data_2bho_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 2bho _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 ' 1' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.337 0 N-CA-C 109.824 -0.436 . . . . 67.489999999999995 109.824 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 1.4 m -73.81 174.04 9.02 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 121.003 0.43 . . . . 58.060000000000002 110.683 -179.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 33.0 t80 -60.83 -52.23 65.94 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.76 -0.654 . . . . 49.789999999999999 110.597 179.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 3.5 p -56.04 -43.94 78.31 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 113.493 0.923 . . . . 50.840000000000003 113.493 179.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 9.0 mm-40 -54.91 -56.01 24.3 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 105.653 -1.98 . . . . 63.189999999999998 105.653 179.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -53.32 -57.55 10.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 114.781 -1.1 . . . . 47.75 109.368 179.376 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' MET . . . . . . . . . . . . . 34.2 mmt -50.55 -47.53 57.66 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 113.076 0.769 . . . . 44.75 113.076 179.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 94.0 mt-30 -59.65 -60.42 3.87 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 109.019 -0.734 . . . . 50.149999999999999 109.019 -179.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -48.38 -36.36 14.45 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.166 -0.925 . . . . 62.810000000000002 110.026 -179.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 57.8 tp -64.03 -56.1 17.45 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.597 0.592 . . . . 50.159999999999997 112.597 -179.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -70.83 -36.27 72.83 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.617 -0.433 . . . . 65.579999999999998 111.931 -179.259 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 26.9 tp -67.86 -17.86 64.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.953 0.406 . . . . 53.729999999999997 110.529 -179.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -91.59 -54.47 3.88 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.105 -0.498 . . . . 54.210000000000001 112.042 179.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 74.9 mt -72.7 0.42 10.8 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.93 0.715 . . . . 62.450000000000003 112.93 -179.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 55.41 33.36 58.55 Favored Glycine 0 C--N 1.33 0.232 0 C-N-CA 121.174 -0.536 . . . . 54.969999999999999 113.932 179.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -100.06 142.38 31.61 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.475 -0.565 . . . . 59.479999999999997 109.475 179.827 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 75.7 m-80 -79.43 145.89 33.07 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 106.985 -1.487 . . . . 59.859999999999999 106.985 179.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -135.52 172.96 12.25 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 119.803 -0.759 . . . . 66.790000000000006 112.943 -179.318 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -144.61 111.08 5.61 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 113.419 0.896 . . . . 67.859999999999999 113.419 179.605 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 1.7 t -96.96 129.41 47.04 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.338 0 N-CA-C 108.397 -0.964 . . . . 57.450000000000003 108.397 179.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ASN . . . . . 0.45 ' C ' ' ND2' ' A' ' 21' ' ' ASN . 0.1 OUTLIER -90.32 -158.81 0.56 Allowed 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.365 -0.534 . . . . 54.020000000000003 111.464 179.287 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -74.97 -35.71 62.08 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.706 -0.679 . . . . 56.100000000000001 112.587 -179.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -82.24 7.91 12.5 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 114.388 1.255 . . . . 61.600000000000001 114.388 -178.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.8 t0 71.01 43.47 0.66 Allowed 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.913 0.863 . . . . 51.539999999999999 112.905 179.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 2.3 t -112.25 123.66 68.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.393 -0.821 . . . . 45.299999999999997 109.473 179.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 90.9 m-85 -86.6 142.19 28.45 Favored 'General case' 0 C--O 1.222 -0.379 0 N-CA-C 112.471 0.545 . . . . 44.109999999999999 112.471 179.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 99.4 m -130.38 141.36 50.56 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.072 -0.513 . . . . 52.590000000000003 110.01 179.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' PHE . . . . . . . . . . . . . 5.7 p90 -145.55 134.42 22.45 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 107.66 -1.237 . . . . 65.930000000000007 107.66 178.173 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 7.2 mt-10 -102.15 138.72 38.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.568 -0.742 . . . . 59.289999999999999 112.746 -179.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 58.0 t -101.71 118.87 49.15 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.489 0 N-CA-C 106.909 -1.515 . . . . 55.299999999999997 106.909 179.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 61.89 -121.67 0.74 Allowed 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 104.407 -2.442 . . . . 70.829999999999998 104.407 -179.349 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -131.48 3.46 5.44 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 118.773 -1.679 . . . . 57.590000000000003 114.531 179.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 7.7 p-80 -124.63 -1.89 7.94 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 115.481 1.66 . . . . 58.700000000000003 115.481 -178.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 96.6 mt -117.52 117.15 54.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 116.283 1.957 . . . . 47.759999999999998 116.283 -178.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 66.1 mt-30 -110.03 128.14 55.24 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 115.913 -0.585 . . . . 52.060000000000002 110.384 178.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 94.3 t -120.97 128.38 76.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 C-N-CA 120.145 -0.622 . . . . 39.640000000000001 110.341 179.583 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LEU . . . . . 0.703 ' CG ' ' O ' ' A' 2005 ' ' HOH . 12.9 mt -102.14 142.15 33.84 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.544 -0.539 . . . . 42.609999999999999 109.544 178.443 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 3.8 mp -132.77 114.83 23.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 109.096 -0.705 . . . . 52.280000000000001 109.096 -179.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -129.09 163.09 26.21 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 119.348 -0.941 . . . . 38.170000000000002 109.838 178.941 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -119.1 130.56 55.65 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 106.613 -1.625 . . . . 42.829999999999998 106.613 178.32 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -115.64 141.03 48.62 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 113.443 0.905 . . . . 38.109999999999999 113.443 -179.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 87.3 m-70 51.1 29.5 4.76 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 113.303 0.853 . . . . 40.299999999999997 113.303 179.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 22.3 mt-30 59.4 21.48 9.84 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 114.489 1.292 . . . . 48.390000000000001 114.489 179.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLN . . . . . 0.477 ' O ' ' N ' ' A' ' 87' ' ' LEU . 39.3 mt-30 -139.4 -38.52 0.48 Allowed 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 115.715 1.746 . . . . 64.810000000000002 115.715 -179.324 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' TRP . . . . . . . . . . . . . 48.0 m95 -103.29 130.15 50.48 Favored 'General case' 0 CA--C 1.503 -0.862 0 N-CA-C 117.338 2.347 . . . . 37.049999999999997 117.338 -175.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 56.9 t -98.23 119.37 46.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 N-CA-C 106.488 -1.671 . . . . 42.630000000000003 106.488 177.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLN . . . . . 