C--O 1.238 0.512 0 N-CA-C 114.702 1.001 . . . . 70.32 114.702 -179.923 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' GLU . . . . . 0.466 ' HG2' ' CG ' ' B' ' 38' ' ' HIS . 5.0 tt0 -120.75 101.57 7.81 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 106.511 -1.663 . . . . 55.14 106.511 162.194 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' THR . . . . . . . . . . . . . 59.0 m -115.15 143.55 45.05 Favored 'General case' 0 N--CA 1.448 -0.539 0 N-CA-C 108.299 -1.0 . . . . 45.17 108.299 178.274 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' TRP . . . . . . . . . . . . . 80.6 m95 -125.67 115.99 20.97 Favored 'General case' 0 C--O 1.24 0.565 0 N-CA-C 109.38 -0.6 . . . . 37.88 109.38 176.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' VAL . . . . . . . . . . . . . 37.2 t -77.33 122.67 32.47 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 N-CA-C 108.213 -1.032 . . . . 35.03 108.213 173.232 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' ILE . . . . . . . . . . . . . 23.4 pt -112.95 12.18 8.33 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.323 0 C-N-CA 119.146 -1.022 . . . . 37.52 112.384 -171.141 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' GLY . . . . . 0.441 ' O ' ' HA ' ' B' ' 42' ' ' MET . . . 119.76 175.13 15.73 Favored Glycine 0 C--N 1.335 0.515 0 CA-C-O 121.852 0.696 . . . . 31.52 112.525 177.425 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' GLY . . . . . . . . . . . . . . . -101.57 -149.88 23.07 Favored Glycine 0 C--O 1.243 0.685 0 C-N-CA 123.205 0.431 . . . . 32.18 112.768 1.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' GLY . . . . . . . . . . . . . . . -54.45 -38.58 63.11 Favored Glycine 0 C--N 1.339 0.708 0 C-N-CA 120.577 -0.82 . . . . 29.51 112.628 -168.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' GLN . . . . . . . . . . . . . 63.4 mt-30 -67.25 -42.03 84.6 Favored 'General case' 0 C--O 1.243 0.722 0 C-N-CA 119.728 -0.789 . . . . 51.08 111.423 177.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' VAL . . . . . . . . . . . . . 54.8 t -74.79 -38.41 44.27 Favored 'Isoleucine or valine' 0 C--O 1.236 0.367 0 C-N-CA 119.245 -0.982 . . . . 35.44 110.756 -175.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' TYR . . . . . 0.457 ' HB3' ' CG ' ' B' ' 129' ' ' PRO . 13.6 m-85 -52.44 -50.71 62.07 Favored 'General case' 0 CA--C 1.518 -0.279 0 C-N-CA 119.397 -0.921 . . . . 31.6 110.947 173.144 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' ALA . . . . . . . . . . . . . . . -65.5 -36.94 85.32 Favored 'General case' 0 C--N 1.325 -0.5 0 C-N-CA 119.079 -1.048 . . . . 36.09 110.552 -176.606 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' LEU . . . . . . . . . . . . . 49.2 tp -64.83 -33.18 75.39 Favored 'General case' 0 C--O 1.239 0.503 0 C-N-CA 119.955 -0.698 . . . . 42.2 112.269 177.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' ALA . . . . . . . . . . . . . . . -87.22 -28.72 22.21 Favored 'General case' 0 C--N 1.343 0.308 0 N-CA-C 115.043 1.497 . . . . 37.82 115.043 -172.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' LEU . . . . . . . . . . . . . 14.2 tp -52.16 -38.39 53.4 Favored Pre-proline 0 C--O 1.246 0.914 0 N-CA-C 115.519 1.674 . . . . 41.26 115.519 -170.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' PRO . . . . . . . . . . . . . 38.6 Cg_exo -63.48 -18.64 65.39 Favored 'Trans proline' 0 CA--C 1.512 -0.584 0 CA-C-N 122.159 1.807 . . . . 45.26 113.188 176.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' TYR . . . . . . . . . . . . . 60.5 m-85 -102.61 11.14 38.2 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 118.255 0.479 . . . . 76.34 112.093 179.132 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' ALA . . . . . . . . . . . . . . . -103.87 148.14 26.49 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-O 121.378 0.609 . . . . 41.36 110.917 -174.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' THR . . . . . . . . . . . . . 6.5 t -112.31 -14.92 13.26 Favored 'General case' 0 N--CA 1.448 -0.561 0 CA-C-N 114.929 -1.032 . . . . 48.6 113.173 171.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' ARG . . . . . 0.696 ' N ' ' O ' ' B' ' 401' ' ' HOH . 75.7 mtp180 -139.98 138.34 35.43 Favored 'General case' 0 C--N 1.346 0.42 0 C-N-CA 124.176 0.991 . . . . 42.75 110.15 -176.634 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' CYS . . . . . . . . . . . . . 