data_3gw2_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 3gw2 _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 ' 7' ' ' ARG . . . . . . . . . . . . . 8.7 ptp85 . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 120.594 0.235 . . . . 55.270000000000003 111.476 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 8.0 mtpt -89.4 -34.69 16.4 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.129 0.572 . . . . 55.729999999999997 112.525 -179.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -74.68 161.69 29.42 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 122.736 0.415 . . . . 52.950000000000003 111.596 -178.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -92.41 38.75 1.01 Allowed 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.838 1.255 . . . . 50.5 112.995 3.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 37.7 tp -68.13 -35.83 78.73 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.704 -0.68 . . . . 47.57 109.555 172.111 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 42.9 mt -72.81 -33.23 66.09 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 113.599 0.963 . . . . 44.950000000000003 113.599 -177.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 51.2 m-20 -65.39 -32.3 73.86 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 112.428 0.529 . . . . 45.57 112.428 172.502 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 44.2 tp60 -77.77 -34.01 52.51 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.272 0.471 . . . . 42.979999999999997 112.272 174.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 55.5 t -61.73 -39.51 83.54 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.247 0 N-CA-C 107.493 -1.299 . . . . 38.039999999999999 107.493 172.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.26 -41.49 79.73 Favored 'General case' 0 C--O 1.242 0.678 0 O-C-N 123.534 0.521 . . . . 36.350000000000001 110.716 174.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 47.2 mtt85 -65.47 -38.12 88.87 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 116.639 -0.255 . . . . 44.68 111.452 175.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 99.5 t -58.98 -50.7 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 121.097 -0.241 . . . . 36.020000000000003 110.5 172.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -57.46 -45.23 93.23 Favored Glycine 0 C--N 1.334 0.456 0 CA-C-N 116.399 -0.364 . . . . 38.210000000000001 113.517 176.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 44.1 tttm -56.64 -45.28 81.69 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 122.251 0.22 . . . . 46.740000000000002 110.778 176.169 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.66 -36.65 76.85 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.231 0.456 . . . . 40.920000000000002 112.231 177.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 75.2 mt -82.06 -12.2 58.38 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 112.429 0.529 . . . . 39.93 112.429 -176.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -82.07 34.3 0.41 Allowed 'General case' 0 C--O 1.219 -0.512 0 N-CA-C 114.687 1.365 . . . . 40.219999999999999 114.687 -167.03 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -148.28 115.8 6.28 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.267 -1.012 . . . . 40.32 108.267 178.676 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -62.12 -39.44 97.64 Favored Glycine 0 C--O 1.241 0.588 0 CA-C-O 121.459 0.477 . . . . 39.240000000000002 114.185 -171.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 37.2 ttt180 -72.67 -36.79 68.02 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.187 -0.506 . . . . 40.289999999999999 111.804 179.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 19.4 ttp180 -58.8 -30.88 67.94 Favored 'General case' 0 C--O 1.246 0.918 0 N-CA-C 113.424 0.898 . . . . 45.969999999999999 113.424 172.003 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.14 -23.82 65.84 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 114.041 1.126 . . . . 40.960000000000001 114.041 177.905 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -57.43 -39.5 76.39 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.369 -0.378 . . . . 41.68 110.956 173.08 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.8 mt -54.76 -43.45 66.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.361 -0.381 . . . . 36.140000000000001 111.468 175.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 73.1 mt -64.03 -43.53 95.29 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 112.097 0.406 . . . . 38.640000000000001 112.097 -179.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.02 -37.88 84.14 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.738 0.304 . . . . 47.060000000000002 111.758 174.893 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 28.5 tp -67.13 -40.56 86.8 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.664 0.616 . . . . 42.770000000000003 112.664 179.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 95.8 mt -80.99 -8.95 59.89 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.328 0.492 . . . . 43.25 112.328 -178.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -106.45 95.73 5.96 Favored 'General case' 0 CA--C 1.5 -0.963 0 C-N-CA 122.911 0.485 . . . . 49.189999999999998 109.874 -171.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' GLN . . . . . . . . . . . . . 44.3 tp60 -118.44 149.99 40.32 Favored 'General case' 0 CA--C 1.555 1.142 0 CA-C-O 122.461 1.124 . . . . 52.189999999999998 113.186 -6.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 136.21 117.02 1.63 Allowed Glycine 0 N--CA 1.444 -0.802 0 N-CA-C 107.475 -2.25 . . . . 45.490000000000002 107.475 175.267 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 2.4 tt0 -56.68 143.16 37.32 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.128 0.571 . . . . 39.369999999999997 112.142 176.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 5.2 mtp180 -138.64 154.49 48.65 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 120.565 -0.454 . . . . 47.219999999999999 111.476 177.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.98 151.78 42.97 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-N 116.208 -0.451 . . . . 33.310000000000002 110.321 175.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 89.9 t -51.07 -47.0 31.84 Favored 'Isoleucine or valine' 0 C--O 1.247 0.934 0 C-N-CA 123.172 0.589 . . . . 33.259999999999998 111.531 177.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -55.29 -48.0 74.72 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.718 -0.674 . . . . 