data_1fdn_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 1fdn _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' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.711 0 N-CA-C 113.69 0.996 . . . . 11.73 113.69 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -93.99 159.6 15.09 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 105.736 -1.949 . . . . 14.24 105.736 165.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.4 p -136.05 138.22 47.64 Favored 'Isoleucine or valine' 0 C--O 1.24 0.588 0 N-CA-C 105.46 -2.052 . . . . 10.0 105.46 174.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 78.8 mt -84.0 120.57 35.14 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.477 0 N-CA-C 106.738 -1.579 . . . . 11.05 106.738 178.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 38.0 p30 -89.26 -170.94 3.06 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 119.082 -1.047 . . . . 15.0 112.85 -177.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 88.5 mt-10 -69.73 -11.67 61.03 Favored 'General case' 0 CA--C 1.513 -0.48 0 N-CA-C 117.939 2.57 . . . . 26.96 117.939 -174.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -67.85 -17.13 64.4 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-O 117.668 -1.158 . . . . 11.89 112.654 176.635 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 53.9 t -51.58 129.26 25.33 Favored 'General case' 0 C--N 1.344 0.368 0 CA-C-N 120.654 1.57 . . . . 11.93 112.711 -178.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 41.5 pt -103.99 13.83 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.164 0 CA-C-N 114.745 -1.116 . . . . 12.01 111.583 177.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 69.2 m 53.71 40.19 31.17 Favored 'General case' 0 C--N 1.345 0.398 0 N-CA-C 117.219 2.303 . . . . 15.45 117.219 178.112 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.0 p -72.98 -24.28 60.75 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 113.63 -1.623 . . . . 12.98 112.981 178.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.96 -0.59 88.33 Favored Glycine 0 C--N 1.341 0.833 0 O-C-N 120.782 -1.199 . . . . 11.1 115.707 178.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.97 -28.19 69.35 Favored 'General case' 0 C--O 1.247 0.97 0 CA-C-N 120.407 2.103 . . . . 13.43 116.435 -176.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 12.6 p -77.49 -30.94 53.28 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 113.656 0.984 . . . . 13.5 113.656 -178.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.6 tt0 -53.45 -51.22 77.83 Favored Pre-proline 0 N--CA 1.451 -0.416 0 N-CA-C 116.135 1.902 . . . . 27.83 116.135 -174.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -62.26 -24.43 76.03 Favored 'Trans proline' 0 N--CA 1.456 -0.72 0 C-N-CA 123.796 2.997 . . . . 16.54 113.563 175.268 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -86.1 -12.93 48.74 Favored 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 117.215 2.302 . . . . 24.45 117.215 -171.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 49.6 t -65.13 120.61 68.65 Favored Pre-proline 0 N--CA 1.447 -0.601 0 O-C-N 124.683 1.239 . . . . 11.61 109.172 176.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -64.81 -19.68 64.42 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 123.082 2.522 . . . . 14.0 113.572 179.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 20.4 m -118.41 17.85 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.275 0 CA-C-N 120.451 1.478 . . . . 11.8 113.353 -179.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 37.1 t30 57.13 39.69 28.82 Favored 'General case' 0 C--O 1.24 0.582 0 CA-C-O 122.294 1.045 . . . . 18.53 113.24 176.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -85.19 -8.72 58.44 Favored 'General case' 0 C--O 1.24 0.59 0 O-C-N 120.42 -1.425 . . . . 11.64 114.706 -177.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 68.3 mt -101.87 135.91 36.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 CA-C-N 119.093 0.861 . . . . 12.5 112.03 -175.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 79.6 p -138.01 164.52 28.86 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-O 122.401 1.095 . . . . 19.88 110.034 171.173 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.8 t -75.45 134.05 40.95 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 108.051 -1.092 . . . . 28.19 108.051 177.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -123.9 -169.45 13.14 Favored Glycine 0 CA--C 1.521 0.436 0 CA-C-O 122.682 1.157 . . . . 29.17 111.032 177.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -81.14 127.87 33.12 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 105.866 -1.902 . . . . 63.01 105.866 172.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 83.66 -46.72 0.12 Allowed 'General case' 0 C--O 1.234 0.259 0 N-CA-C 114.416 1.265 . . . . 62.88 114.416 177.268 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 2.6 ptt180 -154.07 169.38 23.68 Favored 'General case' 0 C--O 1.24 0.562 0 N-CA-C 107.0 -1.481 . . . . 