data_1pkr_residue 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 1pkr _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 0' ' ' GLU . . . . . 0.84 ' N ' ' O ' ' A' ' 522' ' ' HOH 0.332 40.8 mp0 . . . . . 0 N--CA 1.431 -1.384 0 CA-C-O 122.321 1.058 . . . . 35.0 108.777 . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' CYS . . . . . 0.567 ' O ' ' O ' ' A' ' 702' ' ' HOH . 24.6 p -156.83 160.62 39.36 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 100.231 -3.989 . . . . 35.0 100.231 176.737 67.538 126.803 -43.389 108.576 2.016 110.669 107.67 -147.241 2 2 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' LYS . . . . . 0.8 ' O ' ' CB ' ' A' ' 80' ' ' CYS . 20.7 ttpt -118.25 157.94 26.09 Favored 'General case' 0 C--N 1.32 -0.683 0 O-C-N 128.055 3.347 . . . . 35.0 108.452 -178.287 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -156.97 124.35 5.3 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 102.731 -3.063 . . . . 35.0 102.731 177.378 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 82.04 -155.67 35.09 Favored Glycine 0 N--CA 1.49 2.254 1 O-C-N 129.769 4.418 . . . . 35.0 110.822 179.985 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ASN . . . . . 0.504 ' N ' ' ND2' ' A' ' 5' ' ' ASN . 0.0 OUTLIER -71.91 2.54 5.41 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 107.496 -1.298 . . . . 34.84 107.496 -179.779 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 74.63 36.58 48.19 Favored Glycine 0 C--N 1.301 -1.39 0 N-CA-C 110.24 -1.144 . . . . 30.75 110.24 -179.536 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.8 tptt -64.09 -39.89 95.05 Favored 'General case' 0 C--O 1.261 1.663 0 N-CA-C 117.57 2.433 . . . . 35.0 117.57 179.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ASN . . . . . . . . . . . . . 3.8 m120 -97.23 8.33 44.77 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-O 117.635 -1.174 . . . . 34.63 111.644 -177.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' TYR . . . . . . . . . . . . . 88.9 t80 -63.03 114.47 3.72 Favored 'General case' 0 C--N 1.314 -0.971 1 O-C-N 129.262 4.101 . . . . 28.01 111.289 -177.18 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ARG . . . . . . . . . . . . . 27.0 mmt-85 -119.45 34.92 5.02 Favored 'General case' 0 C--O 1.247 0.951 1 O-C-N 129.59 4.306 . . . . 29.1 109.716 177.242 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLY . . . . . 0.521 ' O ' ' NH2' ' A' ' 52' ' ' ARG . . . -66.77 -175.06 6.65 Favored Glycine 0 N--CA 1.433 -1.552 0 O-C-N 126.045 2.09 . . . . 25.38 110.874 179.331 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' THR . . . . . 0.549 ' O ' ' CG2' ' A' ' 12' ' ' THR . 0.6 OUTLIER -118.93 10.87 12.37 Favored 'General case' 0 C--O 1.267 2.01 0 N-CA-C 119.862 3.282 . . . . 27.88 119.862 -176.052 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 58.3 mmm -71.12 137.78 49.13 Favored 'General case' 0 C--N 1.309 -1.162 0 O-C-N 126.198 2.186 . . . . 35.0 107.932 178.496 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.1 p -132.98 20.75 4.11 Favored 'General case' 0 C--N 1.326 -0.422 1 O-C-N 130.442 4.839 . . . . 30.86 116.02 -178.79 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 7.8 pttt -137.01 150.77 48.31 Favored 'General case' 0 C--N 1.306 -1.326 0 CA-C-O 127.134 3.349 . . . . 24.72 106.273 179.043 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' THR . . . . . 0.451 ' OG1' ' O ' ' A' ' 118' ' ' HOH . 1.3 p -83.62 177.61 8.33 Favored 'General case' 0 N--CA 1.486 1.366 0 CA-C-N 111.674 -2.512 . . . . 27.04 108.666 -178.099 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.4 pttt -54.99 -18.72 5.44 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 111.349 -2.659 . . . . 32.36 113.907 178.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -111.81 23.81 13.41 Favored 'General case' 0 C--O 1.251 1.164 0 C-N-CA 128.726 2.81 . . . . 35.0 111.566 179.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.42 26.19 56.24 Favored Glycine 0 C--O 1.254 1.386 0 O-C-N 127.117 2.761 . . . . 31.88 118.4 177.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ILE . . . . . 0.519 ' CD1' ' CB ' ' A' ' 67' ' ' ASP 0.402 4.7 tt -104.69 134.64 45.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 N-CA-C 102.62 -3.104 . . . . 31.61 102.62 176.137 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' THR . . . . . 0.449 ' O ' ' OG1' ' A' ' 66' ' ' THR 0.275 0.4 OUTLIER -72.98 135.61 45.0 Favored 'General case' 0 C--O 1.251 1.167 0 CA-C-N 111.424 -2.625 . . . . 29.59 116.52 -176.922 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 77.2 m -63.82 149.03 47.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 110.978 -2.828 . . . . 25.41 113.482 -179.673 -60.938 -80.801 -75.904 103.863 2.042 102.646 -176.0 72.848 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 26.4 tt0 -92.34 139.07 30.97 Favored 'General case' 0 C--O 1.277 2.529 0 O-C-N 126.46 2.35 . . . . 26.85 108.672 177.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 3.7 mmmt -60.81 132.79 54.98 Favored 'General case' 0 N--CA 1.503 2.199 0 N-CA-C 105.815 -1.92 . . . . 31.67 105.815 -179.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -64.3 -17.93 64.12 Favored 'General case' 0 C--O 1.254 1.325 0 C-N-CA 126.623 1.969 . . . . 28.66 110.015 179.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.57 -36.03 22.39 Favored 'General case' 0 N--CA 1.481 1.121 0 O-C-N 125.909 2.005 . . . . 30.2 109.386 179.184 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.9 t -65.33 156.49 31.97 Favored 'General case' 0 C--N 1.301 -1.515 0 C-N-CA 128.792 2.837 . . . . 29.86 112.967 -179.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 66.2 p -123.41 26.99 7.65 Favored 'General case' 0 C--O 1.252 1.205 0 N-CA-C 116.294 1.961 . . . . 34.62 116.294 -178.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' SER . . . . . . . . . . . . . 4.5 p -155.45 149.81 19.82 Favored Pre-proline 0 C--N 1.309 -1.186 0 C-N-CA 126.117 1.767 . . . . 35.0 107.624 177.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -69.85 -16.9 12.28 Favored 'Cis proline' 0 CA--C 1.543 0.939 0 N-CA-C 107.77 -1.665 . . . . 35.0 107.77 1.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 11.8 m80 -111.23 153.0 26.47 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 114.124 1.157 . . . . 32.06 114.124 -178.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ARG . . . . . . . . . . . . . 4.4 ttm180 -101.57 111.52 63.97 Favored Pre-proline 0 C--N 1.319 -0.745 0 N-CA-C 107.365 -1.346 . . . . 35.0 107.365 177.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -72.84 142.08 34.69 Favored 'Trans proline' 0 C--O 1.248 0.983 0 CA-C-O 125.216 2.09 . . . . 32.4 111.926 -178.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ARG . . . . . 0.571 ' NE ' ' NH1' ' A' ' 71' ' ' ARG . 0.9 OUTLIER -88.25 -10.86 48.31 Favored 'General case' 0 C--O 1.246 0.879 0 C-N-CA 129.313 3.045 . . . . 35.0 108.308 -179.853 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' PHE . . . . . 0.573 ' CE2' 'CL ' ' A' ' 91' ' ' ' CL' . 71.2 m-85 -135.67 139.59 43.84 Favored 'General case' 0 C--O 1.247 0.944 0 O-C-N 125.708 1.88 . . . . 