46.090000000000003 109.788 -178.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.29 -41.81 96.7 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 115.411 -0.813 . . . . 32.07 112.246 -179.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 66.2 mt -64.04 -41.51 92.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 123.226 0.61 . . . . 30.699999999999999 110.594 179.157 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.26 -48.43 79.97 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.283 0.563 . . . . 29.539999999999999 110.149 178.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 95.4 m -64.09 -44.34 92.63 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-N 115.669 -0.696 . . . . 27.98 112.51 -179.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.21 -35.21 80.07 Favored 'General case' 0 C--O 1.226 -0.172 0 N-CA-C 112.311 0.485 . . . . 28.07 112.311 -179.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 78.1 p -98.0 0.72 46.86 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.06 -0.656 . . . . 30.859999999999999 112.511 -175.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 67.86 24.28 74.28 Favored Glycine 0 CA--C 1.53 1.03 0 CA-C-O 119.358 -0.69 . . . . 31.469999999999999 113.904 -177.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' MSE . . . . . . . . . . . . . 53.9 mtt -96.7 141.88 29.41 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-N 117.928 0.864 . . . . 44.93 109.238 179.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ASN . . . . . 0.415 ' ND2' ' OG1' ' A' ' 54' ' ' THR . 8.2 p30 -64.05 159.99 19.04 Favored 'General case' 0 C--O 1.242 0.7 0 N-CA-C 108.649 -0.871 . . . . 32.079999999999998 108.649 168.005 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.3 -38.74 74.45 Favored 'General case' 0 C--O 1.219 -0.534 0 N-CA-C 114.003 1.112 . . . . 36.100000000000001 114.003 -176.764 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 37.3 m -65.28 -48.38 73.36 Favored 'General case' 0 C--O 1.248 0.979 0 N-CA-C 112.363 0.505 . . . . 32.5 112.363 176.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' THR . . . . . 0.415 ' OG1' ' ND2' ' A' ' 51' ' ' ASN . 97.3 m -58.03 -48.52 79.83 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 122.692 0.397 . . . . 31.030000000000001 111.578 175.478 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.76 -47.46 84.6 Favored 'General case' 0 C--N 1.328 -0.367 0 O-C-N 122.082 -0.386 . . . . 32.57 110.795 179.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 31.1 t -66.83 -40.1 87.86 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.322 -0.399 . . . . 39.25 111.312 -176.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.72 -47.2 83.07 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.404 0.52 . . . . 33.159999999999997 112.404 171.317 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 59.2 m-20 -67.1 -38.01 84.91 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 111.698 0.258 . . . . 34.899999999999999 111.698 179.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 32.8 mt -63.77 -41.98 97.88 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 112.769 0.655 . . . . 32.020000000000003 112.769 175.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -56.9 -43.03 80.95 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 112.635 0.606 . . . . 50.799999999999997 112.635 170.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.18 -44.49 97.21 Favored 'General case' 0 C--N 1.332 -0.165 0 O-C-N 123.208 0.317 . . . . 33.299999999999997 111.096 177.605 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 91.7 mt -61.19 -42.21 98.19 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 112.821 0.674 . . . . 32.590000000000003 112.821 174.641 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 48.1 tttm -63.92 -43.08 97.0 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.523 0.564 . . . . 40.43 112.523 179.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 28.6 m -63.22 -26.76 68.94 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 112.039 0.385 . . . . 34.039999999999999 112.039 178.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -89.2 4.06 84.37 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 121.593 -0.337 . . . . 32.719999999999999 112.691 176.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 75.18 17.08 80.28 Favored Glycine 0 C--N 1.335 0.492 0 N-CA-C 114.446 0.538 . . . . 33.960000000000001 114.446 175.642 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 59.7 mt -93.47 -23.15 18.48 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 113.446 0.906 . . . . 33.119999999999997 113.446 -169.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 31.2 m -132.34 158.16 43.22 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 CA-C-N 116.313 -0.403 . . . . 31.949999999999999 110.148 175.444 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -121.74 160.91 23.58 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 108.898 -0.778 . . . . 43.579999999999998 108.898 169.013 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -131.24 149.94 52.36 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 123.749 0.656 . . . . 34.450000000000003 111.097 -174.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 51.6 ptt85 -138.59 149.32 45.14 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.899 -0.778 . . . . 37.350000000000001 108.899 169.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 7.5 tpp180 -102.82 124.55 48.55 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.35 -0.981 . . . . 51.619999999999997 108.35 -178.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -132.73 100.93 5.09 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 120.991 0.424 . . . . 48.149999999999999 110.023 175.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 71.33 -129.86 17.88 Favored Glycine 0 N--CA 1.461 0.344 0 N-CA-C 109.962 -1.255 . . . . 46.259999999999998 109.962 -174.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.0 t -89.4 6.25 41.51 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 122.882 0.473 . . . . 47.340000000000003 112.144 178.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 10.8 mtt-85 -113.08 160.61 18.0 Favored 'General case' 0 CA--C 1.512 -0.515 0 CA-C-N 116.072 -0.513 . . . . 55.979999999999997 111.616 -176.043 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -129.94 131.1 45.85 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 107.303 -1.369 . . . . 43.219999999999999 107.303 176.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -112.31 130.08 56.07 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.983 0.421 . . . . 