data_1xe1_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 1xe1 _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 ' 18' ' ' ILE . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.532 0 N-CA-C 111.675 0.25 . . . . 81.819999999999993 111.675 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . . . -145.85 151.3 37.67 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.77 0.656 . . . . 75.769999999999996 112.77 -179.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 7.6 mt -99.8 122.94 52.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 109.753 -0.462 . . . . 67.140000000000001 109.753 -179.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 13.3 mt -97.21 -25.83 15.15 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 115.525 1.676 . . . . 67.939999999999998 115.525 -176.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 3.5 m -77.08 155.86 32.15 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 118.306 0.503 . . . . 63.090000000000003 112.286 -178.673 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . . . -83.15 -38.92 21.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.28 -0.418 . . . . 63.68 111.826 -179.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . . . -119.78 150.1 49.8 Favored Pre-proline 0 C--O 1.245 0.83 0 CA-C-N 116.626 -0.261 . . . . 59.600000000000001 111.238 -177.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -62.84 141.13 83.57 Favored 'Trans proline' 0 CA--C 1.536 0.61 0 C-N-CA 121.435 1.423 . . . . 49.399999999999999 112.173 176.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -71.99 -32.15 66.93 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 121.151 0.501 . . . . 34.729999999999997 111.508 167.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -162.67 168.83 37.72 Favored Glycine 0 N--CA 1.448 -0.546 0 N-CA-C 109.699 -1.361 . . . . 33.5 109.699 -176.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -131.59 143.35 50.28 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 122.74 0.416 . . . . 51.770000000000003 109.979 174.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 62.0 t -120.5 123.77 71.12 Favored 'Isoleucine or valine' 0 C--O 1.248 1.009 0 O-C-N 123.681 0.613 . . . . 30.84 109.875 178.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.4 p -86.21 125.53 40.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 N-CA-C 106.791 -1.559 . . . . 30.09 106.791 171.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 91.8 t -79.8 122.85 35.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.182 -0.917 . . . . 28.41 109.56 -176.91 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 50.5 tt0 -92.31 -43.65 9.16 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.934 -1.03 . . . . 32.369999999999997 111.22 175.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 68.9 mm-40 -151.69 147.85 27.21 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 107.421 -1.325 . . . . 53.68 107.421 178.298 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 16.0 t -126.32 131.18 71.77 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.463 0 N-CA-C 106.588 -1.634 . . . . 43.549999999999997 106.588 176.04 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 8.6 p -133.44 137.8 52.34 Favored 'Isoleucine or valine' 0 C--O 1.243 0.716 0 C-N-CA 119.808 -0.757 . . . . 55.979999999999997 110.962 170.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -96.37 125.46 40.89 Favored 'General case' 0 C--O 1.226 -0.167 0 N-CA-C 109.45 -0.574 . . . . 59.119999999999997 109.45 170.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 13.0 mt -134.68 123.24 41.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 106.402 -1.703 . . . . 52.159999999999997 106.402 -179.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' MSE . . . . . 0.417 ' N ' ' O ' ' A' ' 226' ' ' HOH . 94.8 mmm 50.74 49.36 21.11 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 121.741 0.782 . . . . 59.039999999999999 110.311 176.97 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLY . . . . . 0.535 ' N ' ' O ' ' A' ' 209' ' ' HOH . . . 71.86 4.38 58.35 Favored Glycine 0 C--O 1.224 -0.497 0 N-CA-C 117.991 1.956 . . . . 50.579999999999998 117.991 176.062 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . . . -119.86 139.27 52.64 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 117.768 0.784 . . . . 57.899999999999999 111.811 -178.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -77.87 123.58 26.94 Favored 'General case' 0 C--O 1.245 0.816 0 CA-C-N 115.354 -0.839 . . . . 60.020000000000003 109.58 174.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 68.0 t -110.79 122.72 65.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 N-CA-C 106.455 -1.683 . . . . 40.329999999999998 106.455 168.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 59.2 mt -110.09 128.44 66.27 Favored 'Isoleucine or valine' 0 C--O 1.241 0.633 0 CA-C-N 114.906 -1.043 . . . . 46.719999999999999 108.407 -176.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 32.5 mt -106.55 133.16 51.87 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 N-CA-C 105.826 -1.916 . . . . 42.450000000000003 105.826 171.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -172.89 -178.23 42.76 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 119.996 -1.097 . . . . 27.809999999999999 111.421 -173.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 41.2 m -126.27 132.91 51.59 Favored 'General case' 0 CA--C 1.503 -0.835 0 N-CA-C 106.847 -1.538 . . . . 27.77 106.847 -179.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 35.7 t -64.63 121.69 14.14 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.258 0 N-CA-C 109.583 -0.525 . . . . 25.66 109.583 173.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.5 tm-20 -91.03 -36.28 14.15 Favored 'General case' 0 CA--C 1.517 -0.321 0 C-N-CA 123.802 0.841 . . . . 52.310000000000002 110.767 -169.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 77.7 p -157.66 152.35 25.22 Favored 'General case' 0 C--O 1.244 0.78 0 N-CA-C 107.069 -1.456 . . . . 40.109999999999999 107.069 -178.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 64.39 -136.75 39.67 Favored Glycine 0 C--O 1.222 -0.619 0 O-C-N 124.032 0.832 . . . . 35.0 114.612 -179.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' MSE . . . . . . . . . . . . . 0.4 OUTLIER -155.65 153.91 30.76 Favored 'General case' 0 C--O 1.211 -0.97 0 N-CA-C 109.117 -0.697 . . . . 