0.635 ' NE2' ' NE2' ' A' ' 84' ' ' GLN . 34.1 mm-40 -105.85 136.85 44.75 Favored 'General case' 0 CA--C 1.513 -0.469 0 C-N-CA 124.427 1.091 . . . . 52.759999999999998 111.819 -178.595 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 31.4 mt -113.48 140.89 47.73 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 104.657 -2.349 . . . . 41.299999999999997 104.657 176.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 73.0 t80 -146.18 136.41 23.75 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.856 0.36 . . . . 49.390000000000001 111.964 -179.092 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.2 t -156.8 142.52 17.71 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.932 0.396 . . . . 48.520000000000003 110.241 178.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -84.51 146.73 27.43 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.739 0.644 . . . . 61.090000000000003 112.739 -179.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -104.44 -7.04 20.14 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 118.57 2.804 . . . . 62.479999999999997 118.57 -177.695 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 89.52 -106.85 3.35 Favored Glycine 0 CA--C 1.524 0.618 0 C-N-CA 119.804 -1.189 . . . . 69.150000000000006 113.196 -179.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -141.11 51.24 1.6 Allowed 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 108.141 -1.059 . . . . 70.099999999999994 108.141 179.269 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 37.4 t70 -66.47 174.54 2.7 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 114.475 -1.238 . . . . 79.689999999999998 114.173 -178.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 47.5 tp -70.58 99.2 0.22 Allowed Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 123.5 0.72 . . . . 76.569999999999993 109.93 179.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -57.88 -9.19 5.46 Favored 'Trans proline' 0 CA--C 1.53 0.301 0 C-N-CA 122.188 1.925 . . . . 76.310000000000002 114.919 -179.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 7.8 m -86.46 82.61 7.89 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.308 0.484 . . . . 71.120000000000005 112.308 -179.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -123.6 124.07 41.97 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 110.165 -0.309 . . . . 61.740000000000002 110.165 179.456 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -62.0 -21.04 64.52 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 115.013 1.486 . . . . 57.460000000000001 115.013 -178.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 5.4 m120 48.5 59.08 4.58 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 115.568 1.692 . . . . 36.579999999999998 115.568 -179.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 55.4 mt -100.54 159.49 15.11 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 106.92 -1.511 . . . . 39.490000000000002 106.92 178.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 23.1 p90 -89.01 169.55 11.42 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 103.239 -2.875 . . . . 34.689999999999998 103.239 177.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 116.83 -40.72 2.29 Favored Glycine 0 N--CA 1.449 -0.439 0 N-CA-C 117.356 1.702 . . . . 35.859999999999999 117.356 178.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -66.72 -40.53 88.45 Favored 'General case' 0 C--O 1.238 0.495 0 O-C-N 122.026 -0.691 . . . . 69.239999999999995 110.24 -179.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 47.0 m-70 -136.59 155.52 49.82 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 113.409 0.892 . . . . 41.359999999999999 113.409 -178.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' TRP . . . . . . . . . . . . . 85.2 m95 -131.95 108.47 14.04 Favored Pre-proline 0 N--CA 1.442 -0.829 0 C-N-CA 119.455 -0.898 . . . . 40.990000000000002 110.01 178.048 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 96.0 Cg_endo -73.28 172.33 61.16 Favored 'Cis proline' 0 CA--C 1.534 0.505 0 C-N-CA 122.859 -1.725 . . . . 37.119999999999997 112.767 -0.374 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -68.44 148.88 50.01 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 115.068 1.507 . . . . 43.380000000000003 115.068 -178.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -101.96 114.54 28.74 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 102.796 -3.039 . . . . 44.090000000000003 102.796 176.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 61.1 t -101.42 138.29 26.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 CA-C-O 120.69 0.281 . . . . 40.469999999999999 111.324 -178.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -103.35 123.86 47.6 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 107.648 -1.241 . . . . 46.170000000000002 107.648 179.524 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -123.12 177.14 16.62 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.087 -1.054 . . . . 46.640000000000001 112.791 -179.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -117.15 113.65 22.56 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.989 -0.745 . . . . 70.569999999999993 108.989 179.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 54.9 tp -124.26 118.7 27.38 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 106.744 -1.576 . . . . 55.369999999999997 106.744 178.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 66.13 31.9 8.5 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 104.389 -2.448 . . . . 71.959999999999994 104.389 -178.925 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 70.33 -12.62 1.76 Allowed Glycine 0 N--CA 1.448 -0.508 0 N-CA-C 109.409 -1.476 . . . . 63.140000000000001 109.409 -178.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -89.58 130.04 44.8 Favored Pre-proline 0 C--N 1.332 -0.18 0 N-CA-C 113.216 0.821 . . . . 70.969999999999999 113.216 -179.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_exo -57.33 127.87 27.3 Favored 'Trans proline' 0 C--O 1.234 0.312 1 C-N-CA 127.954 5.77 . . . . 57.539999999999999 115.852 -179.74 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 2.7 pp -134.28 163.83 35.95 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 CA-C-N 115.893 -0.594 . . . . 48.240000000000002 109.976 177.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 16.1 tp -128.1 136.95 51.89 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 107.446 -1.316 . . . . 40.689999999999998 107.446 179.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 67.4 p-90 -145.11 158.61 43.77 Favored 'General case' 0 CA--C 1.519 -0.25 0 C-N-CA 120.047 -0.661 . . . . 42.979999999999997 112.479 178.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 6.1 t -146.91 147.22 30.56 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 106.324 -1.732 . . . . 37.600000000000001 106.324 -179.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLN . . . . . 0.635 ' NE2' ' NE2' ' A' ' 47' ' ' GLN . 2.6 pt20 -143.17 150.86 39.98 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 119.343 -0.943 . . . . 39.25 110.319 -178.682 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -158.34 152.83 24.5 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 105.901 -1.888 . . . . 46.32 105.901 -178.257 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 37.9 p -75.78 154.28 36.39 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.389 -0.967 . . . . 47.170000000000002 108.389 -179.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' LEU . . . . . 0.477 ' N ' ' O ' ' A' ' 44' ' ' GLN . 0.6 OUTLIER -71.22 -40.52 71.06 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.007 -0.542 . . . . 50.329999999999998 109.805 179.788 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' VAL . . . . . 0.774 ' CG2' ' O ' ' A' 2018 ' ' HOH . 21.3 t -49.75 122.91 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-N 115.558 -0.746 . . . . 59.109999999999999 112.997 -179.865 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 81.82 -4.17 76.02 Favored Glycine 0 CA--C 1.519 0.308 0 CA-C-N 115.904 -0.589 . . . . 57.420000000000002 113.57 179.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -75.93 113.46 13.45 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 112.751 0.649 . . . . 56.380000000000003 112.751 -178.863 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -102.7 163.43 12.22 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.343 -0.389 . . . . 77.989999999999995 110.161 178.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ILE . . . . . . . . . . . . . 3.4 tt -58.65 -30.95 42.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 112.382 0.512 . . . . 53.950000000000003 112.382 -179.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -69.34 -41.49 76.54 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 111.946 0.351 . . . . 60.950000000000003 111.946 -179.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.18 -38.01 81.57 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.669 -0.863 . . . . 