30.56 107.232 178.63 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 24.9 p -157.0 167.72 13.96 Favored Pre-proline 0 N--CA 1.484 1.238 0 O-C-N 125.517 1.76 . . . . 31.26 110.763 178.026 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -61.45 -21.92 73.17 Favored 'Trans proline' 0 C--O 1.26 1.616 0 C-N-CA 122.806 2.337 . . . . 29.79 113.434 179.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -81.18 -26.94 35.61 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 113.713 1.005 . . . . 31.79 113.713 -179.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' THR . . . . . 0.868 ' CG2' ' CE1' ' A' ' 41' ' ' HIS . 1.0 OUTLIER -102.48 -33.69 9.42 Favored 'General case' 0 C--N 1.312 -1.032 0 N-CA-C 116.57 2.063 . . . . 31.94 116.57 -178.308 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' HIS . . . . . 0.868 ' CE1' ' CG2' ' A' ' 40' ' ' THR . 2.9 m80 -126.99 67.98 70.86 Favored Pre-proline 0 N--CA 1.474 0.738 0 C-N-CA 127.265 2.226 . . . . 32.88 109.056 179.991 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -58.89 -27.58 84.84 Favored 'Trans proline' 0 C--O 1.24 0.586 0 O-C-N 128.336 3.808 . . . . 32.93 115.616 -177.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . 0.279 54.8 p -85.21 1.9 46.1 Favored 'General case' 0 C--O 1.27 2.15 0 C-N-CA 126.693 1.997 . . . . 32.48 114.902 177.845 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -96.57 0.31 49.84 Favored 'General case' 0 CA--C 1.488 -1.408 0 N-CA-C 120.915 3.672 . . . . 32.08 120.915 -176.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLY . . . . . 0.509 ' O ' ' CD ' ' A' ' 52' ' ' ARG . . . 71.34 35.07 63.63 Favored Glycine 0 CA--C 1.531 1.085 0 CA-C-N 122.833 2.561 . . . . 29.36 115.964 175.461 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -81.85 53.39 2.16 Favored 'General case' 0 C--N 1.311 -1.072 0 O-C-N 124.383 0.696 . . . . 28.05 112.337 -177.608 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -100.4 140.5 34.56 Favored 'General case' 0 C--O 1.249 1.073 0 O-C-N 124.883 1.365 . . . . 35.0 111.514 -179.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 52.7 mm-40 58.57 -134.98 0.96 Allowed 'General case' 0 C--O 1.259 1.559 0 O-C-N 126.622 2.451 . . . . 35.0 108.916 179.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 25.9 p-10 -129.04 45.76 2.74 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 126.053 2.096 . . . . 25.96 107.529 -178.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -92.77 157.04 16.63 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.799 -1.091 . . . . 22.73 110.709 -179.153 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 65.6 m -71.09 115.84 10.7 Favored 'General case' 0 C--N 1.304 -1.411 0 C-N-CA 130.826 3.65 . . . . 22.15 107.994 178.989 -57.668 -116.479 -69.507 103.303 2.036 103.948 -160.504 -64.265 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ARG . . . . . 0.521 ' NH2' ' O ' ' A' ' 11' ' ' GLY . 6.7 mmp_? -128.08 -174.36 3.19 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 114.374 -1.284 . . . . 24.73 108.808 178.486 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 63.6 t-20 -149.03 70.87 10.19 Favored Pre-proline 0 N--CA 1.478 0.951 0 N-CA-C 107.526 -1.287 . . . . 28.31 107.526 178.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -65.8 -11.62 31.61 Favored 'Trans proline' 0 C--O 1.246 0.908 0 C-N-CA 123.812 3.008 . . . . 25.97 114.599 -177.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . 0.266 17.7 p-10 -125.82 16.48 8.03 Favored 'General case' 0 C--O 1.258 1.542 1 O-C-N 130.504 4.877 . . . . 33.2 116.289 -174.081 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ASN . . . . . . . . . . . . 0.276 10.1 t-20 52.03 44.29 29.66 Favored 'General case' 0 C--O 1.263 1.793 0 CA-C-O 124.793 2.235 . . . . 31.84 110.943 177.879 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ASP . . . . . 0.458 ' OD2' ' OH ' ' A' ' 74' ' ' TYR . 25.5 t0 -63.64 134.5 95.9 Favored Pre-proline 0 C--O 1.251 1.164 0 N-CA-C 102.831 -3.026 . . . . 26.42 102.831 177.279 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -72.7 -17.19 26.28 Favored 'Trans proline' 0 C--O 1.259 1.548 0 O-C-N 125.593 2.365 . . . . 26.16 113.654 -175.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . 0.253 28.5 mt-30 -88.81 -6.37 57.41 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-O 117.481 -1.247 . . . . 23.04 113.325 -179.678 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . 93.13 -172.48 33.58 Favored Glycine 0 N--CA 1.467 0.739 0 O-C-N 126.473 2.358 . . . . 22.06 113.94 178.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -48.86 127.79 17.54 Favored 'Trans proline' 0 C--O 1.255 1.341 0 O-C-N 128.199 3.736 . . . . 22.14 119.581 178.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 67.8 p-90 -137.91 -179.89 6.03 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 111.574 -2.557 . . . . 20.03 105.015 -178.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 16.5 p -163.37 159.89 22.95 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-O 124.789 2.233 . . . . 21.7 108.527 178.004 72.848 -176.0 -75.904 102.646 2.042 103.863 -80.801 -60.938 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -72.31 140.29 48.45 Favored 'General case' 0 N--CA 1.503 2.213 0 N-CA-C 102.339 -3.208 . . . . 27.39 102.339 177.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' THR . . . . . 0.534 ' CG2' ' N ' ' A' ' 66' ' ' THR . 17.5 m -93.42 168.27 11.17 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 114.388 -1.278 . . . . 30.7 110.282 -177.785 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' THR . . . . . 0.534 ' N ' ' CG2' ' A' ' 65' ' ' THR . 81.1 p -105.31 -7.12 19.09 Favored 'General case' 0 C--O 1.248 1.007 0 O-C-N 127.852 3.22 . . . . 27.27 112.671 -179.601 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ASP . . . . . 0.519 ' CB ' ' CD1' ' A' ' 20' ' ' ILE . 2.2 t0 -91.17 112.82 55.89 Favored Pre-proline 0 CA--C 1.557 1.218 0 N-CA-C 101.072 -3.677 . . . . 31.62 101.072 178.356 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 2.0 Cg_endo -51.12 -22.23 10.54 Favored 'Trans proline' 0 C--O 1.244 0.777 0 O-C-N 127.248 3.236 . . . . 29.02 113.32 -177.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -98.57 1.68 46.71 Favored 'General case' 0 C--N 1.304 -1.375 0 C-N-CA 118.499 -1.28 . . . . 35.0 112.153 177.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 52.8 tptt -125.83 107.01 10.09 Favored 'General case' 0 C--O 1.245 0.827 0 CA-C-N 120.834 1.652 . . . . 28.23 107.601 178.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ARG . . . . . 0.666 ' NH2' 'CL ' ' A' ' 90' ' ' ' CL' . 0.0 OUTLIER -63.06 -68.68 0.32 Allowed 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 114.01 1.115 . . . . 35.0 114.01 -177.946 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 2.0 p90 -130.86 171.49 13.1 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 104.105 -2.554 . . . . 26.08 104.105 179.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 16.4 t0 -177.74 150.31 0.65 Allowed 'General case' 0 C--O 1.257 1.456 0 O-C-N 126.382 2.301 . . . . 