52.920000000000002 109.117 -168.92 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 19.1 pt -133.11 152.94 36.73 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.864 0 N-CA-C 107.049 -1.463 . . . . 39.25 107.049 175.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -140.24 161.82 26.44 Favored Glycine 0 CA--C 1.504 -0.616 0 N-CA-C 111.471 -0.651 . . . . 31.93 111.471 177.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 79.6 t -56.56 132.44 20.64 Favored 'Isoleucine or valine' 0 C--O 1.242 0.661 0 N-CA-C 108.705 -0.85 . . . . 36.799999999999997 108.705 173.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 91.51 -8.14 79.18 Favored Glycine 0 C--O 1.224 -0.477 0 N-CA-C 116.446 1.338 . . . . 41.840000000000003 116.446 -175.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.7 m-30 -73.42 163.15 28.46 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 118.189 0.994 . . . . 37.75 108.526 179.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' LYS . . . . . 0.661 ' NZ ' ' OXT' ' A' ' 108' ' ' THR . 45.5 mttt -102.09 133.88 46.22 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.138 -0.483 . . . . 51.369999999999997 111.991 -174.538 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 44.8 t -102.78 118.61 49.95 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 CA-C-N 115.364 -0.834 . . . . 42.859999999999999 109.578 178.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 6.6 ttpp -84.18 102.64 12.75 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.283 -0.636 . . . . 63.539999999999999 109.283 175.354 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -90.19 174.6 40.49 Favored Glycine 0 CA--C 1.52 0.367 0 N-CA-C 111.221 -0.752 . . . . 52.310000000000002 111.221 176.236 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -61.36 -37.89 68.81 Favored 'Trans proline' 0 N--CA 1.473 0.288 0 C-N-CA 121.633 1.555 . . . . 58.659999999999997 111.429 178.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 43.3 m -115.16 -11.16 12.06 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 114.344 1.238 . . . . 61.119999999999997 114.344 -174.33 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -161.21 176.63 37.75 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 120.328 -0.939 . . . . 52.159999999999997 115.367 -173.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 6.7 mt -117.92 124.7 73.46 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.859 0 N-CA-C 107.229 -1.397 . . . . 56.159999999999997 107.229 -178.688 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -113.39 170.07 13.2 Favored Glycine 0 N--CA 1.446 -0.654 0 N-CA-C 111.499 -0.64 . . . . 45.560000000000002 111.499 -178.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -119.78 137.85 12.74 Favored Glycine 0 CA--C 1.501 -0.839 0 N-CA-C 109.33 -1.508 . . . . 44.520000000000003 109.33 179.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 23.0 mt -77.34 121.5 29.99 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.7 0 C-N-CA 119.391 -0.924 . . . . 39.649999999999999 108.655 176.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 1.4 t -99.56 -33.96 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.945 0 CA-C-N 114.556 -1.202 . . . . 45.479999999999997 110.095 -174.22 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 47.8 ttt85 -156.78 147.68 21.84 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 109.361 -0.607 . . . . 43.659999999999997 109.361 -176.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 73.3 mt -131.6 134.74 60.18 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.957 0 N-CA-C 108.365 -0.976 . . . . 31.969999999999999 108.365 175.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 73.4 mt-10 -125.13 141.99 51.77 Favored 'General case' 0 CA--C 1.487 -1.464 0 C-N-CA 119.434 -0.906 . . . . 45.560000000000002 109.033 174.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 41.1 ttp180 -138.66 127.23 23.28 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 107.308 -1.367 . . . . 49.039999999999999 107.308 -179.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 32.2 m120 49.56 49.0 20.69 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 111.319 0.118 . . . . 61.759999999999998 111.319 -172.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . . . 56.32 32.54 20.64 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 113.869 1.062 . . . . 59.210000000000001 113.869 179.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -134.13 133.02 40.57 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 123.435 0.694 . . . . 74.230000000000004 110.128 -177.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 34.4 tttt -64.36 132.41 50.05 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.889 -0.782 . . . . 53.270000000000003 108.889 175.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 35.6 m -133.45 158.57 42.88 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 N-CA-C 107.68 -1.23 . . . . 33.710000000000001 107.68 175.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -90.98 -24.77 20.01 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 123.05 0.219 . . . . 49.060000000000002 110.873 -177.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 33.0 p90 -150.62 162.48 40.58 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.403 -0.362 . . . . 30.98 110.479 -179.074 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -143.67 153.73 42.79 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 108.209 -1.034 . . . . 29.16 108.209 176.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 46.6 pt -126.23 170.3 16.43 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.637 0 CA-C-N 116.349 -0.387 . . . . 32.079999999999998 110.143 -174.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -45.12 131.22 7.69 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 123.879 0.872 . . . . 31.690000000000001 112.132 -177.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 94.1 -14.71 64.74 Favored Glycine 0 C--N 1.339 0.722 0 CA-C-O 118.862 -0.966 . . . . 30.18 114.854 -178.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 87.3 m-20 -77.14 128.14 33.88 Favored 'General case' 0 CA--C 1.508 -0.642 0 CA-C-N 117.74 0.77 . . . . 29.390000000000001 110.062 177.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 54.3 ttt-85 -95.11 123.58 38.68 Favored 'General case' 0 N--CA 1.446 -0.636 0 O-C-N 124.246 0.966 . . . . 36.619999999999997 108.941 171.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 41.1 pt -139.22 160.01 28.92 Favored 'Isoleucine or valine' 0 C--O 1.247 0.966 0 CA-C-N 116.371 -0.377 . . . . 33.509999999999998 111.371 -166.