75.219999999999999 108.669 178.94 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.31 -47.09 86.68 Favored 'General case' 0 C--N 1.331 -0.219 0 O-C-N 123.773 0.67 . . . . 48.770000000000003 110.624 179.649 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -61.96 -48.42 80.45 Favored 'General case' 0 C--O 1.241 0.621 0 CA-C-N 115.598 -0.728 . . . . 50.770000000000003 111.716 -179.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.49 -43.41 98.88 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.644 -0.707 . . . . 41.390000000000001 112.076 -179.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 17.0 t90 -59.6 -50.62 73.19 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 107.858 -1.164 . . . . 42.289999999999999 107.858 178.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 5.1 mt -57.26 -55.19 38.0 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 111.932 0.345 . . . . 45.439999999999998 111.932 178.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -49.71 -47.26 50.57 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 108.284 -1.006 . . . . 69.569999999999993 108.284 -179.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ARG . . . . . 0.557 ' NH2' ' O ' ' A' 2020 ' ' HOH . 33.2 ttm180 -60.38 -40.8 92.13 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 113.933 -1.485 . . . . 42.0 111.923 -179.097 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' PHE . . . . . . . . . . . . . 48.5 t80 -72.01 -43.24 65.37 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 108.631 -0.877 . . . . 39.200000000000003 108.631 179.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ILE . . . . . . . . . . . . . 25.3 mm -56.65 -49.22 78.87 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.322 0 CA-C-O 121.633 0.73 . . . . 45.140000000000001 109.712 178.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ASP . . . . . 0.525 ' CG ' ' O ' ' A' 2021 ' ' HOH . 1.3 t0 -53.33 -52.07 60.38 Favored 'General case' 0 C--O 1.266 1.972 0 CA-C-N 114.338 -1.301 . . . . 77.519999999999996 110.679 -178.264 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -58.61 -38.89 78.99 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 127.687 3.117 . . . . 39.399999999999999 111.761 -178.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 81.8 mt -61.74 -55.02 27.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 N-CA-C 108.134 -1.062 . . . . 44.090000000000003 108.134 179.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -51.32 -53.49 35.46 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.886 -0.597 . . . . 66.219999999999999 112.57 179.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -55.23 -25.57 34.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.931 -0.577 . . . . 67.819999999999993 112.398 -179.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 46.7 mtt180 -87.92 -42.99 12.12 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.678 0.621 . . . . 51.359999999999999 112.678 -179.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' LYS . . . . . 0.807 ' CD ' ' O ' ' A' 2010 ' ' HOH . 61.7 tttm . . . . . 0 C--O 1.232 0.178 0 C-N-CA 123.219 0.608 . . . . 57.049999999999997 110.793 -179.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1111 ' ' ' PT' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2005 ' ' HOH . . . . . 0.703 ' O ' ' CG ' ' A' ' 37' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2009 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2010 ' ' HOH . . . . . 0.807 ' O ' ' CD ' ' A' ' 110' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2011 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2012 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2013 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2014 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2015 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2016 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2017 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2018 ' ' HOH . . . . . 0.774 ' O ' ' CG2' ' A' ' 88' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2019 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2020 ' ' HOH . . . . . 0.557 ' O ' ' NH2' ' A' ' 101' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2021 ' ' HOH . . . . . 0.525 ' O ' ' CG ' ' A' ' 104' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2022 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' THR . . . . . 0.86 HG22 ' HG3' ' A' ' 5' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.337 0 N-CA-C 109.824 -0.436 . . . . 67.489999999999995 109.824 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 2' ' ' THR . . . . . 0.531 HG22 ' H ' ' A' ' 3' ' ' PHE . 1.4 m -73.81 174.04 9.02 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 121.003 0.43 . . . . 58.060000000000002 110.683 -179.419 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' PHE . . . . . 0.876 ' HZ ' HG22 ' A' ' 38' ' ' ILE . 33.0 t80 -60.83 -52.23 65.94 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.76 -0.654 . . . . 49.789999999999999 110.597 179.629 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' THR . . . . . 0.61 HG22 ' OH ' ' A' ' 26' ' ' TYR . 3.5 p -56.04 -43.94 78.31 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 113.493 0.923 . . . . 50.840000000000003 113.493 179.944 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' GLU . . . . . 0.86 ' HG3' HG22 ' A' ' 1' ' ' THR . 9.0 mm-40 -54.91 -56.01 24.3 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 105.653 -1.98 . . . . 63.189999999999998 105.653 179.22 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' LEU . . . . . 0.431 ' CD2' ' HG3' ' A' ' 95' ' ' MET . 0.3 OUTLIER -53.32 -57.55 10.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 114.781 -1.1 . . . . 47.75 109.368 179.376 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 7' ' ' MET . . . . . 0.506 ' O ' ' HD1' ' A' ' 11' ' ' PHE . 34.2 mmt -50.55 -47.53 57.66 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 113.076 0.769 . . . . 44.75 113.076 179.824 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLN . . . . . 0.439 ' HG3' ' O ' ' A' ' 4' ' ' THR . 94.0 mt-30 -59.65 -60.42 3.87 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 109.019 -0.734 . . . . 50.149999999999999 109.019 -179.561 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' GLN . . . . . 0.89 ' HG2' HD12 ' A' ' 92' ' ' ILE . 60.0 tt0 -48.38 -36.36 14.45 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.166 -0.925 . . . . 62.810000000000002 110.026 -179.697 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 57.8 tp -64.03 -56.1 17.45 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.597 0.592 . . . . 50.159999999999997 112.597 -179.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' PHE . . . . . 0.684 ' CD2' ' HB3' ' A' ' 18' ' ' HIS . 71.3 m-85 -70.83 -36.27 72.83 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.617 -0.433 . . . . 65.579999999999998 111.931 -179.259 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 26.9 tp -67.86 -17.86 64.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.953 0.406 . . . . 53.729999999999997 110.529 -179.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -91.59 -54.47 3.88 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.105 -0.498 . . . . 54.210000000000001 112.042 179.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LEU . . . . . 0.676 HD21 ' NE2' ' A' ' 96' ' ' GLN . 74.9 mt -72.7 0.42 10.8 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.93 0.715 . . . . 62.450000000000003 112.93 -179.371 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 55.41 33.36 58.55 Favored Glycine 0 C--N 1.33 0.232 0 C-N-CA 121.174 -0.536 . . . . 54.969999999999999 113.932 179.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -100.06 142.38 31.61 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.475 -0.565 . . . . 59.479999999999997 109.475 179.827 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 75.7 m-80 -79.43 145.89 33.07 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 106.985 -1.487 . . . . 59.859999999999999 106.985 179.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' HIS . . . . . 0.684 ' HB3' ' CD2' ' A' ' 11' ' ' PHE . 0.0 OUTLIER -135.52 172.96 12.25 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 119.803 -0.759 . . . . 66.790000000000006 112.943 -179.318 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLN . . . . . 0.621 ' CG ' ' HB ' ' A' ' 27' ' ' THR . 0.3 OUTLIER -144.61 111.08 5.61 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 113.419 0.896 . . . . 67.859999999999999 113.419 179.605 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 1.7 t -96.96 129.41 47.04 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.338 0 N-CA-C 108.397 -0.964 . . . . 57.450000000000003 108.397 179.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 51.0 p30 -90.32 -158.81 0.56 Allowed 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.365 -0.534 . . . . 