21.94 108.15 178.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' TYR . . . . . 0.458 ' OH ' ' OD2' ' A' ' 57' ' ' ASP . 85.3 m-85 -69.78 160.95 30.76 Favored 'General case' 0 N--CA 1.48 1.04 0 O-C-N 126.909 2.631 . . . . 22.54 115.223 -178.975 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' CYS . . . . . . . . . . . . . 83.2 m -110.4 143.51 40.58 Favored 'General case' 0 CA--C 1.444 -3.1 0 CA-C-O 113.054 -3.355 . . . . 23.54 116.018 175.845 -64.265 -160.504 -69.507 103.948 2.036 103.303 -116.479 -57.668 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.57 82.54 8.22 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 127.23 2.831 . . . . 35.0 107.94 -179.695 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ILE . . . . . . . . . . . . . 18.3 mm -90.61 125.24 43.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 CA-C-O 116.784 -1.579 . . . . 33.46 113.844 -177.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LEU . . . . . 0.438 ' O ' ' N ' ' A' ' 2' ' ' LYS 0.463 0.2 OUTLIER -53.56 136.73 38.09 Favored 'General case' 0 N--CA 1.485 1.302 0 CA-C-O 126.406 3.003 . . . . 35.0 111.236 -179.312 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' GLU . . . . . 0.485 ' OE2' ' CE ' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -69.92 136.82 51.01 Favored 'General case' 0 C--O 1.241 0.612 1 CA-C-N 107.521 -4.399 . . . . 35.0 108.007 -178.598 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' CYS . . . . . 0.8 ' CB ' ' O ' ' A' ' 2' ' ' LYS . 1.2 t . . . . . 0 C--O 1.285 2.933 0 CA-C-O 113.749 -3.024 . . . . 35.0 109.768 -177.93 -147.241 107.67 -43.389 110.669 2.016 108.576 126.803 67.538 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ' CL' . . . . . 0.666 'CL ' ' NH2' ' A' ' 71' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ' CL' . . . . . 0.573 'CL ' ' CE2' ' A' ' 35' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' HOH . . . . . 0.451 ' O ' ' OG1' ' A' ' 16' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 350' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 365' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 426' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 428' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 431' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 439' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 446' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 522' ' ' HOH . . . . . 0.84 ' O ' ' N ' ' A' ' 0' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 608' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 609' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 610' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 618' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 625' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 631' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 660' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 702' ' ' HOH . . . . . 0.567 ' O ' ' O ' ' A' ' 1' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 703' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 707' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 708' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 0' ' ' GLU . . . . . 0.758 ' OE2' ' HB ' ' A' ' 12' ' ' THR 0.332 40.8 mp0 . . . . . 0 N--CA 1.431 -1.384 0 CA-C-O 122.321 1.058 . . . . 35.0 108.777 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 1' ' ' CYS . . . . . 0.567 ' O ' ' O ' ' A' ' 702' ' ' HOH . 24.6 p -156.83 160.62 39.36 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 100.231 -3.989 . . . . 35.0 100.231 176.737 67.538 126.803 -43.389 108.576 2.016 110.669 107.67 -147.241 2 2 . 1 . 001 ecloud build full ' A' A ' 2' ' ' LYS . . . . . 0.847 ' O ' ' HB2' ' A' ' 80' ' ' CYS . 20.7 ttpt -118.25 157.94 26.09 Favored 'General case' 0 C--N 1.32 -0.683 0 O-C-N 128.055 3.347 . . . . 35.0 108.452 -178.287 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' THR . . . . . 0.462 HG23 ' O ' ' A' ' 107' ' ' HOH . 0.2 OUTLIER -156.97 124.35 5.3 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 102.731 -3.063 . . . . 35.0 102.731 177.378 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 82.04 -155.67 35.09 Favored Glycine 0 N--CA 1.49 2.254 1 O-C-N 129.769 4.418 . . . . 35.0 110.822 179.985 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ASN . . . . . 0.836 ' O ' ' HA2' ' A' ' 60' ' ' GLY . 10.1 p-10 -71.91 2.54 5.41 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 107.496 -1.298 . . . . 34.840000000000003 107.496 -179.779 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 74.63 36.58 48.19 Favored Glycine 0 C--N 1.301 -1.39 0 N-CA-C 110.24 -1.144 . . . . 30.75 110.24 -179.536 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.8 tptt -64.09 -39.89 95.05 Favored 'General case' 0 C--O 1.261 1.663 0 N-CA-C 117.57 2.433 . . . . 35.0 117.57 179.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ASN . . . . . 0.416 ' C ' HH11 ' A' ' 10' ' ' ARG . 3.8 m120 -97.23 8.33 44.77 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-O 117.635 -1.174 . . . . 34.630000000000003 111.644 -177.697 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' TYR . . . . . 0.744 ' CZ ' ' HA3' ' A' ' 11' ' ' GLY . 88.9 t80 -63.03 114.47 3.72 Favored 'General case' 0 C--N 1.314 -0.971 1 O-C-N 129.262 4.101 . . . . 28.010000000000002 111.289 -177.18 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ARG . . . . . 0.529 ' HD3' ' O ' ' A' ' 9' ' ' TYR . 27.0 mmt-85 -119.45 34.92 5.02 Favored 'General case' 0 C--O 1.247 0.951 1 O-C-N 129.59 4.306 . . . . 29.100000000000001 109.716 177.242 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLY . . . . . 0.744 ' HA3' ' CZ ' ' A' ' 9' ' ' TYR . . . -66.77 -175.06 6.65 Favored Glycine 0 N--CA 1.433 -1.552 0 O-C-N 126.045 2.09 . . . . 25.379999999999999 110.874 179.331 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' THR . . . . . 0.821 HG21 ' O ' ' A' ' 121' ' ' HOH . 0.6 OUTLIER -118.93 10.87 12.37 Favored 'General case' 0 C--O 1.267 2.01 0 N-CA-C 119.862 3.282 . . . . 27.879999999999999 119.862 -176.052 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 58.3 mmm -71.12 137.78 49.13 Favored 'General case' 0 C--N 1.309 -1.162 0 O-C-N 126.198 2.186 . . . . 35.0 107.932 178.496 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.1 p -132.98 20.75 4.11 Favored 'General case' 0 C--N 1.326 -0.422 1 O-C-N 130.442 4.839 . . . . 30.859999999999999 116.02 -178.79 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 7.8 pttt -137.01 150.77 48.31 Favored 'General case' 0 C--N 1.306 -1.326 0 CA-C-O 127.134 3.349 . . . . 24.719999999999999 106.273 179.043 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' THR . . . . . 0.423 HG23 ' O ' ' A' ' 20' ' ' ILE . 1.3 p -83.62 177.61 8.33 Favored 'General case' 0 N--CA 1.486 1.366 0 CA-C-N 111.674 -2.512 . . . . 27.039999999999999 108.666 -178.099 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.4 pttt -54.99 -18.72 5.44 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 111.349 -2.659 . . . . 32.359999999999999 113.907 178.