25.24 107.0 -179.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -73.22 158.19 35.69 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.457 -0.792 . . . . 14.17 110.179 174.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -130.57 143.11 41.91 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.478 0 O-C-N 119.81 -1.806 . . . . 13.97 111.544 -174.679 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 75.4 mt -100.3 131.58 47.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 O-C-N 124.07 0.856 . . . . 9.94 110.562 175.162 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.4 t0 -77.27 106.21 8.87 Favored 'General case' 0 C--O 1.244 0.806 0 N-CA-C 106.708 -1.59 . . . . 15.42 106.708 170.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.19 -18.76 65.4 Favored 'General case' 0 CA--C 1.517 -0.323 0 O-C-N 120.966 -1.084 . . . . 10.43 111.951 -177.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -84.45 2.13 42.24 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 120.555 -1.341 . . . . 18.53 113.389 177.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 91.2 m -124.1 -27.77 3.82 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 119.065 0.848 . . . . 14.14 111.617 178.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 53.6 t -58.36 130.76 48.26 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 121.312 0.577 . . . . 10.99 111.684 -177.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 1.9 pp -112.62 26.29 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 C-N-CA 119.144 -1.022 . . . . 13.51 113.136 177.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 57.4 32.26 21.5 Favored 'General case' 0 C--N 1.349 0.575 0 N-CA-C 118.934 2.939 . . . . 16.07 118.934 175.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 7.5 p -72.02 -22.11 61.45 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 114.799 1.407 . . . . 12.97 114.799 -178.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 78.17 -0.0 75.4 Favored Glycine 0 CA--C 1.53 0.99 0 CA-C-O 118.134 -1.37 . . . . 11.51 114.644 -178.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.29 -40.68 74.66 Favored 'General case' 0 C--O 1.243 0.713 0 CA-C-N 122.804 3.302 . . . . 11.25 115.755 -179.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 4.5 p -62.74 -40.28 96.73 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 123.084 0.554 . . . . 10.51 111.985 -179.827 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.65 -34.79 79.12 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.307 0.575 . . . . 10.81 109.999 177.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -67.28 -26.79 73.44 Favored Glycine 0 C--N 1.342 0.887 0 O-C-N 120.344 -1.473 . . . . 10.86 113.897 -179.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 30.3 m -105.29 7.94 9.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 118.671 1.235 . . . . 10.73 112.249 177.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 34.5 t -88.29 117.79 68.79 Favored Pre-proline 0 N--CA 1.439 -1.002 0 O-C-N 121.721 -0.612 . . . . 10.01 111.588 178.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -59.99 -34.05 95.2 Favored 'Trans proline' 0 N--CA 1.459 -0.542 0 C-N-CA 123.778 2.986 . . . . 13.62 113.894 178.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 25.3 m -103.77 5.75 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 N-CA-C 112.848 0.684 . . . . 14.77 112.848 -177.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.3 t0 51.73 45.17 28.58 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 125.398 1.479 . . . . 18.93 114.266 -179.706 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -74.02 -32.69 1.55 Allowed Pre-proline 0 C--O 1.245 0.823 0 N-CA-C 118.372 2.73 . . . . 11.71 118.372 179.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_exo -69.1 125.02 11.95 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 123.713 2.942 . . . . 10.41 110.175 174.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 22.6 m -130.32 144.07 39.07 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 CA-C-O 122.28 1.038 . . . . 13.94 108.396 177.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -72.64 128.28 35.08 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 121.277 -0.889 . . . . 24.69 110.273 178.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.244 0.771 0 O-C-N 125.821 1.951 . . . . 21.8 111.43 177.025 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' SF4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' SF4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.711 0 N-CA-C 113.69 0.996 . . . . 11.73 113.69 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -93.99 159.6 15.09 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 105.736 -1.949 . . . . 14.24 105.736 165.789 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.4 p -136.05 138.22 47.64 Favored 'Isoleucine or valine' 0 C--O 1.24 0.588 0 N-CA-C 105.46 -2.052 . . . . 10.0 105.46 174.