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -102.98 142.1 15.41 Favored Glycine 0 C--N 1.338 0.648 0 N-CA-C 109.957 -1.257 . . . . 35.030000000000001 109.957 159.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 17.6 mt -129.81 133.83 64.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 C-N-CA 124.343 1.057 . . . . 41.869999999999997 109.115 -177.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 2.1 m -98.91 132.57 44.14 Favored 'General case' 0 CA--C 1.491 -1.289 0 CA-C-O 121.511 0.672 . . . . 48.43 109.47 164.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 76.9 mt -108.45 147.37 13.27 Favored 'Isoleucine or valine' 0 C--O 1.255 1.351 0 CA-C-N 114.855 -1.066 . . . . 54.729999999999997 110.187 179.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -108.61 129.24 55.33 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-N 114.774 -1.103 . . . . 81.989999999999995 108.062 173.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 101.99 154.84 25.87 Favored Glycine 0 N--CA 1.448 -0.555 0 N-CA-C 109.745 -1.342 . . . . 65.540000000000006 109.745 -178.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 17.4 mttt -89.19 120.29 30.43 Favored 'General case' 0 C--O 1.241 0.611 0 N-CA-C 107.935 -1.135 . . . . 77.540000000000006 107.935 177.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ILE . . . . . . . . . . . . . 7.6 pt -108.29 -2.49 10.08 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 N-CA-C 112.94 0.718 . . . . 58.75 112.94 -175.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 95.56 -172.88 30.53 Favored Glycine 0 C--N 1.332 0.311 0 O-C-N 123.192 0.307 . . . . 51.450000000000003 112.859 -178.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . . . -77.01 111.9 13.07 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.004 0.43 . . . . 53.640000000000001 111.512 -173.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 90.6 t -103.71 140.36 22.1 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.467 0 N-CA-C 106.983 -1.488 . . . . 49.539999999999999 106.983 175.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 2.8 mmtp -128.02 149.32 50.42 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 108.867 -0.79 . . . . 66.689999999999998 108.867 -176.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 15.1 tttp -43.04 129.22 4.5 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 109.705 -0.48 . . . . 41.75 109.705 166.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 98.2 -19.36 54.8 Favored Glycine 0 C--N 1.335 0.494 0 N-CA-C 115.983 1.153 . . . . 32.969999999999999 115.983 -179.492 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 95.4 m-20 -63.27 147.6 50.56 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 117.59 0.695 . . . . 41.68 110.399 169.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 69.7 t -111.13 113.16 43.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 105.898 -1.89 . . . . 37.57 105.898 172.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 86.5 mt -90.21 130.24 36.37 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 121.128 -0.229 . . . . 41.479999999999997 111.001 -179.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -85.52 133.09 34.09 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-O 121.171 0.51 . . . . 54.549999999999997 110.058 173.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 2.9 mt -120.81 133.0 68.87 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 CA-C-N 115.146 -0.933 . . . . 40.590000000000003 110.608 -175.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -119.71 133.31 55.68 Favored 'General case' 0 CA--C 1.504 -0.809 0 CA-C-N 115.482 -0.781 . . . . 42.57 109.946 -167.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -55.99 -48.48 75.79 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 114.573 -1.194 . . . . 56.280000000000001 109.754 176.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' THR . . . . . 0.661 ' OXT' ' NZ ' ' A' ' 57' ' ' LYS . 21.0 p . . . . . 0 N--CA 1.474 0.726 0 N-CA-C 108.578 -0.897 . . . . 52.07 108.578 170.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . 0.535 ' O ' ' N ' ' A' ' 39' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 226' ' ' HOH . . . . . 0.417 ' O ' ' N ' ' A' ' 38' ' ' MSE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.532 0 N-CA-C 111.675 0.25 . . . . 81.819999999999993 111.675 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . . . -145.85 151.3 37.67 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.77 0.656 . . . . 75.769999999999996 112.77 -179.31 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 7.6 mt -99.8 122.94 52.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 109.753 -0.462 . . . . 67.140000000000001 109.753 -179.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 13.3 mt -97.21 -25.83 15.15 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 115.525 1.676 . . . . 67.939999999999998 115.525 -176.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 3.5 m -77.08 155.86 32.15 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 118.306 0.503 . . . . 63.090000000000003 112.286 -178.673 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . . . -83.15 -38.92 21.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.28 -0.418 . . . . 63.68 111.826 -179.363 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . . . -119.78 150.1 49.8 Favored Pre-proline 0 C--O 1.245 0.83 0 CA-C-N 116.626 -0.261 . . . . 59.600000000000001 111.238 -177.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -62.84 141.13 83.57 Favored 'Trans proline' 0 CA--C 1.536 0.61 0 C-N-CA 121.435 1.423 . . . . 49.399999999999999 112.173 176.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -71.99 -32.15 66.93 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 121.151 0.501 . . . . 34.729999999999997 111.508 167.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -162.67 168.83 37.72 Favored Glycine 0 N--CA 1.448 -0.546 0 N-CA-C 109.699 -1.361 . . . . 33.5 109.699 -176.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -131.59 143.35 50.28 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 122.74 0.416 . . . . 51.770000000000003 109.979 174.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 62.0 t -120.5 123.77 71.12 Favored 'Isoleucine or valine' 0 C--O 1.248 1.009 0 O-C-N 123.681 0.613 . . . . 30.84 109.875 178.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.4 p -86.21 125.53 40.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 N-CA-C 106.791 -1.559 . . . . 