data_1ff2_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 1ff2 _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 1.43 -1.452 0 N-CA-C 109.957 -0.386 . . . . 29.34 109.957 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -99.71 140.49 33.84 Favored 'General case' 0 CA--C 1.508 -0.654 0 N-CA-C 105.312 -2.106 . . . . 25.25 105.312 170.035 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 22.0 t -120.61 131.64 72.25 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 C-N-CA 125.306 1.443 . . . . 24.29 113.424 -174.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 40.2 t -80.24 123.22 36.74 Favored 'Isoleucine or valine' 0 C--O 1.242 0.699 0 C-N-CA 123.624 0.769 . . . . 21.79 109.088 171.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 80.6 p -105.24 -166.78 1.26 Allowed 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 114.986 1.476 . . . . 20.28 114.986 178.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -47.39 -45.94 25.61 Favored 'General case' 0 CA--C 1.504 -0.813 0 N-CA-C 121.307 3.817 . . . . 22.98 121.307 -174.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 55.1 t30 -67.38 -3.22 7.64 Favored 'General case' 0 C--O 1.217 -0.615 0 CA-C-N 120.882 1.674 . . . . 23.02 114.146 -175.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 40.6 t -76.85 -33.39 57.89 Favored 'General case' 0 C--O 1.206 -1.188 0 CA-C-N 121.051 1.751 . . . . 20.36 112.579 175.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 67.7 mt -60.45 130.38 24.2 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.565 0 O-C-N 121.864 -0.522 . . . . 19.98 112.091 -179.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 63.9 mmtt 73.86 2.49 4.22 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 125.429 1.491 . . . . 22.81 111.906 -178.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 84.5 m -114.63 -66.23 1.11 Allowed 'General case' 0 N--CA 1.438 -1.043 0 N-CA-C 107.275 -1.38 . . . . 19.74 107.275 174.268 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 70.2 tttt 48.38 52.73 13.08 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 119.048 -2.282 . . . . 22.2 115.678 175.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -58.3 -34.8 70.96 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 114.809 1.411 . . . . 24.09 114.809 -178.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 45.0 p 65.39 21.15 11.89 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 127.544 2.338 . . . . 23.69 114.722 179.332 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 42.7 m-20 -71.99 -25.48 61.86 Favored 'General case' 0 C--N 1.353 0.729 0 O-C-N 120.787 -1.195 . . . . 30.97 109.539 175.534 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 26.4 p -55.66 -34.96 65.45 Favored 'General case' 0 C--O 1.246 0.912 0 N-CA-C 116.04 1.867 . . . . 23.72 116.04 178.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 18.1 m -73.42 -26.09 21.9 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 N-CA-C 116.095 1.887 . . . . 24.62 116.095 -175.223 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -70.4 -14.31 62.5 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 116.743 2.127 . . . . 38.05 116.743 -177.71 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 44.4 t -106.92 0.3 9.99 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.355 0 O-C-N 124.074 0.859 . . . . 28.64 110.069 -177.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 20.6 t -82.09 110.74 22.29 Favored Pre-proline 0 N--CA 1.438 -1.035 0 O-C-N 119.308 -2.12 . . . . 24.52 111.863 -174.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -53.52 -34.2 71.37 Favored 'Trans proline' 0 N--CA 1.447 -1.252 0 C-N-CA 123.801 3.001 . . . . 25.17 116.136 176.203 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 16.2 m -110.17 1.45 9.26 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.763 0 N-CA-C 116.994 2.22 . . . . 24.76 116.994 -176.01 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 53.24 57.83 5.86 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 112.879 0.696 . . . . 28.56 112.879 -178.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 20.2 p -104.66 26.17 9.42 Favored 'General case' 0 C--N 1.358 0.977 0 N-CA-C 116.122 1.897 . . . . 21.92 116.122 177.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -98.46 135.38 40.11 Favored 'General case' 0 CA--C 1.507 -0.702 0 O-C-N 123.17 0.294 . . . . 19.22 110.973 177.494 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -124.46 134.82 52.94 Favored 'General case' 0 C--O 1.245 0.821 0 CA-C-O 118.816 -0.612 . . . . 22.64 111.045 -179.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -106.95 141.49 38.08 Favored 'General case' 0 N--CA 1.435 -1.181 0 N-CA-C 117.79 2.515 . . . . 26.48 117.79 -170.061 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -111.32 176.7 18.61 Favored Glycine 0 N--CA 1.436 -1.361 0 N-CA-C 108.663 -1.775 . . . . 23.02 108.663 173.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -49.05 -47.52 21.43 Favored 'Trans proline' 0 C--O 1.247 0.956 0 C-N-CA 122.751 2.3 . . . . 24.33 114.112 177.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 49.6 p30 -134.06 30.22 3.66 Favored 'General case' 0 CA--C 1.502 -0.879 0 N-CA-C 112.679 0.622 . . . . 22.35 112.679 -178.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -161.74 152.83 18.19 Favored 'General case' 0 N--CA 1.444 -0.74 0 O-C-N 120.63 -1.294 . . . . 18.95 110.314 -175.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -120.56 155.35 33.86 Favored 'General case' 0 N--CA 1.443 -0.812 0 O-C-N 121.519 -0.738 . . . . 18.43 109.525 173.055 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 15.4 m -134.12 167.4 26.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 O-C-N 121.644 -0.66 . . . . 19.31 112.443 174.441 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 88.4 mt -116.65 132.75 65.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.672 0 N-CA-C 106.468 -1.678 . . . . 18.42 106.468 -179.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' HIS . . . . . . . . . . . . . 19.6 t-80 -75.99 109.4 8.1 Favored Pre-proline 0 N--CA 1.427 -1.617 0 N-CA-C 109.022 -0.733 . . . . 20.77 109.022 176.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -58.12 -31.24 92.74 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 124.726 3.617 . . . . 22.91 113.798 -172.344 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -78.59 -28.15 45.76 Favored 'General case' 0 N--CA 1.44 -0.928 0 N-CA-C 115.862 1.801 . . . . 30.03 115.862 -179.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -89.76 -31.93 17.2 Favored 'General case' 0 C--N 1.315 -0.914 0 O-C-N 121.803 -0.56 . . . . 23.91 111.498 -178.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 43.0 t -54.68 131.07 42.65 Favored 'General case' 0 C--N 1.35 0.622 0 N-CA-C 114.251 1.204 . . . . 21.77 114.251 177.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 44.9 pt -103.57 12.38 7.69 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.401 0 N-CA-C 114.135 1.161 . . . . 21.32 114.135 -177.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 19.2 m-20 54.22 41.38 32.03 Favored 'General case' 0 CA--C 1.508 -0.662 0 N-CA-C 115.762 1.764 . . . . 27.02 115.762 178.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 4.0 p30 -84.19 -3.77 58.37 Favored 'General case' 0 C--O 1.17 -3.109 1 C-N-CA 110.878 -4.329 . . . . 