36.710000000000001 109.983 -178.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -113.06 145.51 40.76 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.967 -0.56 . . . . 33.920000000000002 110.015 -179.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 41.2 ptt85 -145.27 158.67 43.77 Favored 'General case' 0 N--CA 1.419 -1.977 0 C-N-CA 123.473 0.709 . . . . 29.68 111.402 176.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 32.9 mt -54.6 128.41 14.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 O-C-N 124.247 0.967 . . . . 37.689999999999998 108.76 167.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.23 -31.45 72.63 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 115.765 1.765 . . . . 36.350000000000001 115.765 -167.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -172.46 -175.74 40.7 Favored Glycine 0 N--CA 1.475 1.24 0 C-N-CA 120.916 -0.659 . . . . 35.969999999999999 113.258 170.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -58.53 -44.81 89.68 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 112.758 0.651 . . . . 45.159999999999997 112.758 175.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 88.6 m-20 -54.95 -38.5 67.8 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 120.705 0.288 . . . . 41.640000000000001 110.346 -179.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 97.5 t -67.73 -39.98 83.05 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 N-CA-C 112.277 0.473 . . . . 34.340000000000003 112.277 174.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.63 -44.34 86.74 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 120.8 0.333 . . . . 35.049999999999997 111.746 175.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 47.9 mtm105 -60.04 -41.52 92.45 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 120.285 -0.566 . . . . 43.299999999999997 111.546 170.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 28.6 tp -61.64 -46.16 90.97 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 112.752 0.649 . . . . 34.93 112.752 -178.055 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 27.0 t80 -68.98 -35.52 76.83 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.688 -0.687 . . . . 34.259999999999998 111.531 -179.157 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.64 -48.19 78.25 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 120.175 -0.61 . . . . 32.5 109.804 173.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 51.3 tp -66.87 -34.51 77.94 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 114.178 1.177 . . . . 31.100000000000001 114.178 -175.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 4.2 p -68.52 -32.36 54.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.782 0.325 . . . . 30.600000000000001 110.843 178.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -68.48 -34.03 75.19 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.309 -0.405 . . . . 33.0 111.836 172.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 53.5 t -66.71 -47.09 84.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 N-CA-C 110.174 -0.306 . . . . 30.870000000000001 110.174 173.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 17.0 t -60.03 -45.35 95.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 C-N-CA 122.844 0.457 . . . . 31.32 110.696 179.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -61.25 -50.12 74.33 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 123.834 0.854 . . . . 33.710000000000001 111.378 177.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -51.9 -32.78 34.08 Favored 'General case' 0 N--CA 1.462 0.139 0 N-CA-C 109.659 -0.497 . . . . 37.780000000000001 109.659 175.035 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.803 0 C-N-CA 124.637 1.175 . . . . 41.130000000000003 112.027 164.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' 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 ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.7 ptp85 . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 120.594 0.235 . . . . 55.270000000000003 111.476 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LYS . . . . . 0.449 ' HE2' ' HB2' ' A' ' 8' ' ' LYS . 8.0 mtpt -89.4 -34.69 16.4 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.129 0.572 . . . . 55.729999999999997 112.525 -179.06 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ALA . . . . . 0.587 ' HB1' ' HA ' ' A' ' 10' ' ' ALA . . . -74.68 161.69 29.42 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 122.736 0.415 . . . . 52.950000000000003 111.596 -178.191 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ALA . . . . . 0.587 ' HA ' ' HB1' ' A' ' 9' ' ' ALA . . . -92.41 38.75 1.01 Allowed 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.838 1.255 . . . . 50.5 112.995 3.085 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 37.7 tp -68.13 -35.83 78.73 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.704 -0.68 . . . . 47.57 109.555 172.111 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 42.9 mt -72.81 -33.23 66.09 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 113.599 0.963 . . . . 44.950000000000003 113.599 -177.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 51.2 m-20 -65.39 -32.3 73.86 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 112.428 0.529 . . . . 45.57 112.428 172.502 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 44.2 tp60 -77.77 -34.01 52.51 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.272 0.471 . . . . 42.979999999999997 112.272 174.367 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 55.5 t -61.73 -39.51 83.54 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.247 0 N-CA-C 107.493 -1.299 . . . . 38.039999999999999 107.493 172.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.26 -41.49 79.73 Favored 'General case' 0 C--O 1.242 0.678 0 O-C-N 123.534 0.521 . . . . 36.350000000000001 110.716 174.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 47.2 mtt85 -65.47 -38.12 88.87 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 116.639 -0.255 . . . . 44.68 111.452 175.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 99.5 t -58.98 -50.7 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 121.097 -0.241 . . . . 36.020000000000003 110.5 172.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -57.46 -45.23 93.23 Favored Glycine 0 C--N 1.334 0.456 0 CA-C-N 116.399 -0.364 . . . . 38.210000000000001 113.517 176.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 44.1 tttm -56.64 -45.28 81.69 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 122.251 0.22 . . . . 