30.09 106.791 171.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 91.8 t -79.8 122.85 35.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.182 -0.917 . . . . 28.41 109.56 -176.91 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 50.5 tt0 -92.31 -43.65 9.16 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.934 -1.03 . . . . 32.369999999999997 111.22 175.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 68.9 mm-40 -151.69 147.85 27.21 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 107.421 -1.325 . . . . 53.68 107.421 178.298 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 16.0 t -126.32 131.18 71.77 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.463 0 N-CA-C 106.588 -1.634 . . . . 43.549999999999997 106.588 176.04 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 8.6 p -133.44 137.8 52.34 Favored 'Isoleucine or valine' 0 C--O 1.243 0.716 0 C-N-CA 119.808 -0.757 . . . . 55.979999999999997 110.962 170.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -96.37 125.46 40.89 Favored 'General case' 0 C--O 1.226 -0.167 0 N-CA-C 109.45 -0.574 . . . . 59.119999999999997 109.45 170.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 13.0 mt -134.68 123.24 41.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 106.402 -1.703 . . . . 52.159999999999997 106.402 -179.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' MSE . . . . . . . . . . . . . 94.8 mmm 50.74 49.36 21.11 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 121.741 0.782 . . . . 59.039999999999999 110.311 176.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 71.86 4.38 58.35 Favored Glycine 0 C--O 1.224 -0.497 0 N-CA-C 117.991 1.956 . . . . 50.579999999999998 117.991 176.062 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . . . -119.86 139.27 52.64 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 117.768 0.784 . . . . 57.899999999999999 111.811 -178.178 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -77.87 123.58 26.94 Favored 'General case' 0 C--O 1.245 0.816 0 CA-C-N 115.354 -0.839 . . . . 60.020000000000003 109.58 174.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 68.0 t -110.79 122.72 65.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 N-CA-C 106.455 -1.683 . . . . 40.329999999999998 106.455 168.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 59.2 mt -110.09 128.44 66.27 Favored 'Isoleucine or valine' 0 C--O 1.241 0.633 0 CA-C-N 114.906 -1.043 . . . . 46.719999999999999 108.407 -176.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 32.5 mt -106.55 133.16 51.87 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 N-CA-C 105.826 -1.916 . . . . 42.450000000000003 105.826 171.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -172.89 -178.23 42.76 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 119.996 -1.097 . . . . 27.809999999999999 111.421 -173.763 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 41.2 m -126.27 132.91 51.59 Favored 'General case' 0 CA--C 1.503 -0.835 0 N-CA-C 106.847 -1.538 . . . . 27.77 106.847 -179.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 35.7 t -64.63 121.69 14.14 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.258 0 N-CA-C 109.583 -0.525 . . . . 25.66 109.583 173.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.5 tm-20 -91.03 -36.28 14.15 Favored 'General case' 0 CA--C 1.517 -0.321 0 C-N-CA 123.802 0.841 . . . . 52.310000000000002 110.767 -169.582 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 77.7 p -157.66 152.35 25.22 Favored 'General case' 0 C--O 1.244 0.78 0 N-CA-C 107.069 -1.456 . . . . 40.109999999999999 107.069 -178.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 64.39 -136.75 39.67 Favored Glycine 0 C--O 1.222 -0.619 0 O-C-N 124.032 0.832 . . . . 35.0 114.612 -179.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' MSE . . . . . . . . . . . . . 0.4 OUTLIER -155.65 153.91 30.76 Favored 'General case' 0 C--O 1.211 -0.97 0 N-CA-C 109.117 -0.697 . . . . 52.920000000000002 109.117 -168.92 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 19.1 pt -133.11 152.94 36.73 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.864 0 N-CA-C 107.049 -1.463 . . . . 39.25 107.049 175.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -140.24 161.82 26.44 Favored Glycine 0 CA--C 1.504 -0.616 0 N-CA-C 111.471 -0.651 . . . . 31.93 111.471 177.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 79.6 t -56.56 132.44 20.64 Favored 'Isoleucine or valine' 0 C--O 1.242 0.661 0 N-CA-C 108.705 -0.85 . . . . 36.799999999999997 108.705 173.485 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 91.51 -8.14 79.18 Favored Glycine 0 C--O 1.224 -0.477 0 N-CA-C 116.446 1.338 . . . . 41.840000000000003 116.446 -175.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.7 m-30 -73.42 163.15 28.46 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 118.189 0.994 . . . . 37.75 108.526 179.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' LYS . . . . . 0.538 ' NZ ' ' OXT' ' A' ' 108' ' ' THR . 45.5 mttt -102.09 133.88 46.22 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.138 -0.483 . . . . 51.369999999999997 111.991 -174.538 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 44.8 t -102.78 118.61 49.95 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 CA-C-N 115.364 -0.834 . . . . 42.859999999999999 109.578 178.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 6.6 ttpp -84.18 102.64 12.75 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.283 -0.636 . . . . 63.539999999999999 109.283 175.354 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLY . . . . . 0.461 ' HA3' ' HB ' ' A' ' 94' ' ' ILE . . . -90.19 174.6 40.49 Favored Glycine 0 CA--C 1.52 0.367 0 N-CA-C 111.221 -0.752 . . . . 52.310000000000002 111.221 176.236 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -61.36 -37.89 68.81 Favored 'Trans proline' 0 N--CA 1.473 0.288 0 C-N-CA 121.633 1.555 . . . . 58.659999999999997 111.429 178.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 43.3 m -115.16 -11.16 12.06 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 114.344 1.238 . . . . 61.119999999999997 114.344 -174.33 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -161.21 176.63 37.75 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 120.328 -0.939 . . . . 52.159999999999997 115.367 -173.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 6.7 mt -117.92 124.7 73.46 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.859 0 N-CA-C 107.229 -1.397 . . . . 