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -111.81 23.81 13.41 Favored 'General case' 0 C--O 1.251 1.164 0 C-N-CA 128.726 2.81 . . . . 35.0 111.566 179.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.42 26.19 56.24 Favored Glycine 0 C--O 1.254 1.386 0 O-C-N 127.117 2.761 . . . . 31.879999999999999 118.4 177.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ILE . . . . . 0.691 ' CD1' ' HB2' ' A' ' 67' ' ' ASP 0.402 4.7 tt -104.69 134.64 45.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 N-CA-C 102.62 -3.104 . . . . 31.609999999999999 102.62 176.137 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . 0.275 0.4 OUTLIER -72.98 135.61 45.0 Favored 'General case' 0 C--O 1.251 1.167 0 CA-C-N 111.424 -2.625 . . . . 29.59 116.52 -176.922 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 22' ' ' CYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 77.2 m -63.82 149.03 47.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 110.978 -2.828 . . . . 25.41 113.482 -179.673 -60.938 -80.801 -75.904 103.863 2.042 102.646 -176.0 72.848 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 26.4 tt0 -92.34 139.07 30.97 Favored 'General case' 0 C--O 1.277 2.529 0 O-C-N 126.46 2.35 . . . . 26.850000000000001 108.672 177.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 3.7 mmmt -60.81 132.79 54.98 Favored 'General case' 0 N--CA 1.503 2.199 0 N-CA-C 105.815 -1.92 . . . . 31.670000000000002 105.815 -179.06 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -64.3 -17.93 64.12 Favored 'General case' 0 C--O 1.254 1.325 0 C-N-CA 126.623 1.969 . . . . 28.66 110.015 179.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.57 -36.03 22.39 Favored 'General case' 0 N--CA 1.481 1.121 0 O-C-N 125.909 2.005 . . . . 30.199999999999999 109.386 179.184 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.9 t -65.33 156.49 31.97 Favored 'General case' 0 C--N 1.301 -1.515 0 C-N-CA 128.792 2.837 . . . . 29.859999999999999 112.967 -179.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 66.2 p -123.41 26.99 7.65 Favored 'General case' 0 C--O 1.252 1.205 0 N-CA-C 116.294 1.961 . . . . 34.619999999999997 116.294 -178.324 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' SER . . . . . 0.435 ' HA ' ' C ' ' A' ' 30' ' ' PRO . 4.5 p -155.45 149.81 19.82 Favored Pre-proline 0 C--N 1.309 -1.186 0 C-N-CA 126.117 1.767 . . . . 35.0 107.624 177.461 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' PRO . . . . . 0.435 ' C ' ' HA ' ' A' ' 29' ' ' SER . 1.5 Cg_endo -69.85 -16.9 12.28 Favored 'Cis proline' 0 CA--C 1.543 0.939 0 N-CA-C 107.77 -1.665 . . . . 35.0 107.77 1.898 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 11.8 m80 -111.23 153.0 26.47 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 114.124 1.157 . . . . 32.060000000000002 114.124 -178.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ARG . . . . . 0.424 ' HD2' ' O ' ' A' ' 116' ' ' HOH . 4.4 ttm180 -101.57 111.52 63.97 Favored Pre-proline 0 C--N 1.319 -0.745 0 N-CA-C 107.365 -1.346 . . . . 35.0 107.365 177.569 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' PRO . . . . . 0.565 ' HB3' ' CD2' ' A' ' 64' ' ' TYR . 1.1 Cg_endo -72.84 142.08 34.69 Favored 'Trans proline' 0 C--O 1.248 0.983 0 CA-C-O 125.216 2.09 . . . . 32.399999999999999 111.926 -178.434 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ARG . . . . . 0.981 ' HE ' HH12 ' A' ' 71' ' ' ARG . 0.9 OUTLIER -88.25 -10.86 48.31 Favored 'General case' 0 C--O 1.246 0.879 0 C-N-CA 129.313 3.045 . . . . 35.0 108.308 -179.853 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 35' ' ' PHE . . . . . 0.725 ' HE2' 'CL ' ' A' ' 91' ' ' ' CL' . 71.2 m-85 -135.67 139.59 43.84 Favored 'General case' 0 C--O 1.247 0.944 0 O-C-N 125.708 1.88 . . . . 30.559999999999999 107.232 178.63 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' SER . . . . . 0.578 ' C ' HD23 ' A' ' 46' ' ' LEU . 24.9 p -157.0 167.72 13.96 Favored Pre-proline 0 N--CA 1.484 1.238 0 O-C-N 125.517 1.76 . . . . 31.260000000000002 110.763 178.026 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' PRO . . . . . 0.577 ' HD2' ' HB2' ' A' ' 37' ' ' SER . 1.6 Cg_endo -61.45 -21.92 73.17 Favored 'Trans proline' 0 C--O 1.26 1.616 0 C-N-CA 122.806 2.337 . . . . 29.789999999999999 113.434 179.951 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -81.18 -26.94 35.61 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 113.713 1.005 . . . . 31.789999999999999 113.713 -179.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' THR . . . . . 1.213 HG22 ' ND1' ' A' ' 41' ' ' HIS . 1.0 OUTLIER -102.48 -33.69 9.42 Favored 'General case' 0 C--N 1.312 -1.032 0 N-CA-C 116.57 2.063 . . . . 31.940000000000001 116.57 -178.308 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 41' ' ' HIS . . . . . 1.213 ' ND1' HG22 ' A' ' 40' ' ' THR . 2.9 m80 -126.99 67.98 70.86 Favored Pre-proline 0 N--CA 1.474 0.738 0 C-N-CA 127.265 2.226 . . . . 32.880000000000003 109.056 179.991 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' PRO . . . . . 0.509 ' HD3' ' C ' ' A' ' 40' ' ' THR . 2.2 Cg_endo -58.89 -27.58 84.84 Favored 'Trans proline' 0 C--O 1.24 0.586 0 O-C-N 128.336 3.808 . . . . 32.93 115.616 -177.581 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . 0.279 54.8 p -85.21 1.9 46.1 Favored 'General case' 0 C--O 1.27 2.15 0 C-N-CA 126.693 1.997 . . . . 32.479999999999997 114.902 177.845 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLU . . . . . 0.481 ' CG ' ' HB3' ' A' ' 41' ' ' HIS . 74.4 mm-40 -96.57 0.31 49.84 Favored 'General case' 0 CA--C 1.488 -1.408 0 N-CA-C 120.915 3.672 . . . . 32.079999999999998 120.915 -176.468 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLY . . . . . 0.947 ' O ' ' HD2' ' A' ' 52' ' ' ARG . . . 71.34 35.07 63.63 Favored Glycine 0 CA--C 1.531 1.085 0 CA-C-N 122.833 2.561 . . . . 29.359999999999999 115.964 175.461 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' LEU . . . . . 0.578 HD23 ' C ' ' A' ' 37' ' ' SER . 0.3 OUTLIER -81.85 53.39 2.16 Favored 'General case' 0 C--N 1.311 -1.072 0 O-C-N 124.383 0.696 . . . . 28.050000000000001 112.337 -177.608 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -100.4 140.5 34.56 Favored 'General case' 0 C--O 1.249 1.073 0 O-C-N 124.883 1.365 . . . . 35.0 111.514 -179.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 52.7 mm-40 58.57 -134.98 0.96 Allowed 'General case' 0 C--O 1.259 1.559 0 O-C-N 126.622 2.451 . . . . 35.0 108.916 179.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ASN . . . . . 0.438 ' O ' ' HB2' ' A' ' 22' ' ' CYS . 25.9 p-10 -129.04 45.76 2.74 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 126.053 2.096 . . . . 25.960000000000001 107.529 -178.834 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -92.77 157.04 16.63 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.799 -1.091 . . . . 22.73 110.709 -179.153 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 65.6 m -71.09 115.84 10.7 Favored 'General case' 0 C--N 1.304 -1.411 0 C-N-CA 130.826 3.65 . . . . 22.149999999999999 107.994 178.989 -57.668 -116.479 -69.507 103.303 2.036 103.948 -160.504 -64.265 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ARG . . . . . 