46.740000000000002 110.778 176.169 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.66 -36.65 76.85 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.231 0.456 . . . . 40.920000000000002 112.231 177.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 75.2 mt -82.06 -12.2 58.38 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 112.429 0.529 . . . . 39.93 112.429 -176.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -82.07 34.3 0.41 Allowed 'General case' 0 C--O 1.219 -0.512 0 N-CA-C 114.687 1.365 . . . . 40.219999999999999 114.687 -167.03 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -148.28 115.8 6.28 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.267 -1.012 . . . . 40.32 108.267 178.676 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -62.12 -39.44 97.64 Favored Glycine 0 C--O 1.241 0.588 0 CA-C-O 121.459 0.477 . . . . 39.240000000000002 114.185 -171.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 37.2 ttt180 -72.67 -36.79 68.02 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.187 -0.506 . . . . 40.289999999999999 111.804 179.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 19.4 ttp180 -58.8 -30.88 67.94 Favored 'General case' 0 C--O 1.246 0.918 0 N-CA-C 113.424 0.898 . . . . 45.969999999999999 113.424 172.003 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.14 -23.82 65.84 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 114.041 1.126 . . . . 40.960000000000001 114.041 177.905 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 81.2 mt-30 -57.43 -39.5 76.39 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.369 -0.378 . . . . 41.68 110.956 173.08 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.8 mt -54.76 -43.45 66.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.361 -0.381 . . . . 36.140000000000001 111.468 175.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 73.1 mt -64.03 -43.53 95.29 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 112.097 0.406 . . . . 38.640000000000001 112.097 -179.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.02 -37.88 84.14 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.738 0.304 . . . . 47.060000000000002 111.758 174.893 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 28.5 tp -67.13 -40.56 86.8 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.664 0.616 . . . . 42.770000000000003 112.664 179.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' LEU . . . . . 0.604 ' O ' ' HA ' ' A' ' 36' ' ' GLN . 95.8 mt -80.99 -8.95 59.89 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.328 0.492 . . . . 43.25 112.328 -178.287 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ALA . . . . . 0.495 ' HB2' ' CD1' ' A' ' 81' ' ' ILE . . . -106.45 95.73 5.96 Favored 'General case' 0 CA--C 1.5 -0.963 0 C-N-CA 122.911 0.485 . . . . 49.189999999999998 109.874 -171.675 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' GLN . . . . . 0.604 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 6.1 tp-100 -118.44 149.99 40.32 Favored 'General case' 0 CA--C 1.555 1.142 0 CA-C-O 122.461 1.124 . . . . 52.189999999999998 113.186 -6.664 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 136.21 117.02 1.63 Allowed Glycine 0 N--CA 1.444 -0.802 0 N-CA-C 107.475 -2.25 . . . . 45.490000000000002 107.475 175.267 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLU . . . . . 0.584 ' HB2' ' HB3' ' A' ' 80' ' ' ARG . 2.4 tt0 -56.68 143.16 37.32 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.128 0.571 . . . . 39.369999999999997 112.142 176.059 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 5.2 mtp180 -138.64 154.49 48.65 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 120.565 -0.454 . . . . 47.219999999999999 111.476 177.127 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.98 151.78 42.97 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-N 116.208 -0.451 . . . . 33.310000000000002 110.321 175.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 89.9 t -51.07 -47.0 31.84 Favored 'Isoleucine or valine' 0 C--O 1.247 0.934 0 C-N-CA 123.172 0.589 . . . . 33.259999999999998 111.531 177.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -55.29 -48.0 74.72 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.718 -0.674 . . . . 46.090000000000003 109.788 -178.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.29 -41.81 96.7 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 115.411 -0.813 . . . . 32.07 112.246 -179.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 66.2 mt -64.04 -41.51 92.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 123.226 0.61 . . . . 30.699999999999999 110.594 179.157 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.26 -48.43 79.97 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.283 0.563 . . . . 29.539999999999999 110.149 178.109 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 95.4 m -64.09 -44.34 92.63 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-N 115.669 -0.696 . . . . 27.98 112.51 -179.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.21 -35.21 80.07 Favored 'General case' 0 C--O 1.226 -0.172 0 N-CA-C 112.311 0.485 . . . . 28.07 112.311 -179.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 78.1 p -98.0 0.72 46.86 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.06 -0.656 . . . . 30.859999999999999 112.511 -175.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 67.86 24.28 74.28 Favored Glycine 0 CA--C 1.53 1.03 0 CA-C-O 119.358 -0.69 . . . . 31.469999999999999 113.904 -177.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' MSE . . . . . . . . . . . . . 53.9 mtt -96.7 141.88 29.41 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-N 117.928 0.864 . . . . 44.93 109.238 179.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -64.05 159.99 19.04 Favored 'General case' 0 C--O 1.242 0.7 0 N-CA-C 108.649 -0.871 . . . . 32.079999999999998 108.649 168.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.3 -38.74 74.45 Favored 'General case' 0 C--O 1.219 -0.534 0 N-CA-C 114.003 1.112 . . . . 36.100000000000001 114.003 -176.764 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 37.3 m -65.28 -48.38 73.36 Favored 'General case' 0 C--O 1.248 0.979 0 N-CA-C 112.363 0.505 . . . . 32.5 112.363 176.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 97.3 m -58.03 -48.52 79.83 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 122.692 0.397 . . . . 31.030000000000001 111.578 175.478 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.76 -47.46 84.6 Favored 'General case' 0 C--N 1.328 -0.367 0 O-C-N 122.082 -0.386 . . . . 32.57 110.795 179.