84.8 m -124.92 129.1 49.69 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 108.234 -1.024 . . . . 38.28 108.234 166.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 76.5 mm-40 -108.69 109.5 20.69 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 106.949 -1.5 . . . . 40.87 106.949 174.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' VAL . . . . . 0.429 ' HB ' ' HB2' ' B' ' 154' ' ' TYR . 70.4 t -111.05 126.13 68.42 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.476 0 C-N-CA 123.522 0.729 . . . . 39.42 109.139 -168.782 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' THR . . . . . . . . . . . . . 56.7 m -100.11 116.87 33.14 Favored 'General case' 0 C--N 1.324 -0.518 0 N-CA-C 107.613 -1.254 . . . . 39.02 107.613 167.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -101.17 118.28 36.68 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 108.683 -0.858 . . . . 45.2 108.683 178.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' VAL . . . . . . . . . . . . . 17.0 t -97.29 123.48 49.68 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.393 0 N-CA-C 108.571 -0.9 . . . . 35.29 108.571 -178.275 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -77.04 77.69 3.58 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-O 122.961 1.363 . . . . 44.86 109.149 177.775 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' ILE . . . . . 0.705 ' O ' ' O ' ' B' ' 402' ' ' HOH . 3.2 tt -126.17 140.59 48.24 Favored 'Isoleucine or valine' 0 C--O 1.24 0.561 0 N-CA-C 107.569 -1.271 . . . . 45.53 107.569 179.907 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' GLY . . . . . . . . . . . . . . . -87.59 58.73 4.39 Favored Glycine 0 C--O 1.238 0.358 0 C-N-CA 120.184 -1.008 . . . . 51.32 113.789 -177.645 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 1.1 tt -103.98 106.74 54.44 Favored Pre-proline 0 C--O 1.244 0.767 0 C-N-CA 123.737 0.815 . . . . 43.54 110.12 -171.047 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo -77.75 153.1 29.54 Favored 'Trans proline' 0 C--O 1.235 0.347 0 CA-C-O 122.29 0.871 . . . . 42.47 113.08 -177.087 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' ARG . . . . . . . . . . . . . 77.5 mtm-85 -65.18 120.26 12.38 Favored 'General case' 0 N--CA 1.45 -0.455 0 CA-C-N 114.218 -1.355 . . . . 54.41 110.805 178.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' GLU . . . . . . . . . . . . . 26.7 tp10 -108.69 143.43 37.8 Favored 'General case' 0 C--N 1.324 -0.537 0 N-CA-C 108.441 -0.948 . . . . 44.36 108.441 177.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' ALA . . . . . . . . . . . . . . . -50.54 140.37 14.22 Favored 'General case' 0 C--N 1.329 -0.325 0 C-N-CA 119.784 -0.766 . . . . 37.13 109.906 174.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' GLY . . . . . . . . . . . . . . . 82.24 -8.32 61.36 Favored Glycine 0 N--CA 1.444 -0.812 0 N-CA-C 115.558 0.983 . . . . 40.93 115.558 -177.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' ASP . . . . . . . . . . . . . 74.2 m-20 -61.76 146.05 50.62 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 118.709 1.255 . . . . 39.73 110.818 175.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' ALA . . . . . . . . . . . . . . . -81.44 134.88 35.61 Favored 'General case' 0 C--N 1.331 -0.239 0 N-CA-C 108.719 -0.845 . . . . 35.72 108.719 165.532 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' LEU . . . . . . . . . . . . . 41.7 mt -116.21 149.02 39.81 Favored 'General case' 0 C--O 1.238 0.476 0 C-N-CA 124.053 0.941 . . . . 40.98 112.719 -176.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' ALA . . . . . . . . . . . . . . . -69.01 143.59 94.62 Favored Pre-proline 0 C--N 1.354 0.786 0 CA-C-N 115.554 -0.748 . . . . 35.85 111.435 167.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' PRO . . . . . 0.457 ' CG ' ' HB3' ' B' ' 100' ' ' TYR . 25.6 Cg_exo -56.85 155.99 25.29 Favored 'Trans proline' 0 N--CA 1.474 0.33 0 N-CA-C 110.801 -0.5 . . . . 36.7 110.801 170.801 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' VAL . . . . . . . . . . . . . 2.4 t -103.46 131.69 51.42 Favored 'Isoleucine or valine' 0 C--O 1.24 0.575 0 N-CA-C 108.505 -0.924 . . . . 53.84 108.505 176.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' LEU . . . . . . . . . . . . . 14.8 mt -101.08 125.12 47.68 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-N 115.546 -0.752 . . . . 