0.947 ' HD2' ' O ' ' A' ' 45' ' ' GLY . 6.7 mmp_? -128.08 -174.36 3.19 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 114.374 -1.284 . . . . 24.73 108.808 178.486 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 63.6 t-20 -149.03 70.87 10.19 Favored Pre-proline 0 N--CA 1.478 0.951 0 N-CA-C 107.526 -1.287 . . . . 28.309999999999999 107.526 178.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -65.8 -11.62 31.61 Favored 'Trans proline' 0 C--O 1.246 0.908 0 C-N-CA 123.812 3.008 . . . . 25.969999999999999 114.599 -177.26 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . 0.266 17.7 p-10 -125.82 16.48 8.03 Favored 'General case' 0 C--O 1.258 1.542 1 O-C-N 130.504 4.877 . . . . 33.200000000000003 116.289 -174.081 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ASN . . . . . 0.469 ' CG ' HD22 ' A' ' 5' ' ' ASN 0.276 2.9 t30 52.03 44.29 29.66 Favored 'General case' 0 C--O 1.263 1.793 0 CA-C-O 124.793 2.235 . . . . 31.84 110.943 177.879 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ASP . . . . . 0.418 ' OD1' ' HD2' ' A' ' 58' ' ' PRO . 25.5 t0 -63.64 134.5 95.9 Favored Pre-proline 0 C--O 1.251 1.164 0 N-CA-C 102.831 -3.026 . . . . 26.420000000000002 102.831 177.279 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' PRO . . . . . 0.418 ' HD2' ' OD1' ' A' ' 57' ' ' ASP . 1.1 Cg_endo -72.7 -17.19 26.28 Favored 'Trans proline' 0 C--O 1.259 1.548 0 O-C-N 125.593 2.365 . . . . 26.16 113.654 -175.793 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . 0.253 28.5 mt-30 -88.81 -6.37 57.41 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-O 117.481 -1.247 . . . . 23.039999999999999 113.325 -179.678 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLY . . . . . 0.836 ' HA2' ' O ' ' A' ' 5' ' ' ASN . . . 93.13 -172.48 33.58 Favored Glycine 0 N--CA 1.467 0.739 0 O-C-N 126.473 2.358 . . . . 22.059999999999999 113.94 178.191 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -48.86 127.79 17.54 Favored 'Trans proline' 0 C--O 1.255 1.341 0 O-C-N 128.199 3.736 . . . . 22.140000000000001 119.581 178.75 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 67.8 p-90 -137.91 -179.89 6.03 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 111.574 -2.557 . . . . 20.030000000000001 105.015 -178.289 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 16.5 p -163.37 159.89 22.95 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-O 124.789 2.233 . . . . 21.699999999999999 108.527 178.004 72.848 -176.0 -75.904 102.646 2.042 103.863 -80.801 -60.938 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' TYR . . . . . 0.565 ' CD2' ' HB3' ' A' ' 33' ' ' PRO . 34.0 m-85 -72.31 140.29 48.45 Favored 'General case' 0 N--CA 1.503 2.213 0 N-CA-C 102.339 -3.208 . . . . 27.390000000000001 102.339 177.202 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' THR . . . . . 0.966 HG22 ' H ' ' A' ' 67' ' ' ASP . 17.5 m -93.42 168.27 11.17 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 114.388 -1.278 . . . . 30.699999999999999 110.282 -177.785 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' THR . . . . . 0.534 ' N ' ' CG2' ' A' ' 65' ' ' THR . 81.1 p -105.31 -7.12 19.09 Favored 'General case' 0 C--O 1.248 1.007 0 O-C-N 127.852 3.22 . . . . 27.27 112.671 -179.601 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ASP . . . . . 0.966 ' H ' HG22 ' A' ' 65' ' ' THR . 2.2 t0 -91.17 112.82 55.89 Favored Pre-proline 0 CA--C 1.557 1.218 0 N-CA-C 101.072 -3.677 . . . . 31.620000000000001 101.072 178.356 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' PRO . . . . . 0.729 ' HG2' ' O ' ' A' ' 206' ' ' HOH . 2.0 Cg_endo -51.12 -22.23 10.54 Favored 'Trans proline' 0 C--O 1.244 0.777 0 O-C-N 127.248 3.236 . . . . 29.02 113.32 -177.006 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -98.57 1.68 46.71 Favored 'General case' 0 C--N 1.304 -1.375 0 C-N-CA 118.499 -1.28 . . . . 35.0 112.153 177.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LYS . . . . . 0.598 ' O ' ' HB ' ' A' ' 65' ' ' THR . 52.8 tptt -125.83 107.01 10.09 Favored 'General case' 0 C--O 1.245 0.827 0 CA-C-N 120.834 1.652 . . . . 28.23 107.601 178.34 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ARG . . . . . 0.981 HH12 ' HE ' ' A' ' 34' ' ' ARG . 0.0 OUTLIER -63.06 -68.68 0.32 Allowed 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 114.01 1.115 . . . . 35.0 114.01 -177.946 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 72' ' ' TYR . . . . . 0.445 ' O ' ' HB2' ' A' ' 73' ' ' ASP . 2.0 p90 -130.86 171.49 13.1 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 104.105 -2.554 . . . . 26.079999999999998 104.105 179.793 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ASP . . . . . 0.477 ' HB2' ' HE3' ' A' ' 70' ' ' LYS . 16.4 t0 -177.74 150.31 0.65 Allowed 'General case' 0 C--O 1.257 1.456 0 O-C-N 126.382 2.301 . . . . 21.940000000000001 108.15 178.812 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -69.78 160.95 30.76 Favored 'General case' 0 N--CA 1.48 1.04 0 O-C-N 126.909 2.631 . . . . 22.539999999999999 115.223 -178.975 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' CYS . . . . . . . . . . . . . 83.2 m -110.4 143.51 40.58 Favored 'General case' 0 CA--C 1.444 -3.1 0 CA-C-O 113.054 -3.355 . . . . 23.539999999999999 116.018 175.845 -64.265 -160.504 -69.507 103.948 2.036 103.303 -116.479 -57.668 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.57 82.54 8.22 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 127.23 2.831 . . . . 35.0 107.94 -179.695 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ILE . . . . . 0.553 ' CG2' ' HB2' ' A' ' 2' ' ' LYS . 18.3 mm -90.61 125.24 43.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 CA-C-O 116.784 -1.579 . . . . 33.460000000000001 113.844 -177.913 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LEU . . . . . 0.448 HD12 ' HA ' ' A' ' 78' ' ' LEU 0.463 0.2 OUTLIER -53.56 136.73 38.09 Favored 'General case' 0 N--CA 1.485 1.302 0 CA-C-O 126.406 3.003 . . . . 35.0 111.236 -179.312 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 79' ' ' GLU . . . . . 0.528 ' OE2' ' HE2' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -69.92 136.82 51.01 Favored 'General case' 0 C--O 1.241 0.612 1 CA-C-N 107.521 -4.399 . . . . 35.0 108.007 -178.598 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 80' ' ' CYS . . . . . 0.847 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 1.2 t . . . . . 0 C--O 1.285 2.933 0 CA-C-O 113.749 -3.024 . . . . 35.0 109.768 -177.93 -147.241 107.67 -43.389 110.669 2.016 108.576 126.803 67.538 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ' CL' . . . . . 0.584 'CL ' ' NH2' ' A' ' 71' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ' CL' . . . . . 0.725 'CL ' ' HE2' ' A' ' 35' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HOH . . . . . 0.462 ' O ' HG23 ' A' ' 3' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 116' ' ' HOH . . . . . 0.424 ' O ' ' HD2' ' A' ' 32' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HOH . . . . . 0.821 ' O ' HG21 ' A' ' 12' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . 0.729 ' O ' ' HG2' ' A' ' 68' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 220' ' ' HOH . . . . . 0.407 ' O ' ' HB3' ' A' ' 8' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 350' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 365' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 426' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 428' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 431' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 439' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 446' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 522' ' ' HOH . . . . . 0.514 ' O ' ' HA ' ' A' ' 0' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 608' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 609' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 610' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 618' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 625' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 631' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 660' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 702' ' ' HOH . . . . . 0.567 ' O ' ' O ' ' A' ' 1' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 703' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 707' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 708' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 0' ' ' GLU . . . . . 0.758 ' OE2' ' HB ' ' A' ' 12' ' ' THR 0.332 40.8 mp0 . . . . . 0 N--CA 1.431 -1.384 0 CA-C-O 122.321 1.058 . . . . 35.0 108.777 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' CYS . . . . . 0.567 ' O ' ' O ' ' A' ' 702' ' ' HOH . 24.6 p -156.83 160.62 39.36 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 100.231 -3.989 . . . . 35.0 100.231 176.737 67.538 126.803 -43.389 108.576 2.016 110.669 107.67 -147.241 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.847 ' O ' ' HB2' ' A' ' 80' ' ' CYS . 20.7 ttpt -118.25 157.94 26.09 Favored 'General case' 0 C--N 1.32 -0.683 0 O-C-N 128.055 3.347 . . . . 35.0 108.452 -178.287 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' THR . . . . . 0.462 HG23 ' O ' ' A' ' 107' ' ' HOH . 0.2 OUTLIER -156.97 124.35 5.3 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 102.731 -3.063 . . . . 35.0 102.731 177.378 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 82.04 -155.67 35.09 Favored Glycine 0 N--CA 1.49 2.254 1 O-C-N 129.769 4.418 . . . . 35.0 110.822 179.985 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.868 HD22 ' H ' ' A' ' 5' ' ' ASN . 0.0 OUTLIER -71.91 2.54 5.41 Favored 'General case' 0 C--N 1.317 -0.808 0 N-CA-C 107.496 -1.298 . . . . 34.840000000000003 107.496 -179.779 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 74.63 36.58 48.19 Favored Glycine 0 C--N 1.301 -1.39 0 N-CA-C 110.24 -1.144 . . . . 30.75 110.24 -179.536 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.714 ' HD3' HD22 ' A' ' 56' ' ' ASN . 14.8 tptt -64.09 -39.89 95.05 Favored 'General case' 0 C--O 1.261 1.663 0 N-CA-C 117.57 2.433 . . . . 35.0 117.57 179.795 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ASN . . . . . 0.416 ' C ' HH11 ' A' ' 10' ' ' ARG . 3.8 m120 -97.23 8.33 44.77 Favored 'General case' 0 C--O 1.242 0.662 0 CA-C-O 117.635 -1.174 . . . . 34.630000000000003 111.644 -177.697 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' TYR . . . . . 0.744 ' CZ ' ' HA3' ' A' ' 11' ' ' GLY . 88.9 t80 -63.03 114.47 3.72 Favored 'General case' 0 C--N 1.314 -0.971 1 O-C-N 129.262 4.101 . . . . 28.010000000000002 111.289 -177.18 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.529 ' HD3' ' O ' ' A' ' 9' ' ' TYR . 27.0 mmt-85 -119.45 34.92 5.02 Favored 'General case' 0 C--O 1.247 0.951 1 O-C-N 129.59 4.306 . . . . 29.100000000000001 109.716 177.242 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.744 ' HA3' ' CZ ' ' A' ' 9' ' ' TYR . . . -66.77 -175.06 6.65 Favored Glycine 0 N--CA 1.433 -1.552 0 O-C-N 126.045 2.09 . . . . 25.379999999999999 110.874 179.331 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' THR . . . . . 0.821 HG21 ' O ' ' A' ' 121' ' ' HOH . 0.6 OUTLIER -118.93 10.87 12.37 Favored 'General case' 0 C--O 1.267 2.01 0 N-CA-C 119.862 3.282 . . . . 27.879999999999999 119.862 -176.052 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 58.3 mmm -71.12 137.78 49.13 Favored 'General case' 0 C--N 1.309 -1.162 0 O-C-N 126.198 2.186 . . . . 35.0 107.932 178.496 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 1.1 p -132.98 20.75 4.11 Favored 'General case' 0 C--N 1.326 -0.422 1 O-C-N 130.442 4.839 . . . . 30.859999999999999 116.02 -178.79 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 7.8 pttt -137.01 150.77 48.31 Favored 'General case' 0 C--N 1.306 -1.326 0 CA-C-O 127.134 3.349 . . . . 24.719999999999999 106.273 179.043 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' THR . . . . . 0.423 HG23 ' O ' ' A' ' 20' ' ' ILE . 1.3 p -83.62 177.61 8.33 Favored 'General case' 0 N--CA 1.486 1.366 0 CA-C-N 111.674 -2.512 . . . . 27.039999999999999 108.666 -178.099 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.4 pttt -54.99 -18.72 5.44 Favored 'General case' 0 C--N 1.314 -0.958 0 CA-C-N 111.349 -2.659 . . . . 32.359999999999999 113.907 178.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 12.5 m120 -111.81 23.81 13.41 Favored 'General case' 0 C--O 1.251 1.164 0 C-N-CA 128.726 2.81 . . . . 35.0 111.566 179.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 57.42 26.19 56.24 Favored Glycine 0 C--O 1.254 1.386 0 O-C-N 127.117 2.761 . . . . 31.879999999999999 118.4 177.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.691 ' CD1' ' HB2' ' A' ' 67' ' ' ASP 0.402 4.7 tt -104.69 134.64 45.5 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.39 0 N-CA-C 102.62 -3.104 . . . . 31.609999999999999 102.62 176.137 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . 0.275 0.4 OUTLIER -72.98 135.61 45.0 Favored 'General case' 0 C--O 1.251 1.167 0 CA-C-N 111.424 -2.625 . . . . 29.59 116.52 -176.922 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' CYS . . . . . 0.438 ' HB2' ' O ' ' A' ' 49' ' ' ASN . 77.2 m -63.82 149.03 47.84 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 110.978 -2.828 . . . . 25.41 113.482 -179.673 -60.938 -80.801 -75.904 103.863 2.042 102.646 -176.0 72.848 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLN . . . . . . . . . . . . . 26.4 tt0 -92.34 139.07 30.97 Favored 'General case' 0 C--O 1.277 2.529 0 O-C-N 126.46 2.35 . . . . 26.850000000000001 108.672 177.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 3.7 mmmt -60.81 132.79 54.98 Favored 'General case' 0 N--CA 1.503 2.199 0 N-CA-C 105.815 -1.92 . . . . 31.670000000000002 105.815 -179.06 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -64.3 -17.93 64.12 Favored 'General case' 0 C--O 1.254 1.325 0 C-N-CA 126.623 1.969 . . . . 28.66 110.015 179.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.57 -36.03 22.39 Favored 'General case' 0 N--CA 1.481 1.121 0 O-C-N 125.909 2.005 . . . . 30.199999999999999 109.386 179.184 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.9 t -65.33 156.49 31.97 Favored 'General case' 0 C--N 1.301 -1.515 0 C-N-CA 128.792 2.837 . . . . 