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 78.8 mt -84.0 120.57 35.14 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.477 0 N-CA-C 106.738 -1.579 . . . . 11.05 106.738 178.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 38.0 p30 -89.26 -170.94 3.06 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 119.082 -1.047 . . . . 15.0 112.85 -177.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 88.5 mt-10 -69.73 -11.67 61.03 Favored 'General case' 0 CA--C 1.513 -0.48 0 N-CA-C 117.939 2.57 . . . . 26.96 117.939 -174.216 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -67.85 -17.13 64.4 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-O 117.668 -1.158 . . . . 11.89 112.654 176.635 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 53.9 t -51.58 129.26 25.33 Favored 'General case' 0 C--N 1.344 0.368 0 CA-C-N 120.654 1.57 . . . . 11.93 112.711 -178.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 41.5 pt -103.99 13.83 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.164 0 CA-C-N 114.745 -1.116 . . . . 12.01 111.583 177.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 69.2 m 53.71 40.19 31.17 Favored 'General case' 0 C--N 1.345 0.398 0 N-CA-C 117.219 2.303 . . . . 15.45 117.219 178.112 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.0 p -72.98 -24.28 60.75 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 113.63 -1.623 . . . . 12.98 112.981 178.062 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.96 -0.59 88.33 Favored Glycine 0 C--N 1.341 0.833 0 O-C-N 120.782 -1.199 . . . . 11.1 115.707 178.036 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.97 -28.19 69.35 Favored 'General case' 0 C--O 1.247 0.97 0 CA-C-N 120.407 2.103 . . . . 13.43 116.435 -176.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 12.6 p -77.49 -30.94 53.28 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 113.656 0.984 . . . . 13.5 113.656 -178.101 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.6 tt0 -53.45 -51.22 77.83 Favored Pre-proline 0 N--CA 1.451 -0.416 0 N-CA-C 116.135 1.902 . . . . 27.83 116.135 -174.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -62.26 -24.43 76.03 Favored 'Trans proline' 0 N--CA 1.456 -0.72 0 C-N-CA 123.796 2.997 . . . . 16.54 113.563 175.268 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -86.1 -12.93 48.74 Favored 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 117.215 2.302 . . . . 24.45 117.215 -171.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 49.6 t -65.13 120.61 68.65 Favored Pre-proline 0 N--CA 1.447 -0.601 0 O-C-N 124.683 1.239 . . . . 11.61 109.172 176.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -64.81 -19.68 64.42 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 123.082 2.522 . . . . 14.0 113.572 179.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 20.4 m -118.41 17.85 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.275 0 CA-C-N 120.451 1.478 . . . . 11.8 113.353 -179.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 37.1 t30 57.13 39.69 28.82 Favored 'General case' 0 C--O 1.24 0.582 0 CA-C-O 122.294 1.045 . . . . 18.53 113.24 176.15 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -85.19 -8.72 58.44 Favored 'General case' 0 C--O 1.24 0.59 0 O-C-N 120.42 -1.425 . . . . 11.64 114.706 -177.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 68.3 mt -101.87 135.91 36.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 CA-C-N 119.093 0.861 . . . . 12.5 112.03 -175.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 79.6 p -138.01 164.52 28.86 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-O 122.401 1.095 . . . . 19.88 110.034 171.173 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.8 t -75.45 134.05 40.95 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 108.051 -1.092 . . . . 28.19 108.051 177.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -123.9 -169.45 13.14 Favored Glycine 0 CA--C 1.521 0.436 0 CA-C-O 122.682 1.157 . . . . 29.17 111.032 177.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ASP . . . . . 0.555 ' O ' ' HB2' ' A' ' 28' ' ' ASP . 6.0 m-20 -81.14 127.87 33.12 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 105.866 -1.902 . . . . 63.01 105.866 172.728 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ASP . . . . . 0.555 ' HB2' ' O ' ' A' ' 27' ' ' ASP . 2.5 m-20 83.66 -46.72 0.12 Allowed 'General case' 0 C--O 1.234 0.259 0 N-CA-C 114.416 1.265 . . . . 62.88 114.416 177.268 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 2.6 ptt180 -154.07 169.38 23.68 Favored 'General case' 0 C--O 1.24 0.562 0 N-CA-C 107.0 -1.481 . . . . 25.24 107.0 -179.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -73.22 158.19 35.69 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.457 -0.792 . . . . 14.17 110.179 174.821 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -130.57 143.11 41.91 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.478 0 O-C-N 119.81 -1.806 . . . . 13.97 111.544 -174.679 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 75.4 mt -100.3 131.58 47.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 O-C-N 124.07 0.856 . . . . 