51.44 109.7 -173.243 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' ASP . . . . . . . . . . . . . 9.2 p30 -76.37 -151.9 0.04 OUTLIER 'General case' 0 C--O 1.237 0.413 0 C-N-CA 118.942 -1.103 . . . . 54.64 111.786 -176.24 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -74.7 -30.83 61.68 Favored 'General case' 0 C--O 1.239 0.531 0 N-CA-C 112.569 0.581 . . . . 72.05 112.569 177.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 134' ' ' THR . . . . . . . . . . . . . 1.6 p -67.19 -5.43 13.68 Favored 'General case' 0 N--CA 1.454 -0.265 0 N-CA-C 113.332 0.864 . . . . 55.27 113.332 -175.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 135' ' ' TRP . . . . . . . . . . . . . 94.0 m95 -102.82 117.4 34.55 Favored 'General case' 0 CA--C 1.52 -0.193 0 N-CA-C 108.523 -0.917 . . . . 54.0 108.523 176.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 136' ' ' ARG . . . . . . . . . . . . . 6.8 mmm180 -117.78 136.16 53.58 Favored 'General case' 0 C--O 1.234 0.262 0 N-CA-C 110.098 -0.334 . . . . 72.67 110.098 -176.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 137' ' ' GLY . . . . . . . . . . . . . . . -169.41 171.6 43.2 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 119.474 -1.346 . . . . 68.35 112.173 178.476 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 138' ' ' GLU . . . . . . . . . . . . . . . -85.58 148.32 25.98 Favored 'General case' 0 N--CA 1.452 -0.364 0 CA-C-N 114.491 -0.855 . . . . 72.61 110.057 -176.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 139' ' ' THR . . . . . . . . . . . . . 19.9 m -98.06 90.1 4.77 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 106.192 -1.781 . . . . 72.47 106.192 175.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 140' ' ' GLY . . . . . . . . . . . . . . . -49.19 153.63 2.53 Favored Glycine 0 C--N 1.337 0.614 0 CA-C-N 115.437 -0.801 . . . . 64.67 112.668 178.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 141' ' ' GLU . . . . . . . . . . . . . 7.0 mm-40 -74.44 161.7 29.56 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 118.341 -1.344 . . . . 77.96 110.687 -177.766 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 142' ' ' TRP . . . . . . . . . . . . . 23.0 m95 -66.39 141.2 58.03 Favored 'General case' 0 N--CA 1.456 -0.142 0 CA-C-N 115.657 -0.701 . . . . 58.54 109.838 176.894 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 143' ' ' ARG . . . . . . . . . . . . . 2.0 mtt180 -130.6 166.13 21.3 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 109.265 -0.643 . . . . 59.93 109.265 177.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 144' ' ' PHE . . . . . . . . . . . . . 53.3 m-85 -120.3 120.89 37.37 Favored 'General case' 0 C--O 1.236 0.355 0 O-C-N 121.83 -0.544 . . . . 68.29 109.913 -177.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 145' ' ' SER . . . . . . . . . . . . . 42.3 t -78.4 155.0 30.21 Favored 'General case' 0 N--CA 1.448 -0.539 0 CA-C-O 121.606 0.717 . . . . 49.54 110.536 178.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 146' ' ' ARG . . . . . . . . . . . . . 10.8 ptt180 -70.69 4.54 2.4 Favored 'General case' 0 C--O 1.24 0.589 0 CA-C-N 115.169 -0.923 . . . . 65.61 112.391 168.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 147' ' ' SER . . . . . . . . . . . . . 42.9 p -95.88 -14.29 23.27 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 124.215 1.006 . . . . 54.14 112.427 170.642 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 148' ' ' GLY . . . . . . . . . . . . . . . 104.25 1.72 44.54 Favored Glycine 0 N--CA 1.445 -0.711 0 N-CA-C 115.209 0.843 . . . . 56.46 115.209 174.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 149' ' ' LEU . . . . . . . . . . . . . 3.2 mt -108.85 149.73 28.69 Favored 'General case' 0 C--N 1.327 -0.39 0 CA-C-N 118.213 1.007 . . . . 53.53 110.02 -179.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 150' ' ' ARG . . . . . . . . . . . . . 3.8 ttp180 -83.48 149.8 26.41 Favored 'General case' 0 N--CA 1.452 -0.348 0 CA-C-N 115.29 -0.868 . . . . 61.42 110.265 172.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 151' ' ' TYR . . . . . . . . . . . . . 29.4 p90 -161.12 150.05 16.4 Favored 'General case' 0 CA--C 1.517 -0.3 0 CA-C-O 121.065 0.46 . . . . 57.3 110.246 -177.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 152' ' ' ARG . . . . . . . . . . . . . 24.3 ptt180 -141.21 167.46 22.13 Favored 'General case' 0 N--CA 1.449 -0.517 0 C-N-CA 118.428 -1.309 . . . . 