29.859999999999999 112.967 -179.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 66.2 p -123.41 26.99 7.65 Favored 'General case' 0 C--O 1.252 1.205 0 N-CA-C 116.294 1.961 . . . . 34.619999999999997 116.294 -178.324 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' SER . . . . . 0.435 ' HA ' ' C ' ' A' ' 30' ' ' PRO . 4.5 p -155.45 149.81 19.82 Favored Pre-proline 0 C--N 1.309 -1.186 0 C-N-CA 126.117 1.767 . . . . 35.0 107.624 177.461 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.435 ' C ' ' HA ' ' A' ' 29' ' ' SER . 1.5 Cg_endo -69.85 -16.9 12.28 Favored 'Cis proline' 0 CA--C 1.543 0.939 0 N-CA-C 107.77 -1.665 . . . . 35.0 107.77 1.898 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 11.8 m80 -111.23 153.0 26.47 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 114.124 1.157 . . . . 32.060000000000002 114.124 -178.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ARG . . . . . 0.424 ' HD2' ' O ' ' A' ' 116' ' ' HOH . 4.4 ttm180 -101.57 111.52 63.97 Favored Pre-proline 0 C--N 1.319 -0.745 0 N-CA-C 107.365 -1.346 . . . . 35.0 107.365 177.569 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' PRO . . . . . 0.565 ' HB3' ' CD2' ' A' ' 64' ' ' TYR . 1.1 Cg_endo -72.84 142.08 34.69 Favored 'Trans proline' 0 C--O 1.248 0.983 0 CA-C-O 125.216 2.09 . . . . 32.399999999999999 111.926 -178.434 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ARG . . . . . 0.981 ' HE ' HH12 ' A' ' 71' ' ' ARG . 0.9 OUTLIER -88.25 -10.86 48.31 Favored 'General case' 0 C--O 1.246 0.879 0 C-N-CA 129.313 3.045 . . . . 35.0 108.308 -179.853 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' PHE . . . . . 0.725 ' HE2' 'CL ' ' A' ' 91' ' ' ' CL' . 71.2 m-85 -135.67 139.59 43.84 Favored 'General case' 0 C--O 1.247 0.944 0 O-C-N 125.708 1.88 . . . . 30.559999999999999 107.232 178.63 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' SER . . . . . 0.578 ' C ' HD23 ' A' ' 46' ' ' LEU . 24.9 p -157.0 167.72 13.96 Favored Pre-proline 0 N--CA 1.484 1.238 0 O-C-N 125.517 1.76 . . . . 31.260000000000002 110.763 178.026 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.577 ' HD2' ' HB2' ' A' ' 37' ' ' SER . 1.6 Cg_endo -61.45 -21.92 73.17 Favored 'Trans proline' 0 C--O 1.26 1.616 0 C-N-CA 122.806 2.337 . . . . 29.789999999999999 113.434 179.951 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -81.18 -26.94 35.61 Favored 'General case' 0 N--CA 1.478 0.968 0 N-CA-C 113.713 1.005 . . . . 31.789999999999999 113.713 -179.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' THR . . . . . 1.213 HG22 ' ND1' ' A' ' 41' ' ' HIS . 1.0 OUTLIER -102.48 -33.69 9.42 Favored 'General case' 0 C--N 1.312 -1.032 0 N-CA-C 116.57 2.063 . . . . 31.940000000000001 116.57 -178.308 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' HIS . . . . . 1.213 ' ND1' HG22 ' A' ' 40' ' ' THR . 2.9 m80 -126.99 67.98 70.86 Favored Pre-proline 0 N--CA 1.474 0.738 0 C-N-CA 127.265 2.226 . . . . 32.880000000000003 109.056 179.991 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' PRO . . . . . 0.509 ' HD3' ' C ' ' A' ' 40' ' ' THR . 2.2 Cg_endo -58.89 -27.58 84.84 Favored 'Trans proline' 0 C--O 1.24 0.586 0 O-C-N 128.336 3.808 . . . . 32.93 115.616 -177.581 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . 0.279 54.8 p -85.21 1.9 46.1 Favored 'General case' 0 C--O 1.27 2.15 0 C-N-CA 126.693 1.997 . . . . 32.479999999999997 114.902 177.845 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.481 ' CG ' ' HB3' ' A' ' 41' ' ' HIS . 74.4 mm-40 -96.57 0.31 49.84 Favored 'General case' 0 CA--C 1.488 -1.408 0 N-CA-C 120.915 3.672 . . . . 32.079999999999998 120.915 -176.468 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLY . . . . . 0.947 ' O ' ' HD2' ' A' ' 52' ' ' ARG . . . 71.34 35.07 63.63 Favored Glycine 0 CA--C 1.531 1.085 0 CA-C-N 122.833 2.561 . . . . 29.359999999999999 115.964 175.461 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.578 HD23 ' C ' ' A' ' 37' ' ' SER . 0.3 OUTLIER -81.85 53.39 2.16 Favored 'General case' 0 C--N 1.311 -1.072 0 O-C-N 124.383 0.696 . . . . 28.050000000000001 112.337 -177.608 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 1.3 pt-20 -100.4 140.5 34.56 Favored 'General case' 0 C--O 1.249 1.073 0 O-C-N 124.883 1.365 . . . . 35.0 111.514 -179.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 52.7 mm-40 58.57 -134.98 0.96 Allowed 'General case' 0 C--O 1.259 1.559 0 O-C-N 126.622 2.451 . . . . 35.0 108.916 179.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ASN . . . . . 0.438 ' O ' ' HB2' ' A' ' 22' ' ' CYS . 25.9 p-10 -129.04 45.76 2.74 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 126.053 2.096 . . . . 25.960000000000001 107.529 -178.834 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 12.5 m-85 -92.77 157.04 16.63 Favored 'General case' 0 C--N 1.315 -0.917 0 CA-C-N 114.799 -1.091 . . . . 22.73 110.709 -179.153 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 65.6 m -71.09 115.84 10.7 Favored 'General case' 0 C--N 1.304 -1.411 0 C-N-CA 130.826 3.65 . . . . 22.149999999999999 107.994 178.989 -57.668 -116.479 -69.507 103.303 2.036 103.948 -160.504 -64.265 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.947 ' HD2' ' O ' ' A' ' 45' ' ' GLY . 6.7 mmp_? -128.08 -174.36 3.19 Favored 'General case' 0 N--CA 1.476 0.853 0 CA-C-N 114.374 -1.284 . . . . 24.73 108.808 178.486 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ASN . . . . . . . . . . . . . 63.6 t-20 -149.03 70.87 10.19 Favored Pre-proline 0 N--CA 1.478 0.951 0 N-CA-C 107.526 -1.287 . . . . 28.309999999999999 107.526 178.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 2.2 Cg_endo -65.8 -11.62 31.61 Favored 'Trans proline' 0 C--O 1.246 0.908 0 C-N-CA 123.812 3.008 . . . . 25.969999999999999 114.599 -177.26 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . 0.266 17.7 p-10 -125.82 16.48 8.03 Favored 'General case' 0 C--O 1.258 1.542 1 O-C-N 130.504 4.877 . . . . 33.200000000000003 116.289 -174.081 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ASN . . . . . 0.714 HD22 ' HD3' ' A' ' 7' ' ' LYS 0.276 10.1 t-20 52.03 44.29 29.66 Favored 'General case' 0 C--O 1.263 1.793 0 CA-C-O 124.793 2.235 . . . . 31.84 110.943 177.879 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.418 ' OD1' ' HD2' ' A' ' 58' ' ' PRO . 25.5 t0 -63.64 134.5 95.9 Favored Pre-proline 0 C--O 1.251 1.164 0 N-CA-C 102.831 -3.026 . . . . 26.420000000000002 102.831 177.279 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' PRO . . . . . 0.418 ' HD2' ' OD1' ' A' ' 57' ' ' ASP . 1.1 Cg_endo -72.7 -17.19 26.28 Favored 'Trans proline' 0 C--O 1.259 1.548 0 O-C-N 125.593 2.365 . . . . 26.16 113.654 -175.793 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . 0.253 28.5 mt-30 -88.81 -6.37 57.41 Favored 'General case' 0 C--N 1.312 -1.056 0 CA-C-O 117.481 -1.247 . . . . 23.039999999999999 113.325 -179.678 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.836 ' HA2' ' O ' ' A' ' 5' ' ' ASN . . . 93.13 -172.48 33.58 Favored Glycine 0 N--CA 1.467 0.739 0 O-C-N 126.473 2.358 . . . . 