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 31.1 t -66.83 -40.1 87.86 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.322 -0.399 . . . . 39.25 111.312 -176.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.72 -47.2 83.07 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.404 0.52 . . . . 33.159999999999997 112.404 171.317 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 59.2 m-20 -67.1 -38.01 84.91 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 111.698 0.258 . . . . 34.899999999999999 111.698 179.809 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 32.8 mt -63.77 -41.98 97.88 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 112.769 0.655 . . . . 32.020000000000003 112.769 175.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 1.9 mp0 -56.9 -43.03 80.95 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 112.635 0.606 . . . . 50.799999999999997 112.635 170.189 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.18 -44.49 97.21 Favored 'General case' 0 C--N 1.332 -0.165 0 O-C-N 123.208 0.317 . . . . 33.299999999999997 111.096 177.605 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 91.7 mt -61.19 -42.21 98.19 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 112.821 0.674 . . . . 32.590000000000003 112.821 174.641 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 48.1 tttm -63.92 -43.08 97.0 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.523 0.564 . . . . 40.43 112.523 179.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 28.6 m -63.22 -26.76 68.94 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 112.039 0.385 . . . . 34.039999999999999 112.039 178.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -89.2 4.06 84.37 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 121.593 -0.337 . . . . 32.719999999999999 112.691 176.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 75.18 17.08 80.28 Favored Glycine 0 C--N 1.335 0.492 0 N-CA-C 114.446 0.538 . . . . 33.960000000000001 114.446 175.642 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 59.7 mt -93.47 -23.15 18.48 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 113.446 0.906 . . . . 33.119999999999997 113.446 -169.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 31.2 m -132.34 158.16 43.22 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 CA-C-N 116.313 -0.403 . . . . 31.949999999999999 110.148 175.444 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -121.74 160.91 23.58 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 108.898 -0.778 . . . . 43.579999999999998 108.898 169.013 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -131.24 149.94 52.36 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 123.749 0.656 . . . . 34.450000000000003 111.097 -174.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 51.6 ptt85 -138.59 149.32 45.14 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.899 -0.778 . . . . 37.350000000000001 108.899 169.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 7.5 tpp180 -102.82 124.55 48.55 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.35 -0.981 . . . . 51.619999999999997 108.35 -178.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -132.73 100.93 5.09 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 120.991 0.424 . . . . 48.149999999999999 110.023 175.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 71.33 -129.86 17.88 Favored Glycine 0 N--CA 1.461 0.344 0 N-CA-C 109.962 -1.255 . . . . 46.259999999999998 109.962 -174.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.0 t -89.4 6.25 41.51 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 122.882 0.473 . . . . 47.340000000000003 112.144 178.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 10.8 mtt-85 -113.08 160.61 18.0 Favored 'General case' 0 CA--C 1.512 -0.515 0 CA-C-N 116.072 -0.513 . . . . 55.979999999999997 111.616 -176.043 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -129.94 131.1 45.85 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 107.303 -1.369 . . . . 43.219999999999999 107.303 176.118 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -112.31 130.08 56.07 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.983 0.421 . . . . 36.710000000000001 109.983 -178.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -113.06 145.51 40.76 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.967 -0.56 . . . . 33.920000000000002 110.015 -179.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ARG . . . . . 0.584 ' HB3' ' HB2' ' A' ' 38' ' ' GLU . 41.2 ptt85 -145.27 158.67 43.77 Favored 'General case' 0 N--CA 1.419 -1.977 0 C-N-CA 123.473 0.709 . . . . 31.350000000000001 111.402 176.495 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ILE . . . . . 0.495 ' CD1' ' HB2' ' A' ' 35' ' ' ALA . 32.9 mt -54.6 128.41 14.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 O-C-N 124.247 0.967 . . . . 37.689999999999998 108.76 167.151 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.23 -31.45 72.63 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 115.765 1.765 . . . . 36.350000000000001 115.765 -167.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -172.46 -175.74 40.7 Favored Glycine 0 N--CA 1.475 1.24 0 C-N-CA 120.916 -0.659 . . . . 35.969999999999999 113.258 170.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -58.53 -44.81 89.68 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 112.758 0.651 . . . . 45.159999999999997 112.758 175.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 88.6 m-20 -54.95 -38.5 67.8 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 120.705 0.288 . . . . 41.640000000000001 110.346 -179.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 97.5 t -67.73 -39.98 83.05 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 N-CA-C 112.277 0.473 . . . . 34.340000000000003 112.277 174.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.63 -44.34 86.74 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 120.8 0.333 . . . . 35.049999999999997 111.746 175.179 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 47.9 mtm105 -60.04 -41.52 92.45 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 120.285 -0.566 . . . . 43.299999999999997 111.546 170.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 28.6 tp -61.64 -46.16 90.97 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 112.752 0.649 . . . . 34.93 112.752 -178.055 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 27.0 t80 -68.98 -35.52 76.83 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.688 -0.687 . . . . 34.259999999999998 111.531 -179.157 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.64 -48.19 78.25 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 120.175 -0.61 . . . . 