56.159999999999997 107.229 -178.688 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -113.39 170.07 13.2 Favored Glycine 0 N--CA 1.446 -0.654 0 N-CA-C 111.499 -0.64 . . . . 45.560000000000002 111.499 -178.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -119.78 137.85 12.74 Favored Glycine 0 CA--C 1.501 -0.839 0 N-CA-C 109.33 -1.508 . . . . 44.520000000000003 109.33 179.561 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 23.0 mt -77.34 121.5 29.99 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.7 0 C-N-CA 119.391 -0.924 . . . . 39.649999999999999 108.655 176.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 1.4 t -99.56 -33.96 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.945 0 CA-C-N 114.556 -1.202 . . . . 45.479999999999997 110.095 -174.22 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 47.8 ttt85 -156.78 147.68 21.84 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 109.361 -0.607 . . . . 43.659999999999997 109.361 -176.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 73.3 mt -131.6 134.74 60.18 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.957 0 N-CA-C 108.365 -0.976 . . . . 31.969999999999999 108.365 175.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 73.4 mt-10 -125.13 141.99 51.77 Favored 'General case' 0 CA--C 1.487 -1.464 0 C-N-CA 119.434 -0.906 . . . . 45.560000000000002 109.033 174.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 41.1 ttp180 -138.66 127.23 23.28 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 107.308 -1.367 . . . . 49.039999999999999 107.308 -179.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 32.2 m120 49.56 49.0 20.69 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 111.319 0.118 . . . . 61.759999999999998 111.319 -172.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . . . 56.32 32.54 20.64 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 113.869 1.062 . . . . 59.210000000000001 113.869 179.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -134.13 133.02 40.57 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 123.435 0.694 . . . . 74.230000000000004 110.128 -177.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 34.4 tttt -64.36 132.41 50.05 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.889 -0.782 . . . . 53.270000000000003 108.889 175.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 35.6 m -133.45 158.57 42.88 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 N-CA-C 107.68 -1.23 . . . . 33.710000000000001 107.68 175.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -90.98 -24.77 20.01 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 123.05 0.219 . . . . 49.060000000000002 110.873 -177.637 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 33.0 p90 -150.62 162.48 40.58 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.403 -0.362 . . . . 30.98 110.479 -179.074 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -143.67 153.73 42.79 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 108.209 -1.034 . . . . 29.16 108.209 176.097 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 46.6 pt -126.23 170.3 16.43 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.637 0 CA-C-N 116.349 -0.387 . . . . 32.079999999999998 110.143 -174.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -45.12 131.22 7.69 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 123.879 0.872 . . . . 31.690000000000001 112.132 -177.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 94.1 -14.71 64.74 Favored Glycine 0 C--N 1.339 0.722 0 CA-C-O 118.862 -0.966 . . . . 30.18 114.854 -178.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 87.3 m-20 -77.14 128.14 33.88 Favored 'General case' 0 CA--C 1.508 -0.642 0 CA-C-N 117.74 0.77 . . . . 29.390000000000001 110.062 177.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 54.3 ttt-85 -95.11 123.58 38.68 Favored 'General case' 0 N--CA 1.446 -0.636 0 O-C-N 124.246 0.966 . . . . 36.619999999999997 108.941 171.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 41.1 pt -139.22 160.01 28.92 Favored 'Isoleucine or valine' 0 C--O 1.247 0.966 0 CA-C-N 116.371 -0.377 . . . . 33.509999999999998 111.371 -166.821 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -102.98 142.1 15.41 Favored Glycine 0 C--N 1.338 0.648 0 N-CA-C 109.957 -1.257 . . . . 35.030000000000001 109.957 159.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 17.6 mt -129.81 133.83 64.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 C-N-CA 124.343 1.057 . . . . 41.869999999999997 109.115 -177.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 2.1 m -98.91 132.57 44.14 Favored 'General case' 0 CA--C 1.491 -1.289 0 CA-C-O 121.511 0.672 . . . . 48.43 109.47 164.279 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 76.9 mt -108.45 147.37 13.27 Favored 'Isoleucine or valine' 0 C--O 1.255 1.351 0 CA-C-N 114.855 -1.066 . . . . 54.729999999999997 110.187 179.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -108.61 129.24 55.33 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-N 114.774 -1.103 . . . . 81.989999999999995 108.062 173.662 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 101.99 154.84 25.87 Favored Glycine 0 N--CA 1.448 -0.555 0 N-CA-C 109.745 -1.342 . . . . 65.540000000000006 109.745 -178.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 17.4 mttt -89.19 120.29 30.43 Favored 'General case' 0 C--O 1.241 0.611 0 N-CA-C 107.935 -1.135 . . . . 77.540000000000006 107.935 177.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ILE . . . . . 0.461 ' HB ' ' HA3' ' A' ' 60' ' ' GLY . 7.6 pt -108.29 -2.49 10.08 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 N-CA-C 112.94 0.718 . . . . 58.75 112.94 -175.62 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 95.56 -172.88 30.53 Favored Glycine 0 C--N 1.332 0.311 0 O-C-N 123.192 0.307 . . . . 51.450000000000003 112.859 -178.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . . . -77.01 111.9 13.07 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.004 0.43 . . . . 53.640000000000001 111.512 -173.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 90.6 t -103.71 140.36 22.1 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.467 0 N-CA-C 106.983 -1.488 . . . . 49.539999999999999 106.983 175.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 2.8 mmtp -128.02 149.32 50.42 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 108.867 -0.79 . . . . 66.689999999999998 108.867 -176.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 15.1 tttp -43.04 129.22 4.5 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 109.705 -0.48 . . . . 