22.059999999999999 113.94 178.191 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -48.86 127.79 17.54 Favored 'Trans proline' 0 C--O 1.255 1.341 0 O-C-N 128.199 3.736 . . . . 22.140000000000001 119.581 178.75 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' TRP . . . . . . . . . . . . . 67.8 p-90 -137.91 -179.89 6.03 Favored 'General case' 0 C--N 1.319 -0.739 0 CA-C-N 111.574 -2.557 . . . . 20.030000000000001 105.015 -178.289 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' CYS . . . . . . . . . . . . . 16.5 p -163.37 159.89 22.95 Favored 'General case' 0 C--N 1.306 -1.32 0 CA-C-O 124.789 2.233 . . . . 21.699999999999999 108.527 178.004 72.848 -176.0 -75.904 102.646 2.042 103.863 -80.801 -60.938 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.565 ' CD2' ' HB3' ' A' ' 33' ' ' PRO . 34.0 m-85 -72.31 140.29 48.45 Favored 'General case' 0 N--CA 1.503 2.213 0 N-CA-C 102.339 -3.208 . . . . 27.390000000000001 102.339 177.202 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' THR . . . . . 0.966 HG22 ' H ' ' A' ' 67' ' ' ASP . 17.5 m -93.42 168.27 11.17 Favored 'General case' 0 N--CA 1.49 1.526 0 CA-C-N 114.388 -1.278 . . . . 30.699999999999999 110.282 -177.785 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' THR . . . . . 0.534 ' N ' ' CG2' ' A' ' 65' ' ' THR . 81.1 p -105.31 -7.12 19.09 Favored 'General case' 0 C--O 1.248 1.007 0 O-C-N 127.852 3.22 . . . . 27.27 112.671 -179.601 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.966 ' H ' HG22 ' A' ' 65' ' ' THR . 2.2 t0 -91.17 112.82 55.89 Favored Pre-proline 0 CA--C 1.557 1.218 0 N-CA-C 101.072 -3.677 . . . . 31.620000000000001 101.072 178.356 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.729 ' HG2' ' O ' ' A' ' 206' ' ' HOH . 2.0 Cg_endo -51.12 -22.23 10.54 Favored 'Trans proline' 0 C--O 1.244 0.777 0 O-C-N 127.248 3.236 . . . . 29.02 113.32 -177.006 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -98.57 1.68 46.71 Favored 'General case' 0 C--N 1.304 -1.375 0 C-N-CA 118.499 -1.28 . . . . 35.0 112.153 177.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.598 ' O ' ' HB ' ' A' ' 65' ' ' THR . 52.8 tptt -125.83 107.01 10.09 Favored 'General case' 0 C--O 1.245 0.827 0 CA-C-N 120.834 1.652 . . . . 28.23 107.601 178.34 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ARG . . . . . 0.981 HH12 ' HE ' ' A' ' 34' ' ' ARG . 0.0 OUTLIER -63.06 -68.68 0.32 Allowed 'General case' 0 C--N 1.31 -1.117 0 N-CA-C 114.01 1.115 . . . . 35.0 114.01 -177.946 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.445 ' O ' ' HB2' ' A' ' 73' ' ' ASP . 2.0 p90 -130.86 171.49 13.1 Favored 'General case' 0 C--N 1.3 -1.548 0 N-CA-C 104.105 -2.554 . . . . 26.079999999999998 104.105 179.793 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ASP . . . . . 0.477 ' HB2' ' HE3' ' A' ' 70' ' ' LYS . 16.4 t0 -177.74 150.31 0.65 Allowed 'General case' 0 C--O 1.257 1.456 0 O-C-N 126.382 2.301 . . . . 21.940000000000001 108.15 178.812 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' TYR . . . . . . . . . . . . . 85.3 m-85 -69.78 160.95 30.76 Favored 'General case' 0 N--CA 1.48 1.04 0 O-C-N 126.909 2.631 . . . . 22.539999999999999 115.223 -178.975 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' CYS . . . . . . . . . . . . . 83.2 m -110.4 143.51 40.58 Favored 'General case' 0 CA--C 1.444 -3.1 0 CA-C-O 113.054 -3.355 . . . . 23.539999999999999 116.018 175.845 -64.265 -160.504 -69.507 103.948 2.036 103.303 -116.479 -57.668 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -85.57 82.54 8.22 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 127.23 2.831 . . . . 35.0 107.94 -179.695 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ILE . . . . . 0.553 ' CG2' ' HB2' ' A' ' 2' ' ' LYS . 18.3 mm -90.61 125.24 43.44 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.779 0 CA-C-O 116.784 -1.579 . . . . 33.460000000000001 113.844 -177.913 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LEU . . . . . 0.448 HD12 ' HA ' ' A' ' 78' ' ' LEU 0.463 0.2 OUTLIER -53.56 136.73 38.09 Favored 'General case' 0 N--CA 1.485 1.302 0 CA-C-O 126.406 3.003 . . . . 35.0 111.236 -179.312 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.528 ' OE2' ' HE2' ' A' ' 2' ' ' LYS . 0.0 OUTLIER -69.92 136.82 51.01 Favored 'General case' 0 C--O 1.241 0.612 1 CA-C-N 107.521 -4.399 . . . . 35.0 108.007 -178.598 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' CYS . . . . . 0.847 ' HB2' ' O ' ' A' ' 2' ' ' LYS . 1.2 t . . . . . 0 C--O 1.285 2.933 0 CA-C-O 113.749 -3.024 . . . . 35.0 109.768 -177.93 -147.241 107.67 -43.389 110.669 2.016 108.576 126.803 67.538 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ' CL' . . . . . 0.584 'CL ' ' NH2' ' A' ' 71' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ' CL' . . . . . 0.725 'CL ' ' HE2' ' A' ' 35' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HOH . . . . . 0.462 ' O ' HG23 ' A' ' 3' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' HOH . . . . . 0.424 ' O ' ' HD2' ' A' ' 32' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HOH . . . . . 0.821 ' O ' HG21 ' A' ' 12' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . 0.729 ' O ' ' HG2' ' A' ' 68' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' HOH . . . . . 0.407 ' O ' ' HB3' ' A' ' 8' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 334' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 350' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 365' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 402' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 405' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 408' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 411' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 416' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 420' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 425' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 426' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 428' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 431' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 433' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 434' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 439' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 446' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 522' ' ' HOH . . . . . 0.514 ' O ' ' HA ' ' A' ' 0' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 608' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 609' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 610' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 618' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 625' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 631' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 660' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 702' ' ' HOH . . . . . 0.567 ' O ' ' O ' ' A' ' 1' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 703' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 707' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 708' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_