54.020000000000003 111.464 179.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -74.97 -35.71 62.08 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.706 -0.679 . . . . 56.100000000000001 112.587 -179.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -82.24 7.91 12.5 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 114.388 1.255 . . . . 61.600000000000001 114.388 -178.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.8 t0 71.01 43.47 0.66 Allowed 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.913 0.863 . . . . 51.539999999999999 112.905 179.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' VAL . . . . . 0.725 HG22 ' HB2' ' A' ' 39' ' ' ALA . 2.3 t -112.25 123.66 68.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.393 -0.821 . . . . 45.299999999999997 109.473 179.015 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' TYR . . . . . 0.61 ' OH ' HG22 ' A' ' 4' ' ' THR . 90.9 m-85 -86.6 142.19 28.45 Favored 'General case' 0 C--O 1.222 -0.379 0 N-CA-C 112.471 0.545 . . . . 44.109999999999999 112.471 179.679 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' THR . . . . . 0.621 ' HB ' ' CG ' ' A' ' 19' ' ' GLN . 99.4 m -130.38 141.36 50.56 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.072 -0.513 . . . . 52.590000000000003 110.01 179.265 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' PHE . . . . . 0.622 ' CZ ' HD11 ' A' ' 103' ' ' ILE . 5.7 p90 -145.55 134.42 22.45 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 107.66 -1.237 . . . . 65.930000000000007 107.66 178.173 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLU . . . . . 0.491 ' HA ' ' O ' ' A' ' 34' ' ' ILE . 7.2 mt-10 -102.15 138.72 38.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.568 -0.742 . . . . 59.289999999999999 112.746 -179.357 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' VAL . . . . . 0.739 HG21 HD12 ' A' ' 103' ' ' ILE . 58.0 t -101.71 118.87 49.15 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.489 0 N-CA-C 106.909 -1.515 . . . . 55.299999999999997 106.909 179.98 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 61.89 -121.67 0.74 Allowed 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 104.407 -2.442 . . . . 70.829999999999998 104.407 -179.349 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -131.48 3.46 5.44 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 118.773 -1.679 . . . . 57.590000000000003 114.531 179.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 7.7 p-80 -124.63 -1.89 7.94 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 115.481 1.66 . . . . 58.700000000000003 115.481 -178.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ILE . . . . . 0.732 ' HB ' ' HB ' ' A' ' 30' ' ' VAL . 96.6 mt -117.52 117.15 54.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 116.283 1.957 . . . . 47.759999999999998 116.283 -178.659 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLN . . . . . 0.474 ' HG2' ' HG2' ' A' ' 29' ' ' GLU . 66.1 mt-30 -110.03 128.14 55.24 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 115.913 -0.585 . . . . 52.060000000000002 110.384 178.988 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' VAL . . . . . 0.524 HG21 ' CD1' ' A' ' 103' ' ' ILE . 94.3 t -120.97 128.38 76.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 C-N-CA 120.145 -0.622 . . . . 39.640000000000001 110.341 179.583 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LEU . . . . . 0.899 ' HG ' ' O ' ' A' 2005 ' ' HOH . 12.9 mt -102.14 142.15 33.84 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.544 -0.539 . . . . 42.609999999999999 109.544 178.443 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ILE . . . . . 0.876 HG22 ' HZ ' ' A' ' 3' ' ' PHE . 3.8 mp -132.77 114.83 23.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 109.096 -0.705 . . . . 52.280000000000001 109.096 -179.192 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ALA . . . . . 0.725 ' HB2' HG22 ' A' ' 25' ' ' VAL . . . -129.09 163.09 26.21 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 119.348 -0.941 . . . . 38.170000000000002 109.838 178.941 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' CYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 45' ' ' TRP . 0.1 OUTLIER -119.1 130.56 55.65 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 106.613 -1.625 . . . . 42.829999999999998 106.613 178.32 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -115.64 141.03 48.62 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 113.443 0.905 . . . . 38.109999999999999 113.443 -179.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 87.3 m-70 51.1 29.5 4.76 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 113.303 0.853 . . . . 40.299999999999997 113.303 179.051 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLN . . . . . 0.639 ' HG3' ' O ' ' A' 2008 ' ' HOH . 80.8 mt-30 59.4 21.48 9.84 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 114.489 1.292 . . . . 48.390000000000001 114.489 179.49 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLN . . . . . 0.432 ' O ' ' N ' ' A' ' 87' ' ' LEU . 39.3 mt-30 -139.4 -38.52 0.48 Allowed 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 115.715 1.746 . . . . 64.810000000000002 115.715 -179.324 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' TRP . . . . . 0.418 ' O ' ' HA ' ' A' ' 40' ' ' CYS . 48.0 m95 -103.29 130.15 50.48 Favored 'General case' 0 CA--C 1.503 -0.862 0 N-CA-C 117.338 2.347 . . . . 37.049999999999997 117.338 -175.921 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' VAL . . . . . 0.918 HG11 ' HE1' ' A' ' 95' ' ' MET . 56.9 t -98.23 119.37 46.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 N-CA-C 106.488 -1.671 . . . . 42.630000000000003 106.488 177.448 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLN . . . . . 0.478 ' NE2' ' OE1' ' A' ' 84' ' ' GLN . 34.1 mm-40 -105.85 136.85 44.75 Favored 'General case' 0 CA--C 1.513 -0.469 0 C-N-CA 124.427 1.091 . . . . 52.759999999999998 111.819 -178.595 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 31.4 mt -113.48 140.89 47.73 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 104.657 -2.349 . . . . 41.299999999999997 104.657 176.204 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' PHE . . . . . 0.473 ' CZ ' HG21 ' A' ' 80' ' ' ILE . 73.0 t80 -146.18 136.41 23.75 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.856 0.36 . . . . 49.390000000000001 111.964 -179.092 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.2 t -156.8 142.52 17.71 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.932 0.396 . . . . 48.520000000000003 110.241 178.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -84.51 146.73 27.43 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.739 0.644 . . . . 61.090000000000003 112.739 -179.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' LEU . . . . . 0.405 HD21 ' HB2' ' A' ' 81' ' ' LEU . 0.0 OUTLIER -104.44 -7.04 20.14 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 118.57 2.804 . . . . 62.479999999999997 118.57 -177.695 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 89.52 -106.85 3.35 Favored Glycine 0 CA--C 1.524 0.618 0 C-N-CA 119.804 -1.189 . . . . 69.150000000000006 113.196 -179.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -141.11 51.24 1.6 Allowed 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 108.141 -1.059 . . . . 70.099999999999994 108.141 179.269 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ASP . . . . . 0.465 ' O ' ' HD3' ' A' ' 57' ' ' PRO . 37.4 t70 -66.47 174.54 2.7 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 114.475 -1.238 . . . . 79.689999999999998 114.173 -178.791 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 47.5 tp -70.58 99.2 0.22 Allowed Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 123.5 0.72 . . . . 76.569999999999993 109.93 179.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' PRO . . . . . 0.465 ' HD3' ' O ' ' A' ' 55' ' ' ASP . 93.7 Cg_endo -57.88 -9.19 5.46 Favored 'Trans proline' 0 CA--C 1.53 0.301 0 C-N-CA 122.188 1.925 . . . . 76.310000000000002 114.919 -179.765 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 7.8 m -86.46 82.61 7.89 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.308 0.484 . . . . 71.120000000000005 112.308 -179.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 10.3 t-20 -123.6 124.07 41.97 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 110.165 -0.309 . . . . 61.740000000000002 110.165 179.456 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -62.0 -21.04 64.52 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 115.013 1.486 . . . . 57.460000000000001 115.013 -178.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 21.8 m-20 48.5 59.08 4.58 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 115.568 1.692 . . . . 36.579999999999998 115.568 -179.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 55.4 mt -100.54 159.49 15.11 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 106.92 -1.511 . . . . 