28.98 113.911 177.698 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . 73.45 7.25 5.14 Favored 'General case' 0 N--CA 1.431 -1.383 0 C-N-CA 128.605 2.762 . . . . 22.32 115.267 171.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -67.87 -25.78 65.69 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 112.803 -1.999 . . . . 29.84 115.19 -173.99 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 28.3 p -81.15 -25.95 36.45 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 117.836 -1.078 . . . . 26.49 112.767 179.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.55 -41.2 77.3 Favored Pre-proline 0 C--O 1.239 0.552 0 CA-C-N 121.577 1.989 . . . . 39.51 114.581 -175.219 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 60.9 Cg_endo -77.33 -8.24 17.29 Favored 'Trans proline' 0 N--CA 1.442 -1.541 0 CA-C-N 124.618 2.685 . . . . 24.64 113.753 177.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -87.81 -17.88 30.55 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 113.713 1.005 . . . . 24.36 113.713 -178.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 39.3 t -80.5 118.21 71.37 Favored Pre-proline 0 N--CA 1.448 -0.551 0 O-C-N 124.079 0.862 . . . . 23.82 112.702 -177.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -65.6 -25.62 54.64 Favored 'Trans proline' 0 C--O 1.238 0.519 0 C-N-CA 125.272 3.981 . . . . 22.12 112.721 179.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -84.58 -10.22 57.59 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 114.635 -1.166 . . . . 21.43 110.903 178.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 53.22 37.3 24.8 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 121.678 -0.639 . . . . 28.03 110.361 -176.912 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -92.26 -5.33 52.58 Favored 'General case' 0 CA--C 1.505 -0.788 0 N-CA-C 114.812 1.412 . . . . 19.89 114.812 -176.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 57.0 mt -96.42 131.62 42.74 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 N-CA-C 113.4 0.889 . . . . 18.55 113.4 178.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 67.7 m-85 -134.57 150.64 50.75 Favored 'General case' 0 C--O 1.214 -0.767 0 CA-C-N 114.878 -1.055 . . . . 20.56 111.561 179.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 34.0 t -61.86 141.67 57.82 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 104.886 -2.265 . . . . 27.43 104.886 171.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -47.96 -49.28 31.01 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 122.035 2.198 . . . . 29.14 114.97 -179.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 30.7 p30 -71.36 0.16 8.77 Favored 'General case' 0 C--N 1.348 0.527 0 N-CA-C 114.36 1.244 . . . . 41.26 114.36 179.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.8 mt-10 -115.47 3.95 14.19 Favored 'General case' 0 CA--C 1.551 0.986 0 O-C-N 120.771 -1.206 . . . . 42.0 113.275 178.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 89.3 t -62.13 126.47 87.68 Favored Pre-proline 0 CA--C 1.517 -0.316 0 O-C-N 119.403 -2.061 . . . . 26.87 107.785 178.165 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -47.04 144.25 8.86 Favored 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 123.976 3.118 . . . . 23.94 113.383 178.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.5 tm-20 -52.79 -38.78 61.62 Favored 'General case' 0 N--CA 1.438 -1.054 0 N-CA-C 113.618 0.969 . . . . 28.03 113.618 179.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 45.4 p-10 -83.73 8.6 14.1 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 114.313 1.227 . . . . 31.28 114.313 -179.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 42.8 mtm -128.6 19.9 6.16 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-N 119.517 1.053 . . . . 26.93 110.477 176.084 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 83.3 mm-40 -57.34 -26.95 61.77 Favored 'General case' 0 C--N 1.344 0.353 0 N-CA-C 112.895 0.702 . . . . 23.39 112.895 179.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 13.8 tp10 -54.15 -38.97 66.08 Favored 'General case' 0 CA--C 1.554 1.097 0 N-CA-C 114.46 1.281 . . . . 46.16 114.46 175.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -62.42 -19.45 63.48 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 114.013 1.116 . . . . 21.2 114.013 -177.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 93.7 mt -62.86 -53.26 49.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 O-C-N 120.248 -1.532 . . . . 21.39 111.0 179.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 38.1 tt0 -68.16 -40.13 82.44 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 107.792 -1.188 . . . . 34.62 107.792 178.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.7 tp -54.74 -47.99 73.13 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 118.486 0.585 . . . . 23.42 112.201 -179.305 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -59.48 -41.76 90.52 Favored 'General case' 0 C--O 1.224 -0.278 0 N-CA-C 112.558 0.577 . . . . 20.48 112.558 177.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -66.59 -45.55 78.87 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-O 117.711 -1.138 . . . . 24.7 111.52 -179.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -70.69 -36.38 73.26 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 120.01 1.277 . . . . 32.21 114.075 -179.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 79.6 mt -78.97 -26.3 43.42 Favored 'General case' 0 C--O 1.244 0.765 0 N-CA-C 115.795 1.776 . . . . 21.72 115.795 176.114 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.31 -19.74 63.61 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 119.923 -1.735 . . . . 25.77 110.439 174.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -84.52 -23.16 29.9 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 114.876 -1.056 . . . . 38.29 111.63 178.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 31.0 m -110.77 -24.65 3.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 O-C-N 119.926 -1.734 . . . . 29.32 113.042 -176.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 24.8 m0 -83.85 157.7 63.16 Favored Pre-proline 0 C--O 1.245 0.819 0 O-C-N 120.697 -1.252 . . . . 28.13 112.797 -176.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -77.01 148.44 27.77 Favored 'Trans proline' 0 N--CA 1.443 -1.491 0 C-N-CA 123.139 2.559 . . . . 24.65 115.093 175.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -63.35 130.58 45.07 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 114.136 -1.393 . . . . 23.49 113.64 176.964 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.4 tt -116.73 124.1 72.43 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 N-CA-C 108.745 -0.835 . . . . 25.1 108.745 174.206 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 65.8 p -121.72 -4.89 9.19 Favored 'General case' 0 C--O 1.245 0.821 0 N-CA-C 114.928 1.455 . . . . 29.3 114.928 -175.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -125.3 153.39 43.34 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 113.684 0.994 . . . . 45.32 113.684 -178.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 6.6 tmtm? -68.77 143.39 54.66 Favored 'General case' 0 N--CA 1.438 -1.063 0 N-CA-C 106.824 -1.547 . . . . 32.62 106.824 179.913 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 10.8 ttmm -131.81 164.58 25.72 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 113.03 -1.895 . . . . 