57.06 109.734 175.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 153' ' ' LEU . . . . . 0.459 HD22 ' HG2' ' A' ' 138' ' ' GLU . 9.8 mp -116.26 139.5 50.31 Favored 'General case' 0 N--CA 1.453 -0.286 0 CA-C-N 115.387 -0.824 . . . . 52.13 110.463 -170.668 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 154' ' ' TYR . . . . . 0.429 ' HB2' ' HB ' ' B' ' 112' ' ' VAL . 35.5 m-85 -123.2 127.29 48.41 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 107.384 -1.339 . . . . 57.27 107.384 174.4 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 155' ' ' SER . . . . . . . . . . . . . 40.1 m -111.56 121.67 45.78 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 108.248 -1.019 . . . . 48.27 108.248 171.061 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 156' ' ' TYR . . . . . . . . . . . . . 82.6 m-85 -113.25 137.98 50.68 Favored 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 122.461 0.304 . . . . 56.82 110.561 -175.25 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 157' ' ' HIS . . . . . . . . . . . . . 44.7 t-80 -125.09 144.42 50.43 Favored 'General case' 0 N--CA 1.446 -0.668 0 N-CA-C 108.751 -0.833 . . . . 46.9 108.751 170.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 158' ' ' ARG . . . . . 0.477 ' NH1' ' O ' ' B' ' 403' ' ' HOH . 30.0 ttp180 -129.33 112.81 14.24 Favored 'General case' 0 C--N 1.321 -0.657 0 N-CA-C 105.789 -1.93 . . . . 54.49 105.789 176.155 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 159' ' ' SER . . . . . . . . . . . . . 5.0 m . . . . . 0 C--N 1.322 -0.607 0 N-CA-C 109.091 -0.707 . . . . 71.58 109.091 -179.893 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' NDP . . . . . 0.854 ' O3 ' ' HD3' ' A' ' 45' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' RQ1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' PO4 . . . . . 0.858 ' O3 ' ' O ' ' A' ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 301' ' ' ' CO' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 302' ' ' NDP . . . . . 1.2 ' O2X' ' HG2' ' B' ' 67' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 303' ' ' ' CO' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 304' ' ' RQ1 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 305' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 306' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 307' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . 0.858 ' O ' ' O3 ' ' A' ' 204' ' ' PO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . 0.708 ' O ' ' OE1' ' A' ' 68' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . 0.719 ' O ' ' O ' ' A' ' 52' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . 0.649 ' O ' ' O ' ' A' ' 120' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' HOH . . . . . 0.606 ' O ' ' O ' ' A' ' 85' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 309' ' ' HOH . . . . . 0.432 ' O ' ' NH2' ' A' ' 143' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 331' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 332' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 333' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 336' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 337' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 338' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 340' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 341' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 343' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 344' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 345' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 347' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 348' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 349' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 350' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 351' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 401' ' ' HOH . . . . . 0.804 ' O ' ' O ' ' B' ' 2' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 402' ' ' HOH . . . . . 0.705 ' O ' ' O ' ' B' ' 117' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 403' ' ' HOH . . . . . 0.477 ' O ' ' NH1' ' B' ' 158' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 404' ' ' HOH . . . . . 0.653 ' O ' ' O ' ' B' ' 66' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 0 . 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 stop_ save_