32.5 109.804 173.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 51.3 tp -66.87 -34.51 77.94 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 114.178 1.177 . . . . 31.100000000000001 114.178 -175.323 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 4.2 p -68.52 -32.36 54.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.782 0.325 . . . . 30.600000000000001 110.843 178.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -68.48 -34.03 75.19 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.309 -0.405 . . . . 33.0 111.836 172.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 53.5 t -66.71 -47.09 84.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 N-CA-C 110.174 -0.306 . . . . 30.870000000000001 110.174 173.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 17.0 t -60.03 -45.35 95.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 C-N-CA 122.844 0.457 . . . . 31.32 110.696 179.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -61.25 -50.12 74.33 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 123.834 0.854 . . . . 33.710000000000001 111.378 177.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -51.9 -32.78 34.08 Favored 'General case' 0 N--CA 1.462 0.139 0 N-CA-C 109.659 -0.497 . . . . 37.780000000000001 109.659 175.035 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.803 0 C-N-CA 124.637 1.175 . . . . 41.130000000000003 112.027 164.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HOH . . . . . 0.499 ' O ' ' HG3' ' A' ' 80' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 112' ' ' 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 0 . 1 . 001 ecloud build full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 8.7 ptp85 . . . . . 0 N--CA 1.491 1.622 0 CA-C-O 120.594 0.235 . . . . 55.270000000000003 111.476 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.449 ' HE2' ' HB2' ' A' ' 8' ' ' LYS . 8.0 mtpt -89.4 -34.69 16.4 Favored 'General case' 0 N--CA 1.468 0.432 0 C-N-CA 123.129 0.572 . . . . 55.729999999999997 112.525 -179.06 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.587 ' HB1' ' HA ' ' A' ' 10' ' ' ALA . . . -74.68 161.69 29.42 Favored 'General case' 0 CA--C 1.542 0.65 0 C-N-CA 122.736 0.415 . . . . 52.950000000000003 111.596 -178.191 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ALA . . . . . 0.587 ' HA ' ' HB1' ' A' ' 9' ' ' ALA . . . -92.41 38.75 1.01 Allowed 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 124.838 1.255 . . . . 50.5 112.995 3.085 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 37.7 tp -68.13 -35.83 78.73 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-N 115.704 -0.68 . . . . 47.57 109.555 172.111 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 42.9 mt -72.81 -33.23 66.09 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 113.599 0.963 . . . . 44.950000000000003 113.599 -177.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 51.2 m-20 -65.39 -32.3 73.86 Favored 'General case' 0 C--O 1.236 0.379 0 N-CA-C 112.428 0.529 . . . . 45.57 112.428 172.502 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 44.2 tp60 -77.77 -34.01 52.51 Favored 'General case' 0 N--CA 1.471 0.599 0 N-CA-C 112.272 0.471 . . . . 42.979999999999997 112.272 174.367 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 55.5 t -61.73 -39.51 83.54 Favored 'Isoleucine or valine' 0 CA--C 1.519 -0.247 0 N-CA-C 107.493 -1.299 . . . . 38.039999999999999 107.493 172.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -57.26 -41.49 79.73 Favored 'General case' 0 C--O 1.242 0.678 0 O-C-N 123.534 0.521 . . . . 36.350000000000001 110.716 174.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ARG . . . . . . . . . . . . . 47.2 mtt85 -65.47 -38.12 88.87 Favored 'General case' 0 N--CA 1.476 0.873 0 CA-C-N 116.639 -0.255 . . . . 44.68 111.452 175.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 99.5 t -58.98 -50.7 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.579 0 C-N-CA 121.097 -0.241 . . . . 36.020000000000003 110.5 172.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . -57.46 -45.23 93.23 Favored Glycine 0 C--N 1.334 0.456 0 CA-C-N 116.399 -0.364 . . . . 38.210000000000001 113.517 176.798 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LYS . . . . . . . . . . . . . 44.1 tttm -56.64 -45.28 81.69 Favored 'General case' 0 N--CA 1.464 0.262 0 C-N-CA 122.251 0.22 . . . . 46.740000000000002 110.778 176.169 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -59.66 -36.65 76.85 Favored 'General case' 0 N--CA 1.471 0.609 0 N-CA-C 112.231 0.456 . . . . 40.920000000000002 112.231 177.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 75.2 mt -82.06 -12.2 58.38 Favored 'General case' 0 CA--C 1.518 -0.275 0 N-CA-C 112.429 0.529 . . . . 39.93 112.429 -176.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -82.07 34.3 0.41 Allowed 'General case' 0 C--O 1.219 -0.512 0 N-CA-C 114.687 1.365 . . . . 40.219999999999999 114.687 -167.03 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -148.28 115.8 6.28 Favored 'General case' 0 C--N 1.327 -0.381 0 N-CA-C 108.267 -1.012 . . . . 40.32 108.267 178.676 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -62.12 -39.44 97.64 Favored Glycine 0 C--O 1.241 0.588 0 CA-C-O 121.459 0.477 . . . . 39.240000000000002 114.185 -171.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 37.2 ttt180 -72.67 -36.79 68.02 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-N 115.187 -0.506 . . . . 40.289999999999999 111.804 179.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 19.4 ttp180 -58.8 -30.88 67.94 Favored 'General case' 0 C--O 1.246 0.918 0 N-CA-C 113.424 0.898 . . . . 45.969999999999999 113.424 172.003 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -67.14 -23.82 65.84 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 114.041 1.126 . . . . 40.960000000000001 114.041 177.905 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -57.43 -39.5 76.39 Favored 'General case' 0 N--CA 1.468 0.453 0 CA-C-N 116.369 -0.378 . . . . 41.68 110.956 173.08 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 96.8 mt -54.76 -43.45 66.88 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.376 0 CA-C-N 116.361 -0.381 . . . . 36.140000000000001 111.468 175.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 73.1 mt -64.03 -43.53 95.29 Favored 'General case' 0 N--CA 1.467 0.406 0 N-CA-C 112.097 0.406 . . . . 38.640000000000001 112.097 -179.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -61.02 -37.88 84.14 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-O 120.738 0.304 . . . . 