9.94 110.562 175.162 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.4 t0 -77.27 106.21 8.87 Favored 'General case' 0 C--O 1.244 0.806 0 N-CA-C 106.708 -1.59 . . . . 15.42 106.708 170.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.19 -18.76 65.4 Favored 'General case' 0 CA--C 1.517 -0.323 0 O-C-N 120.966 -1.084 . . . . 10.43 111.951 -177.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -84.45 2.13 42.24 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 120.555 -1.341 . . . . 18.53 113.389 177.293 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 91.2 m -124.1 -27.77 3.82 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 119.065 0.848 . . . . 14.14 111.617 178.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 53.6 t -58.36 130.76 48.26 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 121.312 0.577 . . . . 10.99 111.684 -177.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 1.9 pp -112.62 26.29 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 C-N-CA 119.144 -1.022 . . . . 13.51 113.136 177.156 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 57.4 32.26 21.5 Favored 'General case' 0 C--N 1.349 0.575 0 N-CA-C 118.934 2.939 . . . . 16.07 118.934 175.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 7.5 p -72.02 -22.11 61.45 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 114.799 1.407 . . . . 12.97 114.799 -178.391 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 78.17 -0.0 75.4 Favored Glycine 0 CA--C 1.53 0.99 0 CA-C-O 118.134 -1.37 . . . . 11.51 114.644 -178.396 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.29 -40.68 74.66 Favored 'General case' 0 C--O 1.243 0.713 0 CA-C-N 122.804 3.302 . . . . 11.25 115.755 -179.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 4.5 p -62.74 -40.28 96.73 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 123.084 0.554 . . . . 10.51 111.985 -179.827 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.65 -34.79 79.12 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.307 0.575 . . . . 10.81 109.999 177.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -67.28 -26.79 73.44 Favored Glycine 0 C--N 1.342 0.887 0 O-C-N 120.344 -1.473 . . . . 10.86 113.897 -179.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 30.3 m -105.29 7.94 9.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 118.671 1.235 . . . . 10.73 112.249 177.152 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 34.5 t -88.29 117.79 68.79 Favored Pre-proline 0 N--CA 1.439 -1.002 0 O-C-N 121.721 -0.612 . . . . 10.01 111.588 178.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -59.99 -34.05 95.2 Favored 'Trans proline' 0 N--CA 1.459 -0.542 0 C-N-CA 123.778 2.986 . . . . 13.62 113.894 178.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 25.3 m -103.77 5.75 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 N-CA-C 112.848 0.684 . . . . 14.77 112.848 -177.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.3 t0 51.73 45.17 28.58 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 125.398 1.479 . . . . 18.93 114.266 -179.706 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -74.02 -32.69 1.55 Allowed Pre-proline 0 C--O 1.245 0.823 0 N-CA-C 118.372 2.73 . . . . 11.71 118.372 179.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_exo -69.1 125.02 11.95 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 123.713 2.942 . . . . 10.41 110.175 174.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 22.6 m -130.32 144.07 39.07 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 CA-C-O 122.28 1.038 . . . . 13.94 108.396 177.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -72.64 128.28 35.08 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 121.277 -0.889 . . . . 24.69 110.273 178.117 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.244 0.771 0 O-C-N 125.821 1.951 . . . . 21.8 111.43 177.025 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 56' ' ' SF4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 57' ' ' SF4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 58' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 59' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 67' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 68' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 69' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 70' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 71' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 72' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 73' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 74' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 75' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 76' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 77' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 78' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 79' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 80' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.445 -0.711 0 N-CA-C 113.69 0.996 . . . . 