41.75 109.705 166.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 98.2 -19.36 54.8 Favored Glycine 0 C--N 1.335 0.494 0 N-CA-C 115.983 1.153 . . . . 32.969999999999999 115.983 -179.492 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 95.4 m-20 -63.27 147.6 50.56 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 117.59 0.695 . . . . 41.68 110.399 169.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 69.7 t -111.13 113.16 43.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 105.898 -1.89 . . . . 37.57 105.898 172.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 86.5 mt -90.21 130.24 36.37 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 121.128 -0.229 . . . . 41.479999999999997 111.001 -179.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -85.52 133.09 34.09 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-O 121.171 0.51 . . . . 54.549999999999997 110.058 173.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 2.9 mt -120.81 133.0 68.87 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 CA-C-N 115.146 -0.933 . . . . 40.590000000000003 110.608 -175.588 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -119.71 133.31 55.68 Favored 'General case' 0 CA--C 1.504 -0.809 0 CA-C-N 115.482 -0.781 . . . . 42.57 109.946 -167.282 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -55.99 -48.48 75.79 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 114.573 -1.194 . . . . 56.280000000000001 109.754 176.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' THR . . . . . 0.538 ' OXT' ' NZ ' ' A' ' 57' ' ' LYS . 21.0 p . . . . . 0 N--CA 1.474 0.726 0 N-CA-C 108.578 -0.897 . . . . 52.07 108.578 170.059 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 301' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ILE . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 1.532 0 N-CA-C 111.675 0.25 . . . . 81.819999999999993 111.675 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . . . -145.85 151.3 37.67 Favored 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 112.77 0.656 . . . . 75.769999999999996 112.77 -179.31 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 7.6 mt -99.8 122.94 52.25 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 N-CA-C 109.753 -0.462 . . . . 67.140000000000001 109.753 -179.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 13.3 mt -97.21 -25.83 15.15 Favored 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 115.525 1.676 . . . . 67.939999999999998 115.525 -176.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 3.5 m -77.08 155.86 32.15 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 118.306 0.503 . . . . 63.090000000000003 112.286 -178.673 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . . . -83.15 -38.92 21.74 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.28 -0.418 . . . . 63.68 111.826 -179.363 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . . . -119.78 150.1 49.8 Favored Pre-proline 0 C--O 1.245 0.83 0 CA-C-N 116.626 -0.261 . . . . 59.600000000000001 111.238 -177.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -62.84 141.13 83.57 Favored 'Trans proline' 0 CA--C 1.536 0.61 0 C-N-CA 121.435 1.423 . . . . 49.399999999999999 112.173 176.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ALA . . . . . . . . . . . . . . . -71.99 -32.15 66.93 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-O 121.151 0.501 . . . . 34.729999999999997 111.508 167.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -162.67 168.83 37.72 Favored Glycine 0 N--CA 1.448 -0.546 0 N-CA-C 109.699 -1.361 . . . . 33.5 109.699 -176.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -131.59 143.35 50.28 Favored 'General case' 0 N--CA 1.475 0.816 0 C-N-CA 122.74 0.416 . . . . 51.770000000000003 109.979 174.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 62.0 t -120.5 123.77 71.12 Favored 'Isoleucine or valine' 0 C--O 1.248 1.009 0 O-C-N 123.681 0.613 . . . . 30.84 109.875 178.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' VAL . . . . . . . . . . . . . 7.4 p -86.21 125.53 40.67 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 N-CA-C 106.791 -1.559 . . . . 30.09 106.791 171.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 91.8 t -79.8 122.85 35.8 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.597 0 CA-C-N 115.182 -0.917 . . . . 28.41 109.56 -176.91 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 50.5 tt0 -92.31 -43.65 9.16 Favored 'General case' 0 N--CA 1.448 -0.543 0 CA-C-N 114.934 -1.03 . . . . 32.369999999999997 111.22 175.33 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 68.9 mm-40 -151.69 147.85 27.21 Favored 'General case' 0 N--CA 1.48 1.068 0 N-CA-C 107.421 -1.325 . . . . 53.68 107.421 178.298 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 16.0 t -126.32 131.18 71.77 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.463 0 N-CA-C 106.588 -1.634 . . . . 43.549999999999997 106.588 176.04 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 8.6 p -133.44 137.8 52.34 Favored 'Isoleucine or valine' 0 C--O 1.243 0.716 0 C-N-CA 119.808 -0.757 . . . . 55.979999999999997 110.962 170.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 4.6 t-20 -96.37 125.46 40.89 Favored 'General case' 0 C--O 1.226 -0.167 0 N-CA-C 109.45 -0.574 . . . . 59.119999999999997 109.45 170.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 13.0 mt -134.68 123.24 41.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.373 0 N-CA-C 106.402 -1.703 . . . . 52.159999999999997 106.402 -179.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' MSE . . . . . . . . . . . . . 94.8 mmm 50.74 49.36 21.11 Favored 'General case' 0 CA--C 1.544 0.747 0 CA-C-O 121.741 0.782 . . . . 59.039999999999999 110.311 176.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLY . . . . . . . . . . . . . . . 71.86 4.38 58.35 Favored Glycine 0 C--O 1.224 -0.497 0 N-CA-C 117.991 1.956 . . . . 50.579999999999998 117.991 176.062 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . . . -119.86 139.27 52.64 Favored 'General case' 0 C--O 1.234 0.249 0 CA-C-N 117.768 0.784 . . . . 57.899999999999999 111.811 -178.178 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -77.87 123.58 26.94 Favored 'General case' 0 C--O 1.245 0.816 0 CA-C-N 115.354 -0.839 . . . . 60.020000000000003 109.58 174.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 68.0 t -110.79 122.72 65.81 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.677 0 N-CA-C 106.455 -1.683 . . . . 