35.81 107.596 177.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -70.26 141.5 88.75 Favored Pre-proline 0 CA--C 1.484 -1.566 0 O-C-N 120.438 -1.414 . . . . 34.87 108.741 175.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -55.02 168.69 1.13 Allowed 'Trans proline' 0 C--N 1.318 -1.028 0 C-N-CA 123.426 2.751 . . . . 30.77 111.655 176.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.8 mt -66.42 144.12 98.54 Favored Pre-proline 0 N--CA 1.444 -0.731 0 O-C-N 120.439 -1.413 . . . . 31.01 108.11 175.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -41.38 -40.15 4.56 Favored 'Trans proline' 0 N--CA 1.461 -0.423 0 C-N-CA 124.78 3.654 . . . . 35.77 118.779 -177.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 42.2 m-20 -112.94 32.57 5.61 Favored 'General case' 0 CA--C 1.51 -0.586 0 O-C-N 121.378 -0.826 . . . . 39.67 112.614 -179.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -53.45 -43.07 67.79 Favored 'General case' 0 C--N 1.348 0.523 0 N-CA-C 114.722 1.378 . . . . 35.36 114.722 -176.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.03 -30.01 69.98 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.639 -0.663 . . . . 50.82 112.534 179.777 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -64.13 -35.85 82.12 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-N 118.45 0.568 . . . . 33.06 111.886 175.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -93.3 -3.58 53.29 Favored 'General case' 0 N--CA 1.435 -1.216 0 N-CA-C 114.497 1.295 . . . . 29.5 114.497 -179.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -74.64 111.12 9.51 Favored 'General case' 0 C--O 1.218 -0.588 0 CA-C-N 120.009 1.277 . . . . 29.22 111.946 178.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.72 -9.74 37.81 Favored Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 120.126 -1.035 . . . . 25.59 111.971 -178.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 47.2 t -74.44 143.73 13.15 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.697 0 N-CA-C 106.171 -1.789 . . . . 24.17 106.171 178.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.95 163.62 12.61 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 119.197 0.908 . . . . 34.02 111.337 -175.372 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 57.77 37.6 84.65 Favored Glycine 0 C--N 1.341 0.835 0 CA-C-O 118.103 -1.387 . . . . 23.78 112.461 -178.227 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 48.1 mtmt -75.15 -3.07 30.7 Favored 'General case' 0 N--CA 1.422 -1.837 0 CA-C-N 118.362 1.081 . . . . 17.78 111.332 -177.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 33.1 tp -63.3 -22.58 66.97 Favored 'General case' 0 C--O 1.217 -0.629 0 O-C-N 120.526 -1.359 . . . . 22.24 110.156 178.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 22.9 pt20 -69.8 -14.91 63.0 Favored 'General case' 0 C--O 1.224 -0.256 0 O-C-N 120.495 -1.378 . . . . 26.59 110.463 177.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 55.7 m80 -103.63 5.12 36.26 Favored 'General case' 0 C--N 1.355 0.844 0 N-CA-C 114.547 1.314 . . . . 29.16 114.547 177.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 52.3 tp -61.76 131.99 51.7 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 119.147 0.885 . . . . 24.73 112.399 179.008 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 88.4 mt-10 -112.43 128.68 56.38 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 123.808 0.692 . . . . 35.08 111.841 179.325 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.344 0.347 0 C-N-CA 125.551 1.541 . . . . 41.43 111.305 178.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' SF4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' F3S . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 0 . 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 0 . 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 orig full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' ALA . . . . . 0.652 ' HB3' ' OD1' ' A' ' 41' ' ' ASP . . . . . . . . 0 N--CA 1.43 -1.452 0 N-CA-C 109.957 -0.386 . . . . 29.34 109.957 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -99.71 140.49 33.84 Favored 'General case' 0 CA--C 1.508 -0.654 0 N-CA-C 105.312 -2.106 . . . . 25.25 105.312 170.035 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 22.0 t -120.61 131.64 72.25 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 C-N-CA 125.306 1.443 . . . . 24.29 113.424 -174.414 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' VAL . . . . . 0.468 HG23 HG13 ' A' ' 34' ' ' ILE . 40.2 t -80.24 123.22 36.74 Favored 'Isoleucine or valine' 0 C--O 1.242 0.699 0 C-N-CA 123.624 0.769 . . . . 21.79 109.088 171.813 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 80.6 p -105.24 -166.78 1.26 Allowed 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 114.986 1.476 . . . . 20.28 114.986 178.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -47.39 -45.94 25.61 Favored 'General case' 0 CA--C 1.504 -0.813 0 N-CA-C 121.307 3.817 . . . . 22.98 121.307 -174.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 55.1 t30 -67.38 -3.22 7.64 Favored 'General case' 0 C--O 1.217 -0.615 0 CA-C-N 120.882 1.674 . . . . 23.02 114.146 -175.391 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 40.6 t -76.85 -33.39 57.89 Favored 'General case' 0 C--O 1.206 -1.188 0 CA-C-N 121.051 1.751 . . . . 20.36 112.579 175.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 67.7 mt -60.45 130.38 24.2 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.565 0 O-C-N 121.864 -0.522 . . . . 19.98 112.091 -179.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 63.9 mmtt 73.86 2.49 4.22 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 125.429 1.491 . . . . 22.81 111.906 -178.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 84.5 m -114.63 -66.23 1.11 Allowed 'General case' 0 N--CA 1.438 -1.043 0 N-CA-C 107.275 -1.38 . . . . 19.74 107.275 174.268 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 70.2 tttt 48.38 52.73 13.08 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 119.048 -2.282 . . . . 22.2 115.678 175.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -58.3 -34.8 70.96 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 114.809 1.411 . . . . 24.09 114.809 -178.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 45.0 p 65.39 21.15 11.89 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 127.544 2.338 . . . . 23.69 114.722 179.332 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 42.7 m-20 -71.99 -25.48 61.86 Favored 'General case' 0 C--N 1.353 0.729 0 O-C-N 120.787 -1.195 . . . . 30.97 109.539 175.534 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 26.4 p -55.66 -34.96 65.45 Favored 'General case' 0 C--O 1.246 0.912 0 N-CA-C 116.04 1.867 . . . . 23.72 116.04 178.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 18.1 m -73.42 -26.09 21.9 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 N-CA-C 116.095 1.887 . . . . 24.62 116.095 -175.223 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -70.4 -14.31 62.5 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 116.743 2.127 . . . . 38.05 116.743 -177.71 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' VAL . . . . . 0.538 HG12 ' HB3' ' A' ' 44' ' ' LEU . 44.4 t -106.92 0.3 9.99 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.355 0 O-C-N 124.074 0.859 . . . . 