11.73 113.69 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' TYR . . . . . . . . . . . . . 4.5 m-85 -93.99 159.6 15.09 Favored 'General case' 0 C--N 1.313 -1.005 0 N-CA-C 105.736 -1.949 . . . . 14.24 105.736 165.789 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 9.4 p -136.05 138.22 47.64 Favored 'Isoleucine or valine' 0 C--O 1.24 0.588 0 N-CA-C 105.46 -2.052 . . . . 10.0 105.46 174.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 78.8 mt -84.0 120.57 35.14 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.477 0 N-CA-C 106.738 -1.579 . . . . 11.05 106.738 178.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 38.0 p30 -89.26 -170.94 3.06 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 119.082 -1.047 . . . . 15.0 112.85 -177.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 88.5 mt-10 -69.73 -11.67 61.03 Favored 'General case' 0 CA--C 1.513 -0.48 0 N-CA-C 117.939 2.57 . . . . 26.96 117.939 -174.216 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -67.85 -17.13 64.4 Favored 'General case' 0 N--CA 1.442 -0.852 0 CA-C-O 117.668 -1.158 . . . . 11.89 112.654 176.635 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 53.9 t -51.58 129.26 25.33 Favored 'General case' 0 C--N 1.344 0.368 0 CA-C-N 120.654 1.57 . . . . 11.93 112.711 -178.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 41.5 pt -103.99 13.83 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.164 0 CA-C-N 114.745 -1.116 . . . . 12.01 111.583 177.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 69.2 m 53.71 40.19 31.17 Favored 'General case' 0 C--N 1.345 0.398 0 N-CA-C 117.219 2.303 . . . . 15.45 117.219 178.112 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 4.0 p -72.98 -24.28 60.75 Favored 'General case' 0 N--CA 1.447 -0.61 0 CA-C-N 113.63 -1.623 . . . . 12.98 112.981 178.062 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' GLY . . . . . . . . . . . . . . . 81.96 -0.59 88.33 Favored Glycine 0 C--N 1.341 0.833 0 O-C-N 120.782 -1.199 . . . . 11.1 115.707 178.036 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ALA . . . . . . . . . . . . . . . -64.97 -28.19 69.35 Favored 'General case' 0 C--O 1.247 0.97 0 CA-C-N 120.407 2.103 . . . . 13.43 116.435 -176.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' CYS . . . . . . . . . . . . . 12.6 p -77.49 -30.94 53.28 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 113.656 0.984 . . . . 13.5 113.656 -178.101 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 49.6 tt0 -53.45 -51.22 77.83 Favored Pre-proline 0 N--CA 1.451 -0.416 0 N-CA-C 116.135 1.902 . . . . 27.83 116.135 -174.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_exo -62.26 -24.43 76.03 Favored 'Trans proline' 0 N--CA 1.456 -0.72 0 C-N-CA 123.796 2.997 . . . . 16.54 113.563 175.268 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 61.2 mm-40 -86.1 -12.93 48.74 Favored 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 117.215 2.302 . . . . 24.45 117.215 -171.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' CYS . . . . . . . . . . . . . 49.6 t -65.13 120.61 68.65 Favored Pre-proline 0 N--CA 1.447 -0.601 0 O-C-N 124.683 1.239 . . . . 11.61 109.172 176.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -64.81 -19.68 64.42 Favored 'Trans proline' 0 N--CA 1.455 -0.737 0 C-N-CA 123.082 2.522 . . . . 14.0 113.572 179.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 20.4 m -118.41 17.85 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.275 0 CA-C-N 120.451 1.478 . . . . 11.8 113.353 -179.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 37.1 t30 57.13 39.69 28.82 Favored 'General case' 0 C--O 1.24 0.582 0 CA-C-O 122.294 1.045 . . . . 18.53 113.24 176.15 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -85.19 -8.72 58.44 Favored 'General case' 0 C--O 1.24 0.59 0 O-C-N 120.42 -1.425 . . . . 11.64 114.706 -177.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ILE . . . . . . . . . . . . . 68.3 mt -101.87 135.91 36.39 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.337 0 CA-C-N 119.093 0.861 . . . . 12.5 112.03 -175.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 79.6 p -138.01 164.52 28.86 Favored 'General case' 0 N--CA 1.443 -0.798 0 CA-C-O 122.401 1.095 . . . . 19.88 110.034 171.173 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.8 t -75.45 134.05 40.95 Favored 'General case' 0 N--CA 1.447 -0.587 0 N-CA-C 108.051 -1.092 . . . . 28.19 108.051 177.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -123.9 -169.45 13.14 Favored Glycine 0 CA--C 1.521 0.436 0 CA-C-O 122.682 1.157 . . . . 29.17 111.032 177.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ASP . . . . . 0.555 ' O ' ' HB2' ' A' ' 28' ' ' ASP . 6.0 m-20 -81.14 127.87 33.12 Favored 'General case' 0 CA--C 1.515 -0.386 0 N-CA-C 105.866 -1.902 . . . . 63.01 105.866 172.728 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.555 ' HB2' ' O ' ' A' ' 27' ' ' ASP . 2.5 m-20 83.66 -46.72 0.12 Allowed 'General case' 0 C--O 1.234 0.259 0 N-CA-C 114.416 1.265 . . . . 