39.490000000000002 106.92 178.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' PHE . . . . . 0.506 ' HB2' ' O ' ' A' 2012 ' ' HOH . 23.1 p90 -89.01 169.55 11.42 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 103.239 -2.875 . . . . 34.689999999999998 103.239 177.799 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 116.83 -40.72 2.29 Favored Glycine 0 N--CA 1.449 -0.439 0 N-CA-C 117.356 1.702 . . . . 35.859999999999999 117.356 178.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -66.72 -40.53 88.45 Favored 'General case' 0 C--O 1.238 0.495 0 O-C-N 122.026 -0.691 . . . . 69.239999999999995 110.24 -179.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 34.0 m80 -136.59 155.52 49.82 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 113.409 0.892 . . . . 41.359999999999999 113.409 -178.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' TRP . . . . . 0.411 ' HA ' ' HA ' ' A' ' 68' ' ' PRO . 85.2 m95 -131.95 108.47 14.04 Favored Pre-proline 0 N--CA 1.442 -0.829 0 C-N-CA 119.455 -0.898 . . . . 40.990000000000002 110.01 178.048 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' PRO . . . . . 0.411 ' HA ' ' HA ' ' A' ' 67' ' ' TRP . 96.0 Cg_endo -73.28 172.33 61.16 Favored 'Cis proline' 0 CA--C 1.534 0.505 0 C-N-CA 122.859 -1.725 . . . . 37.119999999999997 112.767 -0.374 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ALA . . . . . 0.558 ' HB2' ' O ' ' A' 2012 ' ' HOH . . . -68.44 148.88 50.01 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 115.068 1.507 . . . . 43.380000000000003 115.068 -178.472 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 55.9 m170 -101.96 114.54 28.74 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 102.796 -3.039 . . . . 44.090000000000003 102.796 176.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 61.1 t -101.42 138.29 26.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 CA-C-O 120.69 0.281 . . . . 40.469999999999999 111.324 -178.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 17.5 tt0 -103.35 123.86 47.6 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 107.648 -1.241 . . . . 46.170000000000002 107.648 179.524 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -123.12 177.14 16.62 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.087 -1.054 . . . . 46.640000000000001 112.791 -179.654 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ARG . . . . . 0.447 HH11 ' HB2' ' A' ' 57' ' ' PRO . 96.2 mtt180 -117.15 113.65 22.56 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.989 -0.745 . . . . 70.569999999999993 108.989 179.252 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 54.9 tp -124.26 118.7 27.38 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 106.744 -1.576 . . . . 55.369999999999997 106.744 178.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ASP . . . . . 0.517 ' C ' ' H ' ' A' ' 78' ' ' LYS . 1.0 OUTLIER 66.13 31.9 8.5 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 104.389 -2.448 . . . . 71.959999999999994 104.389 -178.925 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 70.33 -12.62 1.76 Allowed Glycine 0 N--CA 1.448 -0.508 0 N-CA-C 109.409 -1.476 . . . . 63.140000000000001 109.409 -178.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LYS . . . . . 0.517 ' H ' ' C ' ' A' ' 76' ' ' ASP . 84.9 tttt -89.58 130.04 44.8 Favored Pre-proline 0 C--N 1.332 -0.18 0 N-CA-C 113.216 0.821 . . . . 70.969999999999999 113.216 -179.683 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 78' ' ' LYS . 73.9 Cg_exo -57.33 127.87 27.3 Favored 'Trans proline' 0 C--O 1.234 0.312 1 C-N-CA 127.954 5.77 . . . . 57.539999999999999 115.852 -179.74 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ILE . . . . . 0.473 HG21 ' CZ ' ' A' ' 49' ' ' PHE . 2.7 pp -134.28 163.83 35.95 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 CA-C-N 115.893 -0.594 . . . . 48.240000000000002 109.976 177.634 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' LEU . . . . . 0.405 ' HB2' HD21 ' A' ' 52' ' ' LEU . 16.1 tp -128.1 136.95 51.89 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 107.446 -1.316 . . . . 40.689999999999998 107.446 179.511 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 67.4 p-90 -145.11 158.61 43.77 Favored 'General case' 0 CA--C 1.519 -0.25 0 C-N-CA 120.047 -0.661 . . . . 42.979999999999997 112.479 178.451 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 6.1 t -146.91 147.22 30.56 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 106.324 -1.732 . . . . 37.600000000000001 106.324 -179.019 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLN . . . . . 0.478 ' OE1' ' NE2' ' A' ' 47' ' ' GLN . 13.4 pt20 -143.17 150.86 39.98 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 119.343 -0.943 . . . . 39.25 110.319 -178.682 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 57.5 tt0 -158.34 152.83 24.5 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 105.901 -1.888 . . . . 46.32 105.901 -178.257 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 37.9 p -75.78 154.28 36.39 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.389 -0.967 . . . . 47.170000000000002 108.389 -179.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' LEU . . . . . 0.576 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 0.6 OUTLIER -71.22 -40.52 71.06 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.007 -0.542 . . . . 50.329999999999998 109.805 179.788 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 88' ' ' VAL . . . . . 1.01 HG23 ' O ' ' A' 2018 ' ' HOH . 21.3 t -49.75 122.91 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-N 115.558 -0.746 . . . . 59.109999999999999 112.997 -179.865 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 81.82 -4.17 76.02 Favored Glycine 0 CA--C 1.519 0.308 0 CA-C-N 115.904 -0.589 . . . . 57.420000000000002 113.57 179.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LEU . . . . . 0.576 ' HB2' ' O ' ' A' ' 87' ' ' LEU . 0.3 OUTLIER -75.93 113.46 13.45 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 112.751 0.649 . . . . 56.380000000000003 112.751 -178.863 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -102.7 163.43 12.22 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.343 -0.389 . . . . 77.989999999999995 110.161 178.44 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ILE . . . . . 0.89 HD12 ' HG2' ' A' ' 9' ' ' GLN . 3.4 tt -58.65 -30.95 42.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 112.382 0.512 . . . . 53.950000000000003 112.382 -179.277 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -69.34 -41.49 76.54 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 111.946 0.351 . . . . 60.950000000000003 111.946 -179.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.18 -38.01 81.57 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.669 -0.863 . . . . 75.219999999999999 108.669 178.94 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' MET . . . . . 0.918 ' HE1' HG11 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -59.31 -47.09 86.68 Favored 'General case' 0 C--N 1.331 -0.219 0 O-C-N 123.773 0.67 . . . . 48.770000000000003 110.624 179.649 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 96' ' ' GLN . . . . . 0.676 ' NE2' HD21 ' A' ' 14' ' ' LEU . 63.1 tt0 -61.96 -48.42 80.45 Favored 'General case' 0 C--O 1.241 0.621 0 CA-C-N 115.598 -0.728 . . . . 50.770000000000003 111.716 -179.48 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.49 -43.41 98.88 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.644 -0.707 . . . . 41.390000000000001 112.076 -179.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 17.0 t90 -59.6 -50.62 73.19 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 107.858 -1.164 . . . . 42.289999999999999 107.858 178.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' LEU . . . . . 0.512 HD22 ' CZ ' ' A' ' 28' ' ' PHE . 5.1 mt -57.26 -55.19 38.0 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 111.932 0.345 . . . . 45.439999999999998 111.932 178.807 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -49.71 -47.26 50.57 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 108.284 -1.006 . . . . 69.569999999999993 108.284 -179.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ARG . . . . . 0.616 ' HD2' ' O ' ' A' 2019 ' ' HOH . 33.2 ttm180 -60.38 -40.8 92.13 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 113.933 -1.485 . . . . 42.0 111.923 -179.097 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' PHE . . . . . 0.583 ' O ' HG13 ' A' ' 106' ' ' ILE . 48.5 t80 -72.01 -43.24 65.37 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 108.631 -0.877 . . . . 39.200000000000003 108.631 179.907 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ILE . . . . . 0.739 HD12 HG21 ' A' ' 30' ' ' VAL . 25.3 mm -56.65 -49.22 78.87 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.322 0 CA-C-O 121.633 0.73 . . . . 45.140000000000001 109.712 178.911 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ASP . . . . . 