28.64 110.069 -177.881 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 20.6 t -82.09 110.74 22.29 Favored Pre-proline 0 N--CA 1.438 -1.035 0 O-C-N 119.308 -2.12 . . . . 24.52 111.863 -174.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' PRO . . . . . 0.539 ' HG3' ' OD1' ' A' ' 42' ' ' ASP . 69.9 Cg_endo -53.52 -34.2 71.37 Favored 'Trans proline' 0 N--CA 1.447 -1.252 0 C-N-CA 123.801 3.001 . . . . 25.17 116.136 176.203 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 16.2 m -110.17 1.45 9.26 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.763 0 N-CA-C 116.994 2.22 . . . . 24.76 116.994 -176.01 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 53.24 57.83 5.86 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 112.879 0.696 . . . . 28.56 112.879 -178.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 20.2 p -104.66 26.17 9.42 Favored 'General case' 0 C--N 1.358 0.977 0 N-CA-C 116.122 1.897 . . . . 21.92 116.122 177.366 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -98.46 135.38 40.11 Favored 'General case' 0 CA--C 1.507 -0.702 0 O-C-N 123.17 0.294 . . . . 19.22 110.973 177.494 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -124.46 134.82 52.94 Favored 'General case' 0 C--O 1.245 0.821 0 CA-C-O 118.816 -0.612 . . . . 22.64 111.045 -179.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLU . . . . . 0.434 ' HB2' HD22 ' A' ' 32' ' ' LEU . 0.3 OUTLIER -106.95 141.49 38.08 Favored 'General case' 0 N--CA 1.435 -1.181 0 N-CA-C 117.79 2.515 . . . . 26.48 117.79 -170.061 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -111.32 176.7 18.61 Favored Glycine 0 N--CA 1.436 -1.361 0 N-CA-C 108.663 -1.775 . . . . 23.02 108.663 173.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -49.05 -47.52 21.43 Favored 'Trans proline' 0 C--O 1.247 0.956 0 C-N-CA 122.751 2.3 . . . . 24.33 114.112 177.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 49.6 p30 -134.06 30.22 3.66 Favored 'General case' 0 CA--C 1.502 -0.879 0 N-CA-C 112.679 0.622 . . . . 22.35 112.679 -178.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -161.74 152.83 18.19 Favored 'General case' 0 N--CA 1.444 -0.74 0 O-C-N 120.63 -1.294 . . . . 18.95 110.314 -175.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LEU . . . . . 0.573 ' HG ' ' S1 ' ' A' ' 108' ' ' F3S . 0.4 OUTLIER -120.56 155.35 33.86 Favored 'General case' 0 N--CA 1.443 -0.812 0 O-C-N 121.519 -0.738 . . . . 18.43 109.525 173.055 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 15.4 m -134.12 167.4 26.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 O-C-N 121.644 -0.66 . . . . 19.31 112.443 174.441 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ILE . . . . . 0.468 HG13 HG23 ' A' ' 4' ' ' VAL . 88.4 mt -116.65 132.75 65.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.672 0 N-CA-C 106.468 -1.678 . . . . 18.42 106.468 -179.715 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' HIS . . . . . 0.544 ' CE1' ' HB2' ' A' ' 37' ' ' ASP . 19.6 t-80 -75.99 109.4 8.1 Favored Pre-proline 0 N--CA 1.427 -1.617 0 N-CA-C 109.022 -0.733 . . . . 20.77 109.022 176.26 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -58.12 -31.24 92.74 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 124.726 3.617 . . . . 22.91 113.798 -172.344 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ASP . . . . . 0.544 ' HB2' ' CE1' ' A' ' 35' ' ' HIS . 79.9 m-20 -78.59 -28.15 45.76 Favored 'General case' 0 N--CA 1.44 -0.928 0 N-CA-C 115.862 1.801 . . . . 30.03 115.862 -179.895 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -89.76 -31.93 17.2 Favored 'General case' 0 C--N 1.315 -0.914 0 O-C-N 121.803 -0.56 . . . . 23.91 111.498 -178.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 43.0 t -54.68 131.07 42.65 Favored 'General case' 0 C--N 1.35 0.622 0 N-CA-C 114.251 1.204 . . . . 21.77 114.251 177.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 44.9 pt -103.57 12.38 7.69 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.401 0 N-CA-C 114.135 1.161 . . . . 21.32 114.135 -177.368 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ASP . . . . . 0.652 ' OD1' ' HB3' ' A' ' 1' ' ' ALA . 19.2 m-20 54.22 41.38 32.03 Favored 'General case' 0 CA--C 1.508 -0.662 0 N-CA-C 115.762 1.764 . . . . 27.02 115.762 178.134 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ASP . . . . . 0.539 ' OD1' ' HG3' ' A' ' 21' ' ' PRO . 4.0 p30 -84.19 -3.77 58.37 Favored 'General case' 0 C--O 1.17 -3.109 1 C-N-CA 110.878 -4.329 . . . . 28.98 113.911 177.698 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . 73.45 7.25 5.14 Favored 'General case' 0 N--CA 1.431 -1.383 0 C-N-CA 128.605 2.762 . . . . 22.32 115.267 171.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' LEU . . . . . 0.538 ' HB3' HG12 ' A' ' 19' ' ' VAL . 0.8 OUTLIER -67.87 -25.78 65.69 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 112.803 -1.999 . . . . 29.84 115.19 -173.99 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 28.3 p -81.15 -25.95 36.45 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 117.836 -1.078 . . . . 26.49 112.767 179.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' GLU . . . . . 0.721 ' HG3' ' HD3' ' A' ' 47' ' ' PRO . 0.0 OUTLIER -61.55 -41.2 77.3 Favored Pre-proline 0 C--O 1.239 0.552 0 CA-C-N 121.577 1.989 . . . . 39.51 114.581 -175.219 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 47' ' ' PRO . . . . . 0.721 ' HD3' ' HG3' ' A' ' 46' ' ' GLU . 60.9 Cg_endo -77.33 -8.24 17.29 Favored 'Trans proline' 0 N--CA 1.442 -1.541 0 CA-C-N 124.618 2.685 . . . . 24.64 113.753 177.748 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' GLU . . . . . 0.45 ' HG3' HG21 ' A' ' 19' ' ' VAL . 71.6 mm-40 -87.81 -17.88 30.55 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 113.713 1.005 . . . . 24.36 113.713 -178.322 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 39.3 t -80.5 118.21 71.37 Favored Pre-proline 0 N--CA 1.448 -0.551 0 O-C-N 124.079 0.862 . . . . 23.82 112.702 -177.371 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -65.6 -25.62 54.64 Favored 'Trans proline' 0 C--O 1.238 0.519 0 C-N-CA 125.272 3.981 . . . . 22.12 112.721 179.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -84.58 -10.22 57.59 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 114.635 -1.166 . . . . 21.43 110.903 178.638 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 53.22 37.3 24.8 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 121.678 -0.639 . . . . 28.03 110.361 -176.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -92.26 -5.33 52.58 Favored 'General case' 0 CA--C 1.505 -0.788 0 N-CA-C 114.812 1.412 . . . . 19.89 114.812 -176.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 57.0 mt -96.42 131.62 42.74 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 N-CA-C 113.4 0.889 . . . . 18.55 113.4 178.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 67.7 m-85 -134.57 150.64 50.75 Favored 'General case' 0 C--O 1.214 -0.767 0 CA-C-N 114.878 -1.055 . . . . 20.56 111.561 179.595 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 34.0 t -61.86 141.67 57.82 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 104.886 -2.265 . . . . 27.43 104.886 171.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -47.96 -49.28 31.01 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 122.035 2.198 . . . . 29.14 114.97 -179.