62.88 114.416 177.268 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 2.6 ptt180 -154.07 169.38 23.68 Favored 'General case' 0 C--O 1.24 0.562 0 N-CA-C 107.0 -1.481 . . . . 25.24 107.0 -179.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -73.22 158.19 35.69 Favored 'General case' 0 C--N 1.327 -0.401 0 CA-C-N 115.457 -0.792 . . . . 14.17 110.179 174.821 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -130.57 143.11 41.91 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.478 0 O-C-N 119.81 -1.806 . . . . 13.97 111.544 -174.679 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 75.4 mt -100.3 131.58 47.55 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.33 0 O-C-N 124.07 0.856 . . . . 9.94 110.562 175.162 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 33.4 t0 -77.27 106.21 8.87 Favored 'General case' 0 C--O 1.244 0.806 0 N-CA-C 106.708 -1.59 . . . . 15.42 106.708 170.807 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -67.19 -18.76 65.4 Favored 'General case' 0 CA--C 1.517 -0.323 0 O-C-N 120.966 -1.084 . . . . 10.43 111.951 -177.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 90.1 m-20 -84.45 2.13 42.24 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 120.555 -1.341 . . . . 18.53 113.389 177.293 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 91.2 m -124.1 -27.77 3.82 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 119.065 0.848 . . . . 14.14 111.617 178.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' CYS . . . . . . . . . . . . . 53.6 t -58.36 130.76 48.26 Favored 'General case' 0 N--CA 1.447 -0.622 0 CA-C-O 121.312 0.577 . . . . 10.99 111.684 -177.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 1.9 pp -112.62 26.29 3.37 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.357 0 C-N-CA 119.144 -1.022 . . . . 13.51 113.136 177.156 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 80.1 m-20 57.4 32.26 21.5 Favored 'General case' 0 C--N 1.349 0.575 0 N-CA-C 118.934 2.939 . . . . 16.07 118.934 175.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' CYS . . . . . . . . . . . . . 7.5 p -72.02 -22.11 61.45 Favored 'General case' 0 N--CA 1.442 -0.863 0 N-CA-C 114.799 1.407 . . . . 12.97 114.799 -178.391 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 78.17 -0.0 75.4 Favored Glycine 0 CA--C 1.53 0.99 0 CA-C-O 118.134 -1.37 . . . . 11.51 114.644 -178.396 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -56.29 -40.68 74.66 Favored 'General case' 0 C--O 1.243 0.713 0 CA-C-N 122.804 3.302 . . . . 11.25 115.755 -179.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 4.5 p -62.74 -40.28 96.73 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 123.084 0.554 . . . . 10.51 111.985 -179.827 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ALA . . . . . . . . . . . . . . . -64.65 -34.79 79.12 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 121.307 0.575 . . . . 10.81 109.999 177.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -67.28 -26.79 73.44 Favored Glycine 0 C--N 1.342 0.887 0 O-C-N 120.344 -1.473 . . . . 10.86 113.897 -179.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 30.3 m -105.29 7.94 9.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.259 0 CA-C-N 118.671 1.235 . . . . 10.73 112.249 177.152 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 34.5 t -88.29 117.79 68.79 Favored Pre-proline 0 N--CA 1.439 -1.002 0 O-C-N 121.721 -0.612 . . . . 10.01 111.588 178.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' PRO . . . . . . . . . . . . . 94.4 Cg_endo -59.99 -34.05 95.2 Favored 'Trans proline' 0 N--CA 1.459 -0.542 0 C-N-CA 123.778 2.986 . . . . 13.62 113.894 178.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' VAL . . . . . . . . . . . . . 25.3 m -103.77 5.75 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.483 0 N-CA-C 112.848 0.684 . . . . 14.77 112.848 -177.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ASP . . . . . . . . . . . . . 12.3 t0 51.73 45.17 28.58 Favored 'General case' 0 C--O 1.235 0.302 0 C-N-CA 125.398 1.479 . . . . 18.93 114.266 -179.706 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -74.02 -32.69 1.55 Allowed Pre-proline 0 C--O 1.245 0.823 0 N-CA-C 118.372 2.73 . . . . 11.71 118.372 179.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_exo -69.1 125.02 11.95 Favored 'Trans proline' 0 C--N 1.35 0.614 0 C-N-CA 123.713 2.942 . . . . 10.41 110.175 174.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 22.6 m -130.32 144.07 39.07 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 CA-C-O 122.28 1.038 . . . . 13.94 108.396 177.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 39.1 tt0 -72.64 128.28 35.08 Favored 'General case' 0 C--N 1.326 -0.451 0 O-C-N 121.277 -0.889 . . . . 24.69 110.273 178.117 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.244 0.771 0 O-C-N 125.821 1.951 . . . . 21.8 111.43 177.025 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' SF4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' SF4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_