0.546 ' HA ' ' O ' ' A' 2021 ' ' HOH . 1.3 t0 -53.33 -52.07 60.38 Favored 'General case' 0 C--O 1.266 1.972 0 CA-C-N 114.338 -1.301 . . . . 77.519999999999996 110.679 -178.264 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ASP . . . . . 0.688 ' O ' ' HG3' ' A' ' 109' ' ' ARG . 48.9 t0 -58.61 -38.89 78.99 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 127.687 3.117 . . . . 39.399999999999999 111.761 -178.963 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ILE . . . . . 0.583 HG13 ' O ' ' A' ' 102' ' ' PHE . 81.8 mt -61.74 -55.02 27.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 N-CA-C 108.134 -1.062 . . . . 44.090000000000003 108.134 179.283 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -51.32 -53.49 35.46 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.886 -0.597 . . . . 66.219999999999999 112.57 179.926 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -55.23 -25.57 34.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.931 -0.577 . . . . 67.819999999999993 112.398 -179.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ARG . . . . . 0.688 ' HG3' ' O ' ' A' ' 105' ' ' ASP . 46.7 mtt180 -87.92 -42.99 12.12 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.678 0.621 . . . . 51.359999999999999 112.678 -179.973 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 110' ' ' LYS . . . . . 1.209 ' HD2' ' O ' ' A' 2010 ' ' HOH . 61.7 tttm . . . . . 0 C--O 1.232 0.178 0 C-N-CA 123.219 0.608 . . . . 57.049999999999997 110.793 -179.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1111 ' ' ' PT' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2005 ' ' HOH . . . . . 0.899 ' O ' ' HG ' ' A' ' 37' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2008 ' ' HOH . . . . . 0.639 ' O ' ' HG3' ' A' ' 43' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2009 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2010 ' ' HOH . . . . . 1.209 ' O ' ' HD2' ' A' ' 110' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2011 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2012 ' ' HOH . . . . . 0.558 ' O ' ' HB2' ' A' ' 69' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2013 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2014 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2015 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2016 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2017 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2018 ' ' HOH . . . . . 1.01 ' O ' HG23 ' A' ' 88' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2019 ' ' HOH . . . . . 0.616 ' O ' ' HD2' ' A' ' 101' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2020 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2021 ' ' HOH . . . . . 0.546 ' O ' ' HA ' ' A' ' 104' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2022 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' THR . . . . . 0.86 HG22 ' HG3' ' A' ' 5' ' ' GLU . 0.2 OUTLIER . . . . . 0 N--CA 1.486 1.337 0 N-CA-C 109.824 -0.436 . . . . 67.49 109.824 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' THR . . . . . 0.531 HG22 ' H ' ' A' ' 3' ' ' PHE . 1.4 m -73.81 174.04 9.02 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 121.003 0.43 . . . . 58.06 110.683 -179.419 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.876 ' HZ ' HG22 ' A' ' 38' ' ' ILE . 33.0 t80 -60.83 -52.23 65.94 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-N 115.76 -0.654 . . . . 49.79 110.597 179.629 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' THR . . . . . 0.61 HG22 ' OH ' ' A' ' 26' ' ' TYR . 3.5 p -56.04 -43.94 78.31 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 113.493 0.923 . . . . 50.84 113.493 179.944 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.86 ' HG3' HG22 ' A' ' 1' ' ' THR . 9.0 mm-40 -54.91 -56.01 24.3 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 105.653 -1.98 . . . . 63.19 105.653 179.22 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' LEU . . . . . 0.431 ' CD2' ' HG3' ' A' ' 95' ' ' MET . 0.3 OUTLIER -53.32 -57.55 10.19 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 114.781 -1.1 . . . . 47.75 109.368 179.376 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' MET . . . . . 0.506 ' O ' ' HD1' ' A' ' 11' ' ' PHE . 34.2 mmt -50.55 -47.53 57.66 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 113.076 0.769 . . . . 44.75 113.076 179.824 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLN . . . . . 0.439 ' HG3' ' O ' ' A' ' 4' ' ' THR . 94.0 mt-30 -59.65 -60.42 3.87 Favored 'General case' 0 CA--C 1.51 -0.565 0 N-CA-C 109.019 -0.734 . . . . 50.15 109.019 -179.561 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.89 ' HG2' HD12 ' A' ' 92' ' ' ILE . 7.5 tt0 -48.38 -36.36 14.45 Favored 'General case' 0 N--CA 1.452 -0.373 0 CA-C-N 115.166 -0.925 . . . . 62.81 110.026 -179.697 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 57.8 tp -64.03 -56.1 17.45 Favored 'General case' 0 C--N 1.329 -0.323 0 N-CA-C 112.597 0.592 . . . . 50.16 112.597 -179.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.684 ' CD2' ' HB3' ' A' ' 18' ' ' HIS . 71.3 m-85 -70.83 -36.27 72.83 Favored 'General case' 0 C--N 1.327 -0.386 0 C-N-CA 120.617 -0.433 . . . . 65.58 111.931 -179.259 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 26.9 tp -67.86 -17.86 64.63 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-O 120.953 0.406 . . . . 53.73 110.529 -179.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -91.59 -54.47 3.88 Favored 'General case' 0 C--N 1.327 -0.393 0 CA-C-N 116.105 -0.498 . . . . 54.21 112.042 179.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.54 HD21 ' CD ' ' A' ' 96' ' ' GLN . 74.9 mt -72.7 0.42 10.8 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 112.93 0.715 . . . . 62.45 112.93 -179.371 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 55.41 33.36 58.55 Favored Glycine 0 C--N 1.33 0.232 0 C-N-CA 121.174 -0.536 . . . . 54.97 113.932 179.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -100.06 142.38 31.61 Favored 'General case' 0 C--N 1.328 -0.336 0 N-CA-C 109.475 -0.565 . . . . 59.48 109.475 179.827 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 75.7 m-80 -79.43 145.89 33.07 Favored 'General case' 0 C--N 1.332 -0.193 0 N-CA-C 106.985 -1.487 . . . . 59.86 106.985 179.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' HIS . . . . . 0.684 ' HB3' ' CD2' ' A' ' 11' ' ' PHE . 0.7 OUTLIER -135.52 172.96 12.25 Favored 'General case' 0 C--N 1.328 -0.351 0 C-N-CA 119.803 -0.759 . . . . 66.79 112.943 -179.318 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLN . . . . . 0.621 ' CG ' ' HB ' ' A' ' 27' ' ' THR . 0.3 OUTLIER -144.61 111.08 5.61 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 113.419 0.896 . . . . 67.86 113.419 179.605 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 1.7 t -96.96 129.41 47.04 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.338 0 N-CA-C 108.397 -0.964 . . . . 57.45 108.397 179.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.596 ' ND2' ' H ' ' A' ' 25' ' ' VAL . 0.1 OUTLIER -90.32 -158.81 0.56 Allowed 'General case' 0 C--N 1.327 -0.381 0 C-N-CA 120.365 -0.534 . . . . 54.02 111.464 179.287 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 22.3 mt-10 -74.97 -35.71 62.08 Favored 'General case' 0 C--N 1.326 -0.423 0 CA-C-N 115.706 -0.679 . . . . 56.1 112.587 -179.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 15.4 m120 -82.24 7.91 12.5 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 114.388 1.255 . . . . 61.6 114.388 -178.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 3.8 t0 71.01 43.47 0.66 Allowed 'General case' 0 CA--C 1.538 0.484 0 CA-C-O 121.913 0.863 . . . . 51.54 112.905 179.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.725 HG22 ' HB2' ' A' ' 39' ' ' ALA . 2.3 t -112.25 123.66 68.2 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.389 0 CA-C-N 115.393 -0.821 . . . . 45.3 109.473 179.015 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' TYR . . . . . 0.61 ' OH ' HG22 ' A' ' 4' ' ' THR . 90.9 m-85 -86.6 142.19 28.45 Favored 'General case' 0 C--O 1.222 -0.379 0 N-CA-C 112.471 0.545 . . . . 44.11 112.471 179.679 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' THR . . . . . 0.621 ' HB ' ' CG ' ' A' ' 19' ' ' GLN . 99.4 m -130.38 141.36 50.56 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 116.072 -0.513 . . . . 52.59 110.01 179.265 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.622 ' CZ ' HD11 ' A' ' 103' ' ' ILE . 5.7 p90 -145.55 134.42 22.45 Favored 'General case' 0 N--CA 1.448 -0.559 0 N-CA-C 107.66 -1.237 . . . . 65.93 107.66 178.173 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLU . . . . . 0.491 ' HA ' ' O ' ' A' ' 34' ' ' ILE . 7.2 mt-10 -102.15 138.72 38.72 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 115.568 -0.742 . . . . 59.29 112.746 -179.357 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' VAL . . . . . 0.739 HG21 HD12 ' A' ' 103' ' ' ILE . 