47.060000000000002 111.758 174.893 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 28.5 tp -67.13 -40.56 86.8 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 112.664 0.616 . . . . 42.770000000000003 112.664 179.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.604 ' O ' ' HA ' ' A' ' 36' ' ' GLN . 95.8 mt -80.99 -8.95 59.89 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 112.328 0.492 . . . . 43.25 112.328 -178.287 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.495 ' HB2' ' CD1' ' A' ' 81' ' ' ILE . . . -106.45 95.73 5.96 Favored 'General case' 0 CA--C 1.5 -0.963 0 C-N-CA 122.911 0.485 . . . . 49.189999999999998 109.874 -171.675 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' GLN . . . . . 0.604 ' HA ' ' O ' ' A' ' 34' ' ' LEU . 44.3 tp60 -118.44 149.99 40.32 Favored 'General case' 0 CA--C 1.555 1.142 0 CA-C-O 122.461 1.124 . . . . 52.189999999999998 113.186 -6.664 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 136.21 117.02 1.63 Allowed Glycine 0 N--CA 1.444 -0.802 0 N-CA-C 107.475 -2.25 . . . . 45.490000000000002 107.475 175.267 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.584 ' HB2' ' HB3' ' A' ' 80' ' ' ARG . 2.4 tt0 -56.68 143.16 37.32 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.128 0.571 . . . . 39.369999999999997 112.142 176.059 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 5.2 mtp180 -138.64 154.49 48.65 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 120.565 -0.454 . . . . 47.219999999999999 111.476 177.127 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -71.98 151.78 42.97 Favored 'General case' 0 C--O 1.221 -0.43 0 CA-C-N 116.208 -0.451 . . . . 33.310000000000002 110.321 175.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 89.9 t -51.07 -47.0 31.84 Favored 'Isoleucine or valine' 0 C--O 1.247 0.934 0 C-N-CA 123.172 0.589 . . . . 33.259999999999998 111.531 177.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 2.5 tt0 -55.29 -48.0 74.72 Favored 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.718 -0.674 . . . . 46.090000000000003 109.788 -178.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -64.29 -41.81 96.7 Favored 'General case' 0 C--O 1.238 0.469 0 CA-C-N 115.411 -0.813 . . . . 32.07 112.246 -179.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 66.2 mt -64.04 -41.51 92.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 123.226 0.61 . . . . 30.699999999999999 110.594 179.157 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -62.26 -48.43 79.97 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-O 121.283 0.563 . . . . 29.539999999999999 110.149 178.109 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 95.4 m -64.09 -44.34 92.63 Favored 'General case' 0 C--O 1.24 0.593 0 CA-C-N 115.669 -0.696 . . . . 27.98 112.51 -179.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -64.21 -35.21 80.07 Favored 'General case' 0 C--O 1.226 -0.172 0 N-CA-C 112.311 0.485 . . . . 28.07 112.311 -179.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' THR . . . . . . . . . . . . . 78.1 p -98.0 0.72 46.86 Favored 'General case' 0 C--N 1.322 -0.618 0 C-N-CA 120.06 -0.656 . . . . 30.859999999999999 112.511 -175.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 67.86 24.28 74.28 Favored Glycine 0 CA--C 1.53 1.03 0 CA-C-O 119.358 -0.69 . . . . 31.469999999999999 113.904 -177.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' MSE . . . . . . . . . . . . . 53.9 mtt -96.7 141.88 29.41 Favored 'General case' 0 C--O 1.219 -0.528 0 CA-C-N 117.928 0.864 . . . . 44.93 109.238 179.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 8.2 p30 -64.05 159.99 19.04 Favored 'General case' 0 C--O 1.242 0.7 0 N-CA-C 108.649 -0.871 . . . . 32.079999999999998 108.649 168.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -57.3 -38.74 74.45 Favored 'General case' 0 C--O 1.219 -0.534 0 N-CA-C 114.003 1.112 . . . . 36.100000000000001 114.003 -176.764 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 37.3 m -65.28 -48.38 73.36 Favored 'General case' 0 C--O 1.248 0.979 0 N-CA-C 112.363 0.505 . . . . 32.5 112.363 176.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 97.3 m -58.03 -48.52 79.83 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 122.692 0.397 . . . . 31.030000000000001 111.578 175.478 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.76 -47.46 84.6 Favored 'General case' 0 C--N 1.328 -0.367 0 O-C-N 122.082 -0.386 . . . . 32.57 110.795 179.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 31.1 t -66.83 -40.1 87.86 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 116.322 -0.399 . . . . 39.25 111.312 -176.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -57.72 -47.2 83.07 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 112.404 0.52 . . . . 33.159999999999997 112.404 171.317 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 59.2 m-20 -67.1 -38.01 84.91 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 111.698 0.258 . . . . 34.899999999999999 111.698 179.809 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 32.8 mt -63.77 -41.98 97.88 Favored 'General case' 0 N--CA 1.471 0.592 0 N-CA-C 112.769 0.655 . . . . 32.020000000000003 112.769 175.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 -56.9 -43.03 80.95 Favored 'General case' 0 C--O 1.238 0.486 0 N-CA-C 112.635 0.606 . . . . 50.799999999999997 112.635 170.189 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -61.18 -44.49 97.21 Favored 'General case' 0 C--N 1.332 -0.165 0 O-C-N 123.208 0.317 . . . . 33.299999999999997 111.096 177.605 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 91.7 mt -61.19 -42.21 98.19 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 112.821 0.674 . . . . 32.590000000000003 112.821 174.641 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 48.1 tttm -63.92 -43.08 97.0 Favored 'General case' 0 N--CA 1.469 0.496 0 N-CA-C 112.523 0.564 . . . . 40.43 112.523 179.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' SER . . . . . . . . . . . . . 28.6 m -63.22 -26.76 68.94 Favored 'General case' 0 N--CA 1.473 0.693 0 N-CA-C 112.039 0.385 . . . . 34.039999999999999 112.039 178.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -89.2 4.06 84.37 Favored Glycine 0 N--CA 1.45 -0.407 0 C-N-CA 121.593 -0.337 . . . . 32.719999999999999 112.691 176.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . 75.18 17.08 80.28 Favored Glycine 0 C--N 1.335 0.492 0 N-CA-C 114.446 0.538 . . . . 33.960000000000001 114.446 175.642 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 59.7 mt -93.47 -23.15 18.48 Favored 'General case' 0 CA--C 1.531 0.232 0 N-CA-C 113.446 0.906 . . . . 