40.329999999999998 106.455 168.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 59.2 mt -110.09 128.44 66.27 Favored 'Isoleucine or valine' 0 C--O 1.241 0.633 0 CA-C-N 114.906 -1.043 . . . . 46.719999999999999 108.407 -176.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ILE . . . . . . . . . . . . . 32.5 mt -106.55 133.16 51.87 Favored 'Isoleucine or valine' 0 C--O 1.236 0.384 0 N-CA-C 105.826 -1.916 . . . . 42.450000000000003 105.826 171.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -172.89 -178.23 42.76 Favored Glycine 0 N--CA 1.447 -0.62 0 C-N-CA 119.996 -1.097 . . . . 27.809999999999999 111.421 -173.763 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 41.2 m -126.27 132.91 51.59 Favored 'General case' 0 CA--C 1.503 -0.835 0 N-CA-C 106.847 -1.538 . . . . 27.77 106.847 -179.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 35.7 t -64.63 121.69 14.14 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.258 0 N-CA-C 109.583 -0.525 . . . . 25.66 109.583 173.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.5 tm-20 -91.03 -36.28 14.15 Favored 'General case' 0 CA--C 1.517 -0.321 0 C-N-CA 123.802 0.841 . . . . 52.310000000000002 110.767 -169.582 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 77.7 p -157.66 152.35 25.22 Favored 'General case' 0 C--O 1.244 0.78 0 N-CA-C 107.069 -1.456 . . . . 40.109999999999999 107.069 -178.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . 64.39 -136.75 39.67 Favored Glycine 0 C--O 1.222 -0.619 0 O-C-N 124.032 0.832 . . . . 35.0 114.612 -179.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' MSE . . . . . . . . . . . . . 0.4 OUTLIER -155.65 153.91 30.76 Favored 'General case' 0 C--O 1.211 -0.97 0 N-CA-C 109.117 -0.697 . . . . 52.920000000000002 109.117 -168.92 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 19.1 pt -133.11 152.94 36.73 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.864 0 N-CA-C 107.049 -1.463 . . . . 39.25 107.049 175.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -140.24 161.82 26.44 Favored Glycine 0 CA--C 1.504 -0.616 0 N-CA-C 111.471 -0.651 . . . . 31.93 111.471 177.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 79.6 t -56.56 132.44 20.64 Favored 'Isoleucine or valine' 0 C--O 1.242 0.661 0 N-CA-C 108.705 -0.85 . . . . 36.799999999999997 108.705 173.485 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 91.51 -8.14 79.18 Favored Glycine 0 C--O 1.224 -0.477 0 N-CA-C 116.446 1.338 . . . . 41.840000000000003 116.446 -175.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 4.7 m-30 -73.42 163.15 28.46 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 118.189 0.994 . . . . 37.75 108.526 179.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.538 ' NZ ' ' OXT' ' A' ' 108' ' ' THR . 45.5 mttt -102.09 133.88 46.22 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-N 116.138 -0.483 . . . . 51.369999999999997 111.991 -174.538 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 44.8 t -102.78 118.61 49.95 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.414 0 CA-C-N 115.364 -0.834 . . . . 42.859999999999999 109.578 178.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 6.6 ttpp -84.18 102.64 12.75 Favored 'General case' 0 C--N 1.324 -0.538 0 N-CA-C 109.283 -0.636 . . . . 63.539999999999999 109.283 175.354 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLY . . . . . 0.461 ' HA3' ' HB ' ' A' ' 94' ' ' ILE . . . -90.19 174.6 40.49 Favored Glycine 0 CA--C 1.52 0.367 0 N-CA-C 111.221 -0.752 . . . . 52.310000000000002 111.221 176.236 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -61.36 -37.89 68.81 Favored 'Trans proline' 0 N--CA 1.473 0.288 0 C-N-CA 121.633 1.555 . . . . 58.659999999999997 111.429 178.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 43.3 m -115.16 -11.16 12.06 Favored 'General case' 0 CA--C 1.517 -0.317 0 N-CA-C 114.344 1.238 . . . . 61.119999999999997 114.344 -174.33 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . -161.21 176.63 37.75 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 120.328 -0.939 . . . . 52.159999999999997 115.367 -173.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ILE . . . . . . . . . . . . . 6.7 mt -117.92 124.7 73.46 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.859 0 N-CA-C 107.229 -1.397 . . . . 56.159999999999997 107.229 -178.688 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -113.39 170.07 13.2 Favored Glycine 0 N--CA 1.446 -0.654 0 N-CA-C 111.499 -0.64 . . . . 45.560000000000002 111.499 -178.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -119.78 137.85 12.74 Favored Glycine 0 CA--C 1.501 -0.839 0 N-CA-C 109.33 -1.508 . . . . 44.520000000000003 109.33 179.561 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 23.0 mt -77.34 121.5 29.99 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.7 0 C-N-CA 119.391 -0.924 . . . . 39.649999999999999 108.655 176.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 1.4 t -99.56 -33.96 4.13 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.945 0 CA-C-N 114.556 -1.202 . . . . 45.479999999999997 110.095 -174.22 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 47.8 ttt85 -156.78 147.68 21.84 Favored 'General case' 0 CA--C 1.514 -0.435 0 N-CA-C 109.361 -0.607 . . . . 43.659999999999997 109.361 -176.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 73.3 mt -131.6 134.74 60.18 Favored 'Isoleucine or valine' 0 CA--C 1.5 -0.957 0 N-CA-C 108.365 -0.976 . . . . 31.969999999999999 108.365 175.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 73.4 mt-10 -125.13 141.99 51.77 Favored 'General case' 0 CA--C 1.487 -1.464 0 C-N-CA 119.434 -0.906 . . . . 45.560000000000002 109.033 174.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 41.1 ttp180 -138.66 127.23 23.28 Favored 'General case' 0 N--CA 1.449 -0.501 0 N-CA-C 107.308 -1.367 . . . . 49.039999999999999 107.308 -179.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ASN . . . . . . . . . . . . . 32.2 m120 49.56 49.0 20.69 Favored 'General case' 0 N--CA 1.466 0.37 0 N-CA-C 111.319 0.118 . . . . 61.759999999999998 111.319 -172.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . . . 56.32 32.54 20.64 Favored 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 113.869 1.062 . . . . 59.210000000000001 113.869 179.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -134.13 133.02 40.57 Favored 'General case' 0 N--CA 1.464 0.255 0 C-N-CA 123.435 0.694 . . . . 74.230000000000004 110.128 -177.