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 30.7 p30 -71.36 0.16 8.77 Favored 'General case' 0 C--N 1.348 0.527 0 N-CA-C 114.36 1.244 . . . . 41.26 114.36 179.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.8 mt-10 -115.47 3.95 14.19 Favored 'General case' 0 CA--C 1.551 0.986 0 O-C-N 120.771 -1.206 . . . . 42.0 113.275 178.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 89.3 t -62.13 126.47 87.68 Favored Pre-proline 0 CA--C 1.517 -0.316 0 O-C-N 119.403 -2.061 . . . . 26.87 107.785 178.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -47.04 144.25 8.86 Favored 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 123.976 3.118 . . . . 23.94 113.383 178.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.5 tm-20 -52.79 -38.78 61.62 Favored 'General case' 0 N--CA 1.438 -1.054 0 N-CA-C 113.618 0.969 . . . . 28.03 113.618 179.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 45.4 p-10 -83.73 8.6 14.1 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 114.313 1.227 . . . . 31.28 114.313 -179.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 42.8 mtm -128.6 19.9 6.16 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-N 119.517 1.053 . . . . 26.93 110.477 176.084 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 83.3 mm-40 -57.34 -26.95 61.77 Favored 'General case' 0 C--N 1.344 0.353 0 N-CA-C 112.895 0.702 . . . . 23.39 112.895 179.633 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLU . . . . . 0.618 ' HB3' ' O ' ' A' ' 221' ' ' HOH . 13.8 tp10 -54.15 -38.97 66.08 Favored 'General case' 0 CA--C 1.554 1.097 0 N-CA-C 114.46 1.281 . . . . 46.16 114.46 175.468 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -62.42 -19.45 63.48 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 114.013 1.116 . . . . 21.2 114.013 -177.215 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 93.7 mt -62.86 -53.26 49.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 O-C-N 120.248 -1.532 . . . . 21.39 111.0 179.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' GLN . . . . . 0.441 ' O ' ' HG2' ' A' ' 73' ' ' GLU . 38.1 tt0 -68.16 -40.13 82.44 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 107.792 -1.188 . . . . 34.62 107.792 178.14 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.7 tp -54.74 -47.99 73.13 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 118.486 0.585 . . . . 23.42 112.201 -179.305 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -59.48 -41.76 90.52 Favored 'General case' 0 C--O 1.224 -0.278 0 N-CA-C 112.558 0.577 . . . . 20.48 112.558 177.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -66.59 -45.55 78.87 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-O 117.711 -1.138 . . . . 24.7 111.52 -179.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLU . . . . . 0.441 ' HG2' ' O ' ' A' ' 69' ' ' GLN . 2.2 pt-20 -70.69 -36.38 73.26 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 120.01 1.277 . . . . 32.21 114.075 -179.909 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 79.6 mt -78.97 -26.3 43.42 Favored 'General case' 0 C--O 1.244 0.765 0 N-CA-C 115.795 1.776 . . . . 21.72 115.795 176.114 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.31 -19.74 63.61 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 119.923 -1.735 . . . . 25.77 110.439 174.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -84.52 -23.16 29.9 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 114.876 -1.056 . . . . 38.29 111.63 178.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 31.0 m -110.77 -24.65 3.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 O-C-N 119.926 -1.734 . . . . 29.32 113.042 -176.363 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 24.8 m0 -83.85 157.7 63.16 Favored Pre-proline 0 C--O 1.245 0.819 0 O-C-N 120.697 -1.252 . . . . 28.13 112.797 -176.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -77.01 148.44 27.77 Favored 'Trans proline' 0 N--CA 1.443 -1.491 0 C-N-CA 123.139 2.559 . . . . 24.65 115.093 175.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -63.35 130.58 45.07 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 114.136 -1.393 . . . . 23.49 113.64 176.964 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.4 tt -116.73 124.1 72.43 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 N-CA-C 108.745 -0.835 . . . . 25.1 108.745 174.206 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 65.8 p -121.72 -4.89 9.19 Favored 'General case' 0 C--O 1.245 0.821 0 N-CA-C 114.928 1.455 . . . . 29.3 114.928 -175.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -125.3 153.39 43.34 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 113.684 0.994 . . . . 45.32 113.684 -178.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 6.6 tmtm? -68.77 143.39 54.66 Favored 'General case' 0 N--CA 1.438 -1.063 0 N-CA-C 106.824 -1.547 . . . . 32.62 106.824 179.913 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 10.8 ttmm -131.81 164.58 25.72 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 113.03 -1.895 . . . . 35.81 107.596 177.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -70.26 141.5 88.75 Favored Pre-proline 0 CA--C 1.484 -1.566 0 O-C-N 120.438 -1.414 . . . . 34.87 108.741 175.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -55.02 168.69 1.13 Allowed 'Trans proline' 0 C--N 1.318 -1.028 0 C-N-CA 123.426 2.751 . . . . 30.77 111.655 176.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.8 mt -66.42 144.12 98.54 Favored Pre-proline 0 N--CA 1.444 -0.731 0 O-C-N 120.439 -1.413 . . . . 31.01 108.11 175.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -41.38 -40.15 4.56 Favored 'Trans proline' 0 N--CA 1.461 -0.423 0 C-N-CA 124.78 3.654 . . . . 35.77 118.779 -177.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 42.2 m-20 -112.94 32.57 5.61 Favored 'General case' 0 CA--C 1.51 -0.586 0 O-C-N 121.378 -0.826 . . . . 39.67 112.614 -179.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -53.45 -43.07 67.79 Favored 'General case' 0 C--N 1.348 0.523 0 N-CA-C 114.722 1.378 . . . . 35.36 114.722 -176.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.03 -30.01 69.98 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.639 -0.663 . . . . 50.82 112.534 179.777 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -64.13 -35.85 82.12 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-N 118.45 0.568 . . . . 33.06 111.886 175.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -93.3 -3.58 53.29 Favored 'General case' 0 N--CA 1.435 -1.216 0 N-CA-C 114.497 1.295 . . . . 29.5 114.497 -179.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -74.64 111.12 9.51 Favored 'General case' 0 C--O 1.218 -0.588 0 CA-C-N 120.009 1.277 . . . . 29.22 111.946 178.415 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.72 -9.74 37.81 Favored Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 120.126 -1.035 . . . . 25.59 111.971 -178.903 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 47.2 t -74.44 143.73 13.15 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.697 0 N-CA-C 106.171 -1.789 . . . . 24.17 106.171 178.06 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.95 163.62 12.61 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 119.197 0.908 . . . . 34.02 111.337 -175.372 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 57.77 37.6 84.65 Favored Glycine 0 C--N 1.341 0.835 0 CA-C-O 118.103 -1.387 . . . . 