33.119999999999997 113.446 -169.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 31.2 m -132.34 158.16 43.22 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 CA-C-N 116.313 -0.403 . . . . 31.949999999999999 110.148 175.444 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -121.74 160.91 23.58 Favored 'General case' 0 CA--C 1.515 -0.376 0 N-CA-C 108.898 -0.778 . . . . 43.579999999999998 108.898 169.013 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -131.24 149.94 52.36 Favored 'General case' 0 N--CA 1.448 -0.536 0 O-C-N 123.749 0.656 . . . . 34.450000000000003 111.097 -174.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ARG . . . . . . . . . . . . . 51.6 ptt85 -138.59 149.32 45.14 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 108.899 -0.778 . . . . 37.350000000000001 108.899 169.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 7.5 tpp180 -102.82 124.55 48.55 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 108.35 -0.981 . . . . 51.619999999999997 108.35 -178.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -132.73 100.93 5.09 Favored 'General case' 0 N--CA 1.467 0.415 0 CA-C-O 120.991 0.424 . . . . 48.149999999999999 110.023 175.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 71.33 -129.86 17.88 Favored Glycine 0 N--CA 1.461 0.344 0 N-CA-C 109.962 -1.255 . . . . 46.259999999999998 109.962 -174.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' THR . . . . . . . . . . . . . 3.0 t -89.4 6.25 41.51 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 122.882 0.473 . . . . 47.340000000000003 112.144 178.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ARG . . . . . . . . . . . . . 10.8 mtt-85 -113.08 160.61 18.0 Favored 'General case' 0 CA--C 1.512 -0.515 0 CA-C-N 116.072 -0.513 . . . . 55.979999999999997 111.616 -176.043 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 2.5 tt0 -129.94 131.1 45.85 Favored 'General case' 0 N--CA 1.443 -0.802 0 N-CA-C 107.303 -1.369 . . . . 43.219999999999999 107.303 176.118 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' TYR . . . . . . . . . . . . . 92.9 m-85 -112.31 130.08 56.07 Favored 'General case' 0 C--N 1.323 -0.548 0 CA-C-O 120.983 0.421 . . . . 36.710000000000001 109.983 -178.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' TYR . . . . . . . . . . . . . 29.9 m-85 -113.06 145.51 40.76 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.967 -0.56 . . . . 33.920000000000002 110.015 -179.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ARG . . . . . 0.584 ' HB3' ' HB2' ' A' ' 38' ' ' GLU . 41.2 ptt85 -145.27 158.67 43.77 Favored 'General case' 0 N--CA 1.419 -1.977 0 C-N-CA 123.473 0.709 . . . . 31.350000000000001 111.402 176.495 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.495 ' CD1' ' HB2' ' A' ' 35' ' ' ALA . 32.9 mt -54.6 128.41 14.55 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.648 0 O-C-N 124.247 0.967 . . . . 37.689999999999998 108.76 167.151 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -65.23 -31.45 72.63 Favored 'General case' 0 C--O 1.24 0.582 0 N-CA-C 115.765 1.765 . . . . 36.350000000000001 115.765 -167.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . -172.46 -175.74 40.7 Favored Glycine 0 N--CA 1.475 1.24 0 C-N-CA 120.916 -0.659 . . . . 35.969999999999999 113.258 170.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 2.1 tp10 -58.53 -44.81 89.68 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 112.758 0.651 . . . . 45.159999999999997 112.758 175.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 88.6 m-20 -54.95 -38.5 67.8 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-O 120.705 0.288 . . . . 41.640000000000001 110.346 -179.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 97.5 t -67.73 -39.98 83.05 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.667 0 N-CA-C 112.277 0.473 . . . . 34.340000000000003 112.277 174.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -65.63 -44.34 86.74 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-O 120.8 0.333 . . . . 35.049999999999997 111.746 175.179 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 47.9 mtm105 -60.04 -41.52 92.45 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 120.285 -0.566 . . . . 43.299999999999997 111.546 170.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 28.6 tp -61.64 -46.16 90.97 Favored 'General case' 0 N--CA 1.474 0.769 0 N-CA-C 112.752 0.649 . . . . 34.93 112.752 -178.055 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' PHE . . . . . . . . . . . . . 27.0 t80 -68.98 -35.52 76.83 Favored 'General case' 0 C--N 1.323 -0.578 0 CA-C-N 115.688 -0.687 . . . . 34.259999999999998 111.531 -179.157 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -63.64 -48.19 78.25 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 120.175 -0.61 . . . . 32.5 109.804 173.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' LEU . . . . . . . . . . . . . 51.3 tp -66.87 -34.51 77.94 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 114.178 1.177 . . . . 31.100000000000001 114.178 -175.323 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' VAL . . . . . . . . . . . . . 4.2 p -68.52 -32.36 54.97 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.413 0 CA-C-O 120.782 0.325 . . . . 30.600000000000001 110.843 178.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -68.48 -34.03 75.19 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.309 -0.405 . . . . 33.0 111.836 172.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' VAL . . . . . . . . . . . . . 53.5 t -66.71 -47.09 84.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 N-CA-C 110.174 -0.306 . . . . 30.870000000000001 110.174 173.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 17.0 t -60.03 -45.35 95.61 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 C-N-CA 122.844 0.457 . . . . 31.32 110.696 179.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -61.25 -50.12 74.33 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 123.834 0.854 . . . . 33.710000000000001 111.378 177.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -51.9 -32.78 34.08 Favored 'General case' 0 N--CA 1.462 0.139 0 N-CA-C 109.659 -0.497 . . . . 37.780000000000001 109.659 175.035 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.803 0 C-N-CA 124.637 1.175 . . . . 41.130000000000003 112.027 164.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HOH . . . . . 0.499 ' O ' ' HG3' ' A' ' 80' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' 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 0 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_