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 34.4 tttt -64.36 132.41 50.05 Favored 'General case' 0 C--N 1.326 -0.431 0 N-CA-C 108.889 -0.782 . . . . 53.270000000000003 108.889 175.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 35.6 m -133.45 158.57 42.88 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.416 0 N-CA-C 107.68 -1.23 . . . . 33.710000000000001 107.68 175.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -90.98 -24.77 20.01 Favored 'General case' 0 N--CA 1.45 -0.434 0 O-C-N 123.05 0.219 . . . . 49.060000000000002 110.873 -177.637 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 33.0 p90 -150.62 162.48 40.58 Favored 'General case' 0 C--N 1.332 -0.177 0 CA-C-N 116.403 -0.362 . . . . 30.98 110.479 -179.074 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -143.67 153.73 42.79 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 108.209 -1.034 . . . . 29.16 108.209 176.097 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 46.6 pt -126.23 170.3 16.43 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.637 0 CA-C-N 116.349 -0.387 . . . . 32.079999999999998 110.143 -174.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -45.12 131.22 7.69 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 123.879 0.872 . . . . 31.690000000000001 112.132 -177.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 94.1 -14.71 64.74 Favored Glycine 0 C--N 1.339 0.722 0 CA-C-O 118.862 -0.966 . . . . 30.18 114.854 -178.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ASP . . . . . . . . . . . . . 87.3 m-20 -77.14 128.14 33.88 Favored 'General case' 0 CA--C 1.508 -0.642 0 CA-C-N 117.74 0.77 . . . . 29.390000000000001 110.062 177.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 54.3 ttt-85 -95.11 123.58 38.68 Favored 'General case' 0 N--CA 1.446 -0.636 0 O-C-N 124.246 0.966 . . . . 36.619999999999997 108.941 171.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 41.1 pt -139.22 160.01 28.92 Favored 'Isoleucine or valine' 0 C--O 1.247 0.966 0 CA-C-N 116.371 -0.377 . . . . 33.509999999999998 111.371 -166.821 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -102.98 142.1 15.41 Favored Glycine 0 C--N 1.338 0.648 0 N-CA-C 109.957 -1.257 . . . . 35.030000000000001 109.957 159.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ILE . . . . . . . . . . . . . 17.6 mt -129.81 133.83 64.12 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 C-N-CA 124.343 1.057 . . . . 41.869999999999997 109.115 -177.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' SER . . . . . . . . . . . . . 2.1 m -98.91 132.57 44.14 Favored 'General case' 0 CA--C 1.491 -1.289 0 CA-C-O 121.511 0.672 . . . . 48.43 109.47 164.279 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ILE . . . . . . . . . . . . . 76.9 mt -108.45 147.37 13.27 Favored 'Isoleucine or valine' 0 C--O 1.255 1.351 0 CA-C-N 114.855 -1.066 . . . . 54.729999999999997 110.187 179.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' GLU . . . . . . . . . . . . . 9.1 tp10 -108.61 129.24 55.33 Favored 'General case' 0 CA--C 1.512 -0.508 0 CA-C-N 114.774 -1.103 . . . . 81.989999999999995 108.062 173.662 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . 101.99 154.84 25.87 Favored Glycine 0 N--CA 1.448 -0.555 0 N-CA-C 109.745 -1.342 . . . . 65.540000000000006 109.745 -178.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 17.4 mttt -89.19 120.29 30.43 Favored 'General case' 0 C--O 1.241 0.611 0 N-CA-C 107.935 -1.135 . . . . 77.540000000000006 107.935 177.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ILE . . . . . 0.461 ' HB ' ' HA3' ' A' ' 60' ' ' GLY . 7.6 pt -108.29 -2.49 10.08 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 N-CA-C 112.94 0.718 . . . . 58.75 112.94 -175.62 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 95.56 -172.88 30.53 Favored Glycine 0 C--N 1.332 0.311 0 O-C-N 123.192 0.307 . . . . 51.450000000000003 112.859 -178.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . . . -77.01 111.9 13.07 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-O 121.004 0.43 . . . . 53.640000000000001 111.512 -173.064 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 90.6 t -103.71 140.36 22.1 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.467 0 N-CA-C 106.983 -1.488 . . . . 49.539999999999999 106.983 175.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 2.8 mmtp -128.02 149.32 50.42 Favored 'General case' 0 N--CA 1.454 -0.24 0 N-CA-C 108.867 -0.79 . . . . 66.689999999999998 108.867 -176.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' LYS . . . . . . . . . . . . . 15.1 tttp -43.04 129.22 4.5 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 109.705 -0.48 . . . . 41.75 109.705 166.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . 98.2 -19.36 54.8 Favored Glycine 0 C--N 1.335 0.494 0 N-CA-C 115.983 1.153 . . . . 32.969999999999999 115.983 -179.492 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . . 95.4 m-20 -63.27 147.6 50.56 Favored 'General case' 0 N--CA 1.468 0.425 0 CA-C-N 117.59 0.695 . . . . 41.68 110.399 169.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' VAL . . . . . . . . . . . . . 69.7 t -111.13 113.16 43.47 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 N-CA-C 105.898 -1.89 . . . . 37.57 105.898 172.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' LEU . . . . . . . . . . . . . 86.5 mt -90.21 130.24 36.37 Favored 'General case' 0 N--CA 1.455 -0.198 0 C-N-CA 121.128 -0.229 . . . . 41.479999999999997 111.001 -179.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . 93.9 mt-10 -85.52 133.09 34.09 Favored 'General case' 0 CA--C 1.513 -0.465 0 CA-C-O 121.171 0.51 . . . . 54.549999999999997 110.058 173.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ILE . . . . . . . . . . . . . 2.9 mt -120.81 133.0 68.87 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 CA-C-N 115.146 -0.933 . . . . 40.590000000000003 110.608 -175.588 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -119.71 133.31 55.68 Favored 'General case' 0 CA--C 1.504 -0.809 0 CA-C-N 115.482 -0.781 . . . . 42.57 109.946 -167.282 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' GLN . . . . . . . . . . . . . 37.0 tt0 -55.99 -48.48 75.79 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-N 114.573 -1.194 . . . . 56.280000000000001 109.754 176.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' THR . . . . . 0.538 ' OXT' ' NZ ' ' A' ' 57' ' ' LYS . 21.0 p . . . . . 0 N--CA 1.474 0.726 0 N-CA-C 108.578 -0.897 . . . . 52.07 108.578 170.059 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_