23.78 112.461 -178.227 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 48.1 mtmt -75.15 -3.07 30.7 Favored 'General case' 0 N--CA 1.422 -1.837 0 CA-C-N 118.362 1.081 . . . . 17.78 111.332 -177.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 33.1 tp -63.3 -22.58 66.97 Favored 'General case' 0 C--O 1.217 -0.629 0 O-C-N 120.526 -1.359 . . . . 22.24 110.156 178.356 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 22.9 pt20 -69.8 -14.91 63.0 Favored 'General case' 0 C--O 1.224 -0.256 0 O-C-N 120.495 -1.378 . . . . 26.59 110.463 177.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 55.7 m80 -103.63 5.12 36.26 Favored 'General case' 0 C--N 1.355 0.844 0 N-CA-C 114.547 1.314 . . . . 29.16 114.547 177.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 52.3 tp -61.76 131.99 51.7 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 119.147 0.885 . . . . 24.73 112.399 179.008 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 88.4 mt-10 -112.43 128.68 56.38 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 123.808 0.692 . . . . 35.08 111.841 179.325 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ARG . . . . . 0.408 ' HD2' ' OXT' ' A' ' 106' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.344 0.347 0 C-N-CA 125.551 1.541 . . . . 41.43 111.305 178.937 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 107' ' ' SF4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' F3S . . . . . 0.573 ' S1 ' ' HG ' ' A' ' 32' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.618 ' O ' ' HB3' ' A' ' 66' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 build full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.652 ' HB3' ' OD1' ' A' ' 41' ' ' ASP . . . . . . . . 0 N--CA 1.43 -1.452 0 N-CA-C 109.957 -0.386 . . . . 29.34 109.957 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -99.71 140.49 33.84 Favored 'General case' 0 CA--C 1.508 -0.654 0 N-CA-C 105.312 -2.106 . . . . 25.25 105.312 170.035 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 22.0 t -120.61 131.64 72.25 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.314 0 C-N-CA 125.306 1.443 . . . . 24.29 113.424 -174.414 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.468 HG23 HG13 ' A' ' 34' ' ' ILE . 40.2 t -80.24 123.22 36.74 Favored 'Isoleucine or valine' 0 C--O 1.242 0.699 0 C-N-CA 123.624 0.769 . . . . 21.79 109.088 171.813 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 80.6 p -105.24 -166.78 1.26 Allowed 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 114.986 1.476 . . . . 20.28 114.986 178.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ASP . . . . . . . . . . . . . 3.9 t70 -47.39 -45.94 25.61 Favored 'General case' 0 CA--C 1.504 -0.813 0 N-CA-C 121.307 3.817 . . . . 22.98 121.307 -174.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ASN . . . . . . . . . . . . . 55.1 t30 -67.38 -3.22 7.64 Favored 'General case' 0 C--O 1.217 -0.615 0 CA-C-N 120.882 1.674 . . . . 23.02 114.146 -175.391 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' CYS . . . . . . . . . . . . . 40.6 t -76.85 -33.39 57.89 Favored 'General case' 0 C--O 1.206 -1.188 0 CA-C-N 121.051 1.751 . . . . 20.36 112.579 175.402 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 67.7 mt -60.45 130.38 24.2 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.565 0 O-C-N 121.864 -0.522 . . . . 19.98 112.091 -179.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 63.9 mmtt 73.86 2.49 4.22 Favored 'General case' 0 CA--C 1.512 -0.505 0 C-N-CA 125.429 1.491 . . . . 22.81 111.906 -178.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 84.5 m -114.63 -66.23 1.11 Allowed 'General case' 0 N--CA 1.438 -1.043 0 N-CA-C 107.275 -1.38 . . . . 19.74 107.275 174.268 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 70.2 tttt 48.38 52.73 13.08 Favored 'General case' 0 CA--C 1.541 0.619 0 O-C-N 119.048 -2.282 . . . . 22.2 115.678 175.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 79.0 m-85 -58.3 -34.8 70.96 Favored 'General case' 0 N--CA 1.445 -0.712 0 N-CA-C 114.809 1.411 . . . . 24.09 114.809 -178.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 45.0 p 65.39 21.15 11.89 Favored 'General case' 0 N--CA 1.466 0.327 0 C-N-CA 127.544 2.338 . . . . 23.69 114.722 179.332 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 42.7 m-20 -71.99 -25.48 61.86 Favored 'General case' 0 C--N 1.353 0.729 0 O-C-N 120.787 -1.195 . . . . 30.97 109.539 175.534 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 26.4 p -55.66 -34.96 65.45 Favored 'General case' 0 C--O 1.246 0.912 0 N-CA-C 116.04 1.867 . . . . 23.72 116.04 178.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 18.1 m -73.42 -26.09 21.9 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 N-CA-C 116.095 1.887 . . . . 24.62 116.095 -175.223 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -70.4 -14.31 62.5 Favored 'General case' 0 N--CA 1.448 -0.545 0 N-CA-C 116.743 2.127 . . . . 38.05 116.743 -177.71 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.538 HG12 ' HB3' ' A' ' 44' ' ' LEU . 44.4 t -106.92 0.3 9.99 Favored 'Isoleucine or valine' 0 N--CA 1.432 -1.355 0 O-C-N 124.074 0.859 . . . . 28.64 110.069 -177.881 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 20.6 t -82.09 110.74 22.29 Favored Pre-proline 0 N--CA 1.438 -1.035 0 O-C-N 119.308 -2.12 . . . . 24.52 111.863 -174.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' PRO . . . . . 0.539 ' HG3' ' OD1' ' A' ' 42' ' ' ASP . 69.9 Cg_endo -53.52 -34.2 71.37 Favored 'Trans proline' 0 N--CA 1.447 -1.252 0 C-N-CA 123.801 3.001 . . . . 25.17 116.136 176.203 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 16.2 m -110.17 1.45 9.26 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.763 0 N-CA-C 116.994 2.22 . . . . 24.76 116.994 -176.01 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ASP . . . . . . . . . . . . . 66.7 m-20 53.24 57.83 5.86 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 112.879 0.696 . . . . 28.56 112.879 -178.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 20.2 p -104.66 26.17 9.42 Favored 'General case' 0 C--N 1.358 0.977 0 N-CA-C 116.122 1.897 . . . . 21.92 116.122 177.366 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -98.46 135.38 40.11 Favored 'General case' 0 CA--C 1.507 -0.702 0 O-C-N 123.17 0.294 . . . . 19.22 110.973 177.494 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 86.9 m-85 -124.46 134.82 52.94 Favored 'General case' 0 C--O 1.245 0.821 0 CA-C-O 118.816 -0.612 . . . . 22.64 111.045 -179.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.434 ' HB2' HD22 ' A' ' 32' ' ' LEU . 0.3 OUTLIER -106.95 141.49 38.08 Favored 'General case' 0 N--CA 1.435 -1.181 0 N-CA-C 117.79 2.515 . . . . 26.48 117.79 -170.061 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -111.32 176.7 18.61 Favored Glycine 0 N--CA 1.436 -1.361 0 N-CA-C 108.663 -1.775 . . . . 23.02 108.663 173.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -49.05 -47.52 21.43 Favored 'Trans proline' 0 C--O 1.247 0.956 0 C-N-CA 122.751 2.3 . . . . 24.33 114.112 177.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 49.6 p30 -134.06 30.22 3.66 Favored 'General case' 0 CA--C 1.502 -0.879 0 N-CA-C 112.679 0.622 . . . . 22.35 112.679 -178.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' PHE . . . . . . . . . . . . . 16.6 t80 -161.74 152.83 18.19 Favored 'General case' 0 N--CA 1.444 -0.74 0 O-C-N 120.63 -1.294 . . . . 