58.0 t -101.71 118.87 49.15 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.489 0 N-CA-C 106.909 -1.515 . . . . 55.3 106.909 179.98 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 42.1 m-20 61.89 -121.67 0.74 Allowed 'General case' 0 N--CA 1.454 -0.238 0 N-CA-C 104.407 -2.442 . . . . 70.83 104.407 -179.349 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -131.48 3.46 5.44 Favored Glycine 0 N--CA 1.446 -0.65 0 C-N-CA 118.773 -1.679 . . . . 57.59 114.531 179.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 7.7 p-80 -124.63 -1.89 7.94 Favored 'General case' 0 C--N 1.331 -0.233 0 N-CA-C 115.481 1.66 . . . . 58.7 115.481 -178.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.732 ' HB ' ' HB ' ' A' ' 30' ' ' VAL . 96.6 mt -117.52 117.15 54.15 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.253 0 N-CA-C 116.283 1.957 . . . . 47.76 116.283 -178.659 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.474 ' HG2' ' HG2' ' A' ' 29' ' ' GLU . 66.1 mt-30 -110.03 128.14 55.24 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-N 115.913 -0.585 . . . . 52.06 110.384 178.988 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.524 HG21 ' CD1' ' A' ' 103' ' ' ILE . 94.3 t -120.97 128.38 76.07 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.512 0 C-N-CA 120.145 -0.622 . . . . 39.64 110.341 179.583 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.899 ' HG ' ' O ' ' A' 2005 ' ' HOH . 12.9 mt -102.14 142.15 33.84 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 109.544 -0.539 . . . . 42.61 109.544 178.443 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.876 HG22 ' HZ ' ' A' ' 3' ' ' PHE . 3.8 mp -132.77 114.83 23.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.519 0 N-CA-C 109.096 -0.705 . . . . 52.28 109.096 -179.192 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.725 ' HB2' HG22 ' A' ' 25' ' ' VAL . . . -129.09 163.09 26.21 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 119.348 -0.941 . . . . 38.17 109.838 178.941 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.418 ' HA ' ' O ' ' A' ' 45' ' ' TRP . 0.1 OUTLIER -119.1 130.56 55.65 Favored 'General case' 0 N--CA 1.443 -0.791 0 N-CA-C 106.613 -1.625 . . . . 42.83 106.613 178.32 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -115.64 141.03 48.62 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 113.443 0.905 . . . . 38.11 113.443 -179.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 87.3 m-70 51.1 29.5 4.76 Favored 'General case' 0 CA--C 1.532 0.256 0 N-CA-C 113.303 0.853 . . . . 40.3 113.303 179.051 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.639 ' HG3' ' O ' ' A' 2008 ' ' HOH . 22.3 mt-30 59.4 21.48 9.84 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 114.489 1.292 . . . . 48.39 114.489 179.49 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.432 ' O ' ' N ' ' A' ' 87' ' ' LEU . 39.3 mt-30 -139.4 -38.52 0.48 Allowed 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 115.715 1.746 . . . . 64.81 115.715 -179.324 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' TRP . . . . . 0.418 ' O ' ' HA ' ' A' ' 40' ' ' CYS . 48.0 m95 -103.29 130.15 50.48 Favored 'General case' 0 CA--C 1.503 -0.862 0 N-CA-C 117.338 2.347 . . . . 37.05 117.338 -175.921 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.918 HG11 ' HE1' ' A' ' 95' ' ' MET . 56.9 t -98.23 119.37 46.15 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 N-CA-C 106.488 -1.671 . . . . 42.63 106.488 177.448 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.875 HE22 HE21 ' A' ' 84' ' ' GLN . 34.1 mm-40 -105.85 136.85 44.75 Favored 'General case' 0 CA--C 1.513 -0.469 0 C-N-CA 124.427 1.091 . . . . 52.76 111.819 -178.595 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 31.4 mt -113.48 140.89 47.73 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 104.657 -2.349 . . . . 41.3 104.657 176.204 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.473 ' CZ ' HG21 ' A' ' 80' ' ' ILE . 73.0 t80 -146.18 136.41 23.75 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 120.856 0.36 . . . . 49.39 111.964 -179.092 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 32.2 t -156.8 142.52 17.71 Favored 'General case' 0 C--N 1.327 -0.38 0 CA-C-O 120.932 0.396 . . . . 48.52 110.241 178.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 49.8 mt-10 -84.51 146.73 27.43 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 112.739 0.644 . . . . 61.09 112.739 -179.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.405 HD21 ' HB2' ' A' ' 81' ' ' LEU . 0.0 OUTLIER -104.44 -7.04 20.14 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 118.57 2.804 . . . . 62.48 118.57 -177.695 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . 89.52 -106.85 3.35 Favored Glycine 0 CA--C 1.524 0.618 0 C-N-CA 119.804 -1.189 . . . . 69.15 113.196 -179.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -141.11 51.24 1.6 Allowed 'General case' 0 N--CA 1.465 0.31 0 N-CA-C 108.141 -1.059 . . . . 70.1 108.141 179.269 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ASP . . . . . 0.465 ' O ' ' HD3' ' A' ' 57' ' ' PRO . 37.4 t70 -66.47 174.54 2.7 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 114.475 -1.238 . . . . 79.69 114.173 -178.791 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 47.5 tp -70.58 99.2 0.22 Allowed Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 123.5 0.72 . . . . 76.57 109.93 179.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' PRO . . . . . 0.465 ' HD3' ' O ' ' A' ' 55' ' ' ASP . 93.7 Cg_endo -57.88 -9.19 5.46 Favored 'Trans proline' 0 CA--C 1.53 0.301 0 C-N-CA 122.188 1.925 . . . . 76.31 114.919 -179.765 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' THR . . . . . . . . . . . . . 7.8 m -86.46 82.61 7.89 Favored 'General case' 0 C--N 1.329 -0.298 0 N-CA-C 112.308 0.484 . . . . 71.12 112.308 -179.306 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ASN . . . . . 0.782 HD22 ' H ' ' A' ' 61' ' ' ASN . 0.5 OUTLIER -123.6 124.07 41.97 Favored 'General case' 0 N--CA 1.47 0.551 0 N-CA-C 110.165 -0.309 . . . . 61.74 110.165 179.456 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 39.6 m-20 -62.0 -21.04 64.52 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 115.013 1.486 . . . . 57.46 115.013 -178.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ASN . . . . . 0.887 HD21 ' H ' ' A' ' 72' ' ' GLN . 5.4 m120 48.5 59.08 4.58 Favored 'General case' 0 C--O 1.24 0.576 0 N-CA-C 115.568 1.692 . . . . 36.58 115.568 -179.515 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 55.4 mt -100.54 159.49 15.11 Favored 'General case' 0 C--N 1.331 -0.238 0 N-CA-C 106.92 -1.511 . . . . 39.49 106.92 178.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' PHE . . . . . 0.506 ' HB2' ' O ' ' A' 2012 ' ' HOH . 23.1 p90 -89.01 169.55 11.42 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 103.239 -2.875 . . . . 34.69 103.239 177.799 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 116.83 -40.72 2.29 Favored Glycine 0 N--CA 1.449 -0.439 0 N-CA-C 117.356 1.702 . . . . 35.86 117.356 178.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -66.72 -40.53 88.45 Favored 'General case' 0 C--O 1.238 0.495 0 O-C-N 122.026 -0.691 . . . . 69.24 110.24 -179.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' HIS . . . . . . . . . . . . . 47.0 m-70 -136.59 155.52 49.82 Favored 'General case' 0 CA--C 1.515 -0.403 0 N-CA-C 113.409 0.892 . . . . 41.36 113.409 -178.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' TRP . . . . . 0.411 ' HA ' ' HA ' ' A' ' 68' ' ' PRO . 85.2 m95 -131.95 108.47 14.04 Favored Pre-proline 0 N--CA 1.442 -0.829 0 C-N-CA 119.455 -0.898 . . . . 40.99 110.01 178.048 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.411 ' HA ' ' HA ' ' A' ' 67' ' ' TRP . 96.0 Cg_endo -73.28 172.33 61.16 Favored 'Cis proline' 0 CA--C 1.534 0.505 0 C-N-CA 122.859 -1.725 . . . . 37.12 112.767 -0.374 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.558 ' HB2' ' O ' ' A' 2012 ' ' HOH . . . -68.44 148.88 50.01 Favored 'General case' 0 CA--C 1.542 0.654 0 N-CA-C 115.068 1.507 . . . . 43.38 115.068 -178.472 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' HIS . . . . . . . . . . . . . 6.5 m-70 -101.96 114.54 28.74 Favored 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 102.796 -3.039 . . . . 44.09 102.796 176.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 61.1 t -101.42 138.29 26.14 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 CA-C-O 120.69 0.281 . . . . 40.47 111.324 -178.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLN . . . . . 0.887 ' H ' HD21 ' A' ' 61' ' ' ASN . 20.9 tt0 -103.35 123.86 47.6 Favored 'General case' 0 CA--C 1.507 -0.708 0 N-CA-C 107.648 -1.241 . . . . 46.17 107.648 179.524 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -123.12 177.14 16.62 Favored Glycine 0 N--CA 1.446 -0.644 0 C-N-CA 120.087 -1.054 . . . . 46.64 112.791 -179.654 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.447 HH11 ' HB2' ' A' ' 57' ' ' PRO . 96.2 mtt180 -117.15 113.65 22.56 Favored 'General case' 0 C--N 1.327 -0.395 0 N-CA-C 108.989 -0.745 . . . . 70.57 108.989 179.252 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 54.9 tp -124.26 118.7 27.38 Favored 'General case' 0 C--O 1.237 0.415 0 N-CA-C 106.744 -1.576 . . . . 55.37 106.744 178.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ASP . . . . . 0.517 ' C ' ' H ' ' A' ' 78' ' ' LYS . 1.0 OUTLIER 66.13 31.9 8.5 Favored 'General case' 0 C--O 1.232 0.164 0 N-CA-C 104.389 -2.448 . . . . 71.96 104.389 -178.925 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 70.33 -12.62 1.76 Allowed Glycine 0 N--CA 1.448 -0.508 0 N-CA-C 109.409 -1.476 . . . . 63.14 109.409 -178.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.517 ' H ' ' C ' ' A' ' 76' ' ' ASP . 84.9 tttt -89.58 130.04 44.8 Favored Pre-proline 0 C--N 1.332 -0.18 0 N-CA-C 113.216 0.821 . . . . 70.97 113.216 -179.683 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 78' ' ' LYS . 73.9 Cg_exo -57.33 127.87 27.3 Favored 'Trans proline' 0 C--O 1.234 0.312 1 C-N-CA 127.954 5.77 . . . . 57.54 115.852 -179.74 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.473 HG21 ' CZ ' ' A' ' 49' ' ' PHE . 2.7 pp -134.28 163.83 35.95 Favored 'Isoleucine or valine' 0 C--O 1.238 0.457 0 CA-C-N 115.893 -0.594 . . . . 48.24 109.976 177.634 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' LEU . . . . . 0.405 ' HB2' HD21 ' A' ' 52' ' ' LEU . 16.1 tp -128.1 136.95 51.89 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 107.446 -1.316 . . . . 40.69 107.446 179.511 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' TRP . . . . . . . . . . . . . 67.4 p-90 -145.11 158.61 43.77 Favored 'General case' 0 CA--C 1.519 -0.25 0 C-N-CA 120.047 -0.661 . . . . 42.98 112.479 178.451 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 6.1 t -146.91 147.22 30.56 Favored 'General case' 0 N--CA 1.446 -0.635 0 N-CA-C 106.324 -1.732 . . . . 37.6 106.324 -179.019 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.875 HE21 HE22 ' A' ' 47' ' ' GLN . 2.6 pt20 -143.17 150.86 39.98 Favored 'General case' 0 N--CA 1.445 -0.7 0 C-N-CA 119.343 -0.943 . . . . 39.25 110.319 -178.682 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLN . . . . . . . . . . . . . 7.7 tt0 -158.34 152.83 24.5 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 105.901 -1.888 . . . . 46.32 105.901 -178.257 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 37.9 p -75.78 154.28 36.39 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 108.389 -0.967 . . . . 47.17 108.389 -179.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' LEU . . . . . 0.576 ' O ' ' HB2' ' A' ' 90' ' ' LEU . 0.6 OUTLIER -71.22 -40.52 71.06 Favored 'General case' 0 C--N 1.323 -0.552 0 CA-C-N 116.007 -0.542 . . . . 50.33 109.805 179.788 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' VAL . . . . . 1.01 HG23 ' O ' ' A' 2018 ' ' HOH . 21.3 t -49.75 122.91 1.83 Allowed 'Isoleucine or valine' 0 C--N 1.332 -0.162 0 CA-C-N 115.558 -0.746 . . . . 59.11 112.997 -179.865 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLY . . . . . . . . . . . . . . . 81.82 -4.17 76.02 Favored Glycine 0 CA--C 1.519 0.308 0 CA-C-N 115.904 -0.589 . . . . 57.42 113.57 179.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.576 ' HB2' ' O ' ' A' ' 87' ' ' LEU . 0.3 OUTLIER -75.93 113.46 13.45 Favored 'General case' 0 C--O 1.236 0.356 0 N-CA-C 112.751 0.649 . . . . 56.38 112.751 -178.863 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -102.7 163.43 12.22 Favored 'General case' 0 C--O 1.233 0.208 0 CA-C-N 116.343 -0.389 . . . . 77.99 110.161 178.44 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ILE . . . . . 0.89 HD12 ' HG2' ' A' ' 9' ' ' GLN . 3.4 tt -58.65 -30.95 42.98 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.364 0 N-CA-C 112.382 0.512 . . . . 53.95 112.382 -179.277 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -69.34 -41.49 76.54 Favored 'General case' 0 CA--C 1.516 -0.358 0 N-CA-C 111.946 0.351 . . . . 60.95 111.946 -179.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -68.18 -38.01 81.57 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.669 -0.863 . . . . 75.22 108.669 178.94 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' MET . . . . . 0.918 ' HE1' HG11 ' A' ' 46' ' ' VAL . 0.0 OUTLIER -59.31 -47.09 86.68 Favored 'General case' 0 C--N 1.331 -0.219 0 O-C-N 123.773 0.67 . . . . 48.77 110.624 179.649 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' GLN . . . . . 0.54 ' CD ' HD21 ' A' ' 14' ' ' LEU . 8.0 tt0 -61.96 -48.42 80.45 Favored 'General case' 0 C--O 1.241 0.621 0 CA-C-N 115.598 -0.728 . . . . 50.77 111.716 -179.48 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -62.49 -43.41 98.88 Favored 'General case' 0 C--O 1.234 0.287 0 CA-C-N 115.644 -0.707 . . . . 41.39 112.076 -179.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' TRP . . . . . . . . . . . . . 17.0 t90 -59.6 -50.62 73.19 Favored 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 107.858 -1.164 . . . . 42.29 107.858 178.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' LEU . . . . . 0.512 HD22 ' CZ ' ' A' ' 28' ' ' PHE . 5.1 mt -57.26 -55.19 38.0 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 111.932 0.345 . . . . 45.44 111.932 178.807 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 49.3 mt-10 -49.71 -47.26 50.57 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 108.284 -1.006 . . . . 69.57 108.284 -179.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ARG . . . . . 0.616 ' HD2' ' O ' ' A' 2019 ' ' HOH . 33.2 ttm180 -60.38 -40.8 92.13 Favored 'General case' 0 N--CA 1.447 -0.618 0 CA-C-N 113.933 -1.485 . . . . 42.0 111.923 -179.097 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' PHE . . . . . 0.583 ' O ' HG13 ' A' ' 106' ' ' ILE . 48.5 t80 -72.01 -43.24 65.37 Favored 'General case' 0 CA--C 1.544 0.74 0 N-CA-C 108.631 -0.877 . . . . 39.2 108.631 179.907 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ILE . . . . . 0.739 HD12 HG21 ' A' ' 30' ' ' VAL . 25.3 mm -56.65 -49.22 78.87 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.322 0 CA-C-O 121.633 0.73 . . . . 45.14 109.712 178.911 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ASP . . . . . 0.546 ' HA ' ' O ' ' A' 2021 ' ' HOH . 1.3 t0 -53.33 -52.07 60.38 Favored 'General case' 0 C--O 1.266 1.972 0 CA-C-N 114.338 -1.301 . . . . 77.52 110.679 -178.264 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ASP . . . . . 0.688 ' O ' ' HG3' ' A' ' 109' ' ' ARG . 48.9 t0 -58.61 -38.89 78.99 Favored 'General case' 0 N--CA 1.474 0.742 0 O-C-N 127.687 3.117 . . . . 39.4 111.761 -178.963 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.583 HG13 ' O ' ' A' ' 102' ' ' PHE . 81.8 mt -61.74 -55.02 27.05 Favored 'Isoleucine or valine' 0 C--O 1.235 0.337 0 N-CA-C 108.134 -1.062 . . . . 44.09 108.134 179.283 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -51.32 -53.49 35.46 Favored 'General case' 0 C--O 1.235 0.305 0 CA-C-N 115.886 -0.597 . . . . 66.22 112.57 179.926 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 51.5 tt0 -55.23 -25.57 34.13 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 115.931 -0.577 . . . . 67.82 112.398 -179.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ARG . . . . . 0.688 ' HG3' ' O ' ' A' ' 105' ' ' ASP . 46.7 mtt180 -87.92 -42.99 12.12 Favored 'General case' 0 C--N 1.327 -0.402 0 N-CA-C 112.678 0.621 . . . . 51.36 112.678 -179.973 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' LYS . . . . . 1.209 ' HD2' ' O ' ' A' 2010 ' ' HOH . 61.7 tttm . . . . . 0 C--O 1.232 0.178 0 C-N-CA 123.219 0.608 . . . . 57.05 110.793 -179.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1111 ' ' ' PT' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2005 ' ' HOH . . . . . 0.899 ' O ' ' HG ' ' A' ' 37' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2008 ' ' HOH . . . . . 0.639 ' O ' ' HG3' ' A' ' 43' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2009 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2010 ' ' HOH . . . . . 1.209 ' O ' ' HD2' ' A' ' 110' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2011 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2012 ' ' HOH . . . . . 0.558 ' O ' ' HB2' ' A' ' 69' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2013 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2014 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2015 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2016 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2017 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2018 ' ' HOH . . . . . 1.01 ' O ' HG23 ' A' ' 88' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2019 ' ' HOH . . . . . 0.616 ' O ' ' HD2' ' A' ' 101' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2020 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2021 ' ' HOH . . . . . 0.546 ' O ' ' HA ' ' A' ' 104' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2022 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_