18.95 110.314 -175.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.573 ' HG ' ' S1 ' ' A' ' 108' ' ' F3S . 0.4 OUTLIER -120.56 155.35 33.86 Favored 'General case' 0 N--CA 1.443 -0.812 0 O-C-N 121.519 -0.738 . . . . 18.43 109.525 173.055 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' VAL . . . . . . . . . . . . . 15.4 m -134.12 167.4 26.27 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 O-C-N 121.644 -0.66 . . . . 19.31 112.443 174.441 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ILE . . . . . 0.468 HG13 HG23 ' A' ' 4' ' ' VAL . 88.4 mt -116.65 132.75 65.39 Favored 'Isoleucine or valine' 0 C--O 1.242 0.672 0 N-CA-C 106.468 -1.678 . . . . 18.42 106.468 -179.715 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' HIS . . . . . 0.544 ' CE1' ' HB2' ' A' ' 37' ' ' ASP . 19.6 t-80 -75.99 109.4 8.1 Favored Pre-proline 0 N--CA 1.427 -1.617 0 N-CA-C 109.022 -0.733 . . . . 20.77 109.022 176.26 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_endo -58.12 -31.24 92.74 Favored 'Trans proline' 0 N--CA 1.453 -0.868 0 C-N-CA 124.726 3.617 . . . . 22.91 113.798 -172.344 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ASP . . . . . 0.544 ' HB2' ' CE1' ' A' ' 35' ' ' HIS . 79.9 m-20 -78.59 -28.15 45.76 Favored 'General case' 0 N--CA 1.44 -0.928 0 N-CA-C 115.862 1.801 . . . . 30.03 115.862 -179.895 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -89.76 -31.93 17.2 Favored 'General case' 0 C--N 1.315 -0.914 0 O-C-N 121.803 -0.56 . . . . 23.91 111.498 -178.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' CYS . . . . . . . . . . . . . 43.0 t -54.68 131.07 42.65 Favored 'General case' 0 C--N 1.35 0.622 0 N-CA-C 114.251 1.204 . . . . 21.77 114.251 177.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ILE . . . . . . . . . . . . . 44.9 pt -103.57 12.38 7.69 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.401 0 N-CA-C 114.135 1.161 . . . . 21.32 114.135 -177.368 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.652 ' OD1' ' HB3' ' A' ' 1' ' ' ALA . 19.2 m-20 54.22 41.38 32.03 Favored 'General case' 0 CA--C 1.508 -0.662 0 N-CA-C 115.762 1.764 . . . . 27.02 115.762 178.134 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.539 ' OD1' ' HG3' ' A' ' 21' ' ' PRO . 4.0 p30 -84.19 -3.77 58.37 Favored 'General case' 0 C--O 1.17 -3.109 1 C-N-CA 110.878 -4.329 . . . . 28.98 113.911 177.698 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . 73.45 7.25 5.14 Favored 'General case' 0 N--CA 1.431 -1.383 0 C-N-CA 128.605 2.762 . . . . 22.32 115.267 171.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.538 ' HB3' HG12 ' A' ' 19' ' ' VAL . 0.8 OUTLIER -67.87 -25.78 65.69 Favored 'General case' 0 N--CA 1.442 -0.863 0 CA-C-N 112.803 -1.999 . . . . 29.84 115.19 -173.99 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 28.3 p -81.15 -25.95 36.45 Favored 'General case' 0 N--CA 1.449 -0.477 0 CA-C-O 117.836 -1.078 . . . . 26.49 112.767 179.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' GLU . . . . . 0.721 ' HG3' ' HD3' ' A' ' 47' ' ' PRO . 0.0 OUTLIER -61.55 -41.2 77.3 Favored Pre-proline 0 C--O 1.239 0.552 0 CA-C-N 121.577 1.989 . . . . 39.51 114.581 -175.219 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.721 ' HD3' ' HG3' ' A' ' 46' ' ' GLU . 60.9 Cg_endo -77.33 -8.24 17.29 Favored 'Trans proline' 0 N--CA 1.442 -1.541 0 CA-C-N 124.618 2.685 . . . . 24.64 113.753 177.748 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.45 ' HG3' HG21 ' A' ' 19' ' ' VAL . 71.6 mm-40 -87.81 -17.88 30.55 Favored 'General case' 0 N--CA 1.442 -0.848 0 N-CA-C 113.713 1.005 . . . . 24.36 113.713 -178.322 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 39.3 t -80.5 118.21 71.37 Favored Pre-proline 0 N--CA 1.448 -0.551 0 O-C-N 124.079 0.862 . . . . 23.82 112.702 -177.371 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_exo -65.6 -25.62 54.64 Favored 'Trans proline' 0 C--O 1.238 0.519 0 C-N-CA 125.272 3.981 . . . . 22.12 112.721 179.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -84.58 -10.22 57.59 Favored 'General case' 0 N--CA 1.444 -0.769 0 CA-C-N 114.635 -1.166 . . . . 21.43 110.903 178.638 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 83.9 mt-30 53.22 37.3 24.8 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 121.678 -0.639 . . . . 28.03 110.361 -176.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -92.26 -5.33 52.58 Favored 'General case' 0 CA--C 1.505 -0.788 0 N-CA-C 114.812 1.412 . . . . 19.89 114.812 -176.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ILE . . . . . . . . . . . . . 57.0 mt -96.42 131.62 42.74 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.51 0 N-CA-C 113.4 0.889 . . . . 18.55 113.4 178.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 67.7 m-85 -134.57 150.64 50.75 Favored 'General case' 0 C--O 1.214 -0.767 0 CA-C-N 114.878 -1.055 . . . . 20.56 111.561 179.595 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 34.0 t -61.86 141.67 57.82 Favored 'General case' 0 N--CA 1.449 -0.482 0 N-CA-C 104.886 -2.265 . . . . 27.43 104.886 171.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 44.0 tt0 -47.96 -49.28 31.01 Favored 'General case' 0 N--CA 1.439 -0.994 0 CA-C-N 122.035 2.198 . . . . 29.14 114.97 -179.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 30.7 p30 -71.36 0.16 8.77 Favored 'General case' 0 C--N 1.348 0.527 0 N-CA-C 114.36 1.244 . . . . 41.26 114.36 179.664 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 10.8 mt-10 -115.47 3.95 14.19 Favored 'General case' 0 CA--C 1.551 0.986 0 O-C-N 120.771 -1.206 . . . . 42.0 113.275 178.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 89.3 t -62.13 126.47 87.68 Favored Pre-proline 0 CA--C 1.517 -0.316 0 O-C-N 119.403 -2.061 . . . . 26.87 107.785 178.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 21.6 Cg_exo -47.04 144.25 8.86 Favored 'Trans proline' 0 N--CA 1.456 -0.716 0 C-N-CA 123.976 3.118 . . . . 23.94 113.383 178.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.5 tm-20 -52.79 -38.78 61.62 Favored 'General case' 0 N--CA 1.438 -1.054 0 N-CA-C 113.618 0.969 . . . . 28.03 113.618 179.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 45.4 p-10 -83.73 8.6 14.1 Favored 'General case' 0 CA--C 1.505 -0.784 0 N-CA-C 114.313 1.227 . . . . 31.28 114.313 -179.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' MET . . . . . . . . . . . . . 42.8 mtm -128.6 19.9 6.16 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-N 119.517 1.053 . . . . 26.93 110.477 176.084 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLN . . . . . . . . . . . . . 83.3 mm-40 -57.34 -26.95 61.77 Favored 'General case' 0 C--N 1.344 0.353 0 N-CA-C 112.895 0.702 . . . . 23.39 112.895 179.633 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLU . . . . . 0.618 ' HB3' ' O ' ' A' ' 221' ' ' HOH . 13.8 tp10 -54.15 -38.97 66.08 Favored 'General case' 0 CA--C 1.554 1.097 0 N-CA-C 114.46 1.281 . . . . 46.16 114.46 175.468 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -62.42 -19.45 63.48 Favored 'General case' 0 N--CA 1.446 -0.655 0 N-CA-C 114.013 1.116 . . . . 21.2 114.013 -177.215 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ILE . . . . . . . . . . . . . 93.7 mt -62.86 -53.26 49.05 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 O-C-N 120.248 -1.532 . . . . 21.39 111.0 179.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' GLN . . . . . 0.441 ' O ' ' HG2' ' A' ' 73' ' ' GLU . 38.1 tt0 -68.16 -40.13 82.44 Favored 'General case' 0 N--CA 1.441 -0.887 0 N-CA-C 107.792 -1.188 . . . . 34.62 107.792 178.14 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 10.7 tp -54.74 -47.99 73.13 Favored 'General case' 0 C--O 1.236 0.394 0 CA-C-N 118.486 0.585 . . . . 23.42 112.201 -179.305 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 -59.48 -41.76 90.52 Favored 'General case' 0 C--O 1.224 -0.278 0 N-CA-C 112.558 0.577 . . . . 20.48 112.558 177.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ALA . . . . . . . . . . . . . . . -66.59 -45.55 78.87 Favored 'General case' 0 N--CA 1.441 -0.908 0 CA-C-O 117.711 -1.138 . . . . 24.7 111.52 -179.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.441 ' HG2' ' O ' ' A' ' 69' ' ' GLN . 2.2 pt-20 -70.69 -36.38 73.26 Favored 'General case' 0 CA--C 1.51 -0.587 0 CA-C-N 120.01 1.277 . . . . 32.21 114.075 -179.909 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 79.6 mt -78.97 -26.3 43.42 Favored 'General case' 0 C--O 1.244 0.765 0 N-CA-C 115.795 1.776 . . . . 21.72 115.795 176.114 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -62.31 -19.74 63.61 Favored 'General case' 0 N--CA 1.472 0.634 0 O-C-N 119.923 -1.735 . . . . 25.77 110.439 174.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -84.52 -23.16 29.9 Favored 'General case' 0 N--CA 1.44 -0.96 0 CA-C-N 114.876 -1.056 . . . . 38.29 111.63 178.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 31.0 m -110.77 -24.65 3.88 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.517 0 O-C-N 119.926 -1.734 . . . . 29.32 113.042 -176.363 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' TRP . . . . . . . . . . . . . 24.8 m0 -83.85 157.7 63.16 Favored Pre-proline 0 C--O 1.245 0.819 0 O-C-N 120.697 -1.252 . . . . 28.13 112.797 -176.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_endo -77.01 148.44 27.77 Favored 'Trans proline' 0 N--CA 1.443 -1.491 0 C-N-CA 123.139 2.559 . . . . 24.65 115.093 175.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -63.35 130.58 45.07 Favored 'General case' 0 N--CA 1.438 -1.071 0 CA-C-N 114.136 -1.393 . . . . 23.49 113.64 176.964 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 5.4 tt -116.73 124.1 72.43 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 N-CA-C 108.745 -0.835 . . . . 25.1 108.745 174.206 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' THR . . . . . . . . . . . . . 65.8 p -121.72 -4.89 9.19 Favored 'General case' 0 C--O 1.245 0.821 0 N-CA-C 114.928 1.455 . . . . 29.3 114.928 -175.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 20.9 mt-10 -125.3 153.39 43.34 Favored 'General case' 0 N--CA 1.441 -0.902 0 N-CA-C 113.684 0.994 . . . . 45.32 113.684 -178.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 6.6 tmtm? -68.77 143.39 54.66 Favored 'General case' 0 N--CA 1.438 -1.063 0 N-CA-C 106.824 -1.547 . . . . 32.62 106.824 179.913 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 10.8 ttmm -131.81 164.58 25.72 Favored 'General case' 0 N--CA 1.446 -0.647 0 CA-C-N 113.03 -1.895 . . . . 35.81 107.596 177.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 96.7 m-20 -70.26 141.5 88.75 Favored Pre-proline 0 CA--C 1.484 -1.566 0 O-C-N 120.438 -1.414 . . . . 34.87 108.741 175.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_exo -55.02 168.69 1.13 Allowed 'Trans proline' 0 C--N 1.318 -1.028 0 C-N-CA 123.426 2.751 . . . . 30.77 111.655 176.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' LEU . . . . . . . . . . . . . 87.8 mt -66.42 144.12 98.54 Favored Pre-proline 0 N--CA 1.444 -0.731 0 O-C-N 120.439 -1.413 . . . . 31.01 108.11 175.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' PRO . . . . . . . . . . . . . 32.6 Cg_endo -41.38 -40.15 4.56 Favored 'Trans proline' 0 N--CA 1.461 -0.423 0 C-N-CA 124.78 3.654 . . . . 35.77 118.779 -177.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ASP . . . . . . . . . . . . . 42.2 m-20 -112.94 32.57 5.61 Favored 'General case' 0 CA--C 1.51 -0.586 0 O-C-N 121.378 -0.826 . . . . 39.67 112.614 -179.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -53.45 -43.07 67.79 Favored 'General case' 0 C--N 1.348 0.523 0 N-CA-C 114.722 1.378 . . . . 35.36 114.722 -176.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -67.03 -30.01 69.98 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.639 -0.663 . . . . 50.82 112.534 179.777 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ASP . . . . . . . . . . . . . 94.1 m-20 -64.13 -35.85 82.12 Favored 'General case' 0 C--O 1.239 0.519 0 CA-C-N 118.45 0.568 . . . . 33.06 111.886 175.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -93.3 -3.58 53.29 Favored 'General case' 0 N--CA 1.435 -1.216 0 N-CA-C 114.497 1.295 . . . . 29.5 114.497 -179.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -74.64 111.12 9.51 Favored 'General case' 0 C--O 1.218 -0.588 0 CA-C-N 120.009 1.277 . . . . 29.22 111.946 178.415 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' GLY . . . . . . . . . . . . . . . 107.72 -9.74 37.81 Favored Glycine 0 N--CA 1.447 -0.626 0 C-N-CA 120.126 -1.035 . . . . 25.59 111.971 -178.903 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 47.2 t -74.44 143.73 13.15 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.697 0 N-CA-C 106.171 -1.789 . . . . 24.17 106.171 178.06 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.95 163.62 12.61 Favored 'General case' 0 N--CA 1.443 -0.82 0 CA-C-N 119.197 0.908 . . . . 34.02 111.337 -175.372 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 57.77 37.6 84.65 Favored Glycine 0 C--N 1.341 0.835 0 CA-C-O 118.103 -1.387 . . . . 23.78 112.461 -178.227 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 48.1 mtmt -75.15 -3.07 30.7 Favored 'General case' 0 N--CA 1.422 -1.837 0 CA-C-N 118.362 1.081 . . . . 17.78 111.332 -177.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' LEU . . . . . . . . . . . . . 33.1 tp -63.3 -22.58 66.97 Favored 'General case' 0 C--O 1.217 -0.629 0 O-C-N 120.526 -1.359 . . . . 22.24 110.156 178.356 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 22.9 pt20 -69.8 -14.91 63.0 Favored 'General case' 0 C--O 1.224 -0.256 0 O-C-N 120.495 -1.378 . . . . 26.59 110.463 177.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HIS . . . . . . . . . . . . . 55.7 m80 -103.63 5.12 36.26 Favored 'General case' 0 C--N 1.355 0.844 0 N-CA-C 114.547 1.314 . . . . 29.16 114.547 177.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 52.3 tp -61.76 131.99 51.7 Favored 'General case' 0 N--CA 1.456 -0.173 0 CA-C-N 119.147 0.885 . . . . 24.73 112.399 179.008 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 88.4 mt-10 -112.43 128.68 56.38 Favored 'General case' 0 N--CA 1.45 -0.431 0 O-C-N 123.808 0.692 . . . . 35.08 111.841 179.325 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.408 ' HD2' ' OXT' ' A' ' 106' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--N 1.344 0.347 0 C-N-CA 125.551 1.541 . . . . 41.43 111.305 178.937 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' SF4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' F3S . . . . . 0.573 ' S1 ' ' HG ' ' A' ' 32' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.618 ' O ' ' HB3' ' A' ' 66' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . 001 ecloud nobuild full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_