data_2pb8_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 2pb8 _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' ' ' SER . . . . . . . . . . . . . 84.0 p . . . . . 0 N--CA 1.487 1.414 0 N-CA-C 115.018 1.488 . . . . 26.48 115.018 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' LEU . . . . . 0.853 ' CD1' ' O ' ' A' 1300 ' ' HOH . 0.0 OUTLIER -57.22 -22.93 44.44 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 123.887 0.742 . . . . 39.530000000000001 110.988 178.056 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 14.9 mt -68.05 -51.04 51.33 Favored 'General case' 0 C--O 1.214 -0.765 0 CA-C-N 115.647 -0.706 . . . . 40.119999999999997 110.308 178.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 -66.03 -37.93 87.13 Favored 'General case' 0 C--O 1.223 -0.336 0 O-C-N 123.494 0.496 . . . . 37.729999999999997 109.741 177.124 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -68.01 -46.05 72.3 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 118.064 0.393 . . . . 27.43 110.079 -173.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -54.84 -42.42 79.19 Favored Glycine 0 CA--C 1.53 0.973 0 N-CA-C 114.987 0.755 . . . . 27.649999999999999 114.987 174.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 49.2 tttm -69.98 -41.9 73.83 Favored 'General case' 0 N--CA 1.425 -1.711 0 O-C-N 121.983 -0.716 . . . . 44.609999999999999 110.977 -179.226 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.0 mtt -54.73 -54.04 47.08 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 112.488 0.551 . . . . 27.969999999999999 112.488 172.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 75.9 mt -54.1 -50.4 54.9 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.715 0 CA-C-N 115.544 -0.753 . . . . 25.68 111.169 178.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 56.1 tp -56.81 -48.49 77.86 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 109.866 -0.42 . . . . 30.219999999999999 109.866 177.688 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -59.69 -40.09 86.71 Favored 'General case' 0 CA--C 1.508 -0.641 0 CA-C-O 122.441 1.115 . . . . 30.52 112.186 -178.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -75.5 -46.29 33.2 Favored 'General case' 0 N--CA 1.439 -0.984 0 CA-C-N 114.139 -1.391 . . . . 36.460000000000001 111.784 -172.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 43.9 p -109.99 -13.62 14.38 Favored 'General case' 0 C--O 1.212 -0.869 0 N-CA-C 116.952 2.205 . . . . 27.219999999999999 116.952 -169.827 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 69.89 7.37 58.96 Favored Glycine 0 N--CA 1.404 -3.448 0 O-C-N 126.526 2.392 . . . . 33.68 113.074 -172.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 39.7 mttm -101.99 149.81 23.85 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-N 122.45 3.125 . . . . 37.590000000000003 107.658 175.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.8 mt -78.68 134.34 37.12 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 108.465 -0.939 . . . . 38.920000000000002 108.465 174.786 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -51.95 -51.18 58.86 Favored 'General case' 0 CA--C 1.508 -0.658 0 CA-C-N 115.698 -0.683 . . . . 32.479999999999997 111.798 -178.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ILE . . . . . . . . . . . . . 67.7 mt -104.14 124.85 36.08 Favored Pre-proline 0 N--CA 1.453 -0.3 1 N-CA-C 98.396 -4.668 . . . . 40.789999999999999 98.396 171.957 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -101.04 7.29 20.29 Favored 'Cis proline' 0 C--N 1.325 -0.707 0 N-CA-C 117.887 2.226 . . . . 36.140000000000001 117.887 7.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 67.7 m -74.91 -33.85 62.06 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 115.836 1.791 . . . . 32.850000000000001 115.836 -174.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -123.75 5.5 8.81 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 113.854 1.057 . . . . 30.93 113.854 -174.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 57.8 p -89.59 -17.84 27.72 Favored 'General case' 0 C--O 1.208 -1.115 0 N-CA-C 113.299 0.852 . . . . 30.940000000000001 113.299 -179.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 89.6 p -136.83 36.9 2.62 Favored 'General case' 0 C--O 1.247 0.937 0 C-N-CA 119.181 -1.008 . . . . 33.770000000000003 111.997 178.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -98.6 131.59 44.68 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.848 -0.615 . . . . 26.489999999999998 112.081 -173.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 49.51 -148.29 5.88 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 125.355 1.455 . . . . 24.91 112.778 -179.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 4.4 m -89.74 -14.6 34.28 Favored 'General case' 0 N--CA 1.421 -1.884 0 CA-C-O 117.159 -1.401 . . . . 28.199999999999999 113.964 -179.97 -41.154 -73.307 -95.975 85.798 2.042 119.99 -61.241 -94.82 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' TYR . . . . . 0.454 ' N ' ' OD1' ' A' ' 42' ' ' ASP . 49.4 m-85 -120.8 -26.42 5.24 Favored 'General case' 0 CA--C 1.566 1.558 0 C-N-CA 112.74 -3.584 . . . . 25.98 115.312 -175.41 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 69.9 m -64.64 110.48 2.37 Favored 'General case' 0 C--N 1.352 0.713 0 N-CA-C 107.769 -1.197 . . . . 32.68 107.769 177.636 -58.421 -43.59 83.204 108.768 1.923 113.084 156.469 -66.934 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLY . . . . . 0.405 ' O ' ' C ' ' A' ' 31' ' ' TRP . . . 110.45 -168.36 12.98 Favored Glycine 0 N--CA 1.419 -2.454 0 CA-C-O 124.535 2.186 . . . . 43.590000000000003 113.316 179.231 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' TRP . . . . . 0.405 ' C ' ' O ' ' A' ' 30' ' ' GLY . 7.1 t90 -27.73 -51.6 0.07 Allowed 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 109.125 -3.537 . . . . 59.68 111.495 176.604 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -45.19 165.54 0.05 OUTLIER Glycine 0 CA--C 1.529 0.942 0 N-CA-C 122.749 3.86 . . . . 49.729999999999997 122.749 -173.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -178.15 53.03 0.1 OUTLIER Glycine 0 N--CA 1.444 -0.808 0 CA-C-N 114.702 -0.749 . . . . 48.939999999999998 112.398 177.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 4.7 mmtt -146.08 149.32 33.84 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 117.758 0.779 . . . . 55.119999999999997 111.37 178.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 80.37 -166.66 49.81 Favored Glycine 0 C--O 1.217 -0.917 0 N-CA-C 120.025 2.77 . . . . 40.439999999999998 120.025 172.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 76.1 m -88.35 127.55 56.54 Favored Pre-proline 0 C--O 1.217 -0.62 0 C-N-CA 123.297 0.639 . . . . 39.039999999999999 110.886 178.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_exo -59.87 139.89 90.39 Favored 'Trans proline' 0 CA--C 1.514 -0.515 0 N-CA-C 108.758 -1.286 . . . . 31.050000000000001 108.758 179.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 9.5 mmpt? -75.3 -32.16 60.9 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 118.234 2.679 . . . . 38.670000000000002 118.234 -174.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 35.5 p-10 -159.92 177.66 10.55 Favored 'General case' 0 N--CA 1.448 -0.544 0 O-C-N 123.748 0.655 . . . . 27.32 109.925 -178.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -49.26 -47.22 46.76 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 113.53 0.937 . . . . 22.960000000000001 113.53 -177.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 5.6 m -56.84 -47.18 80.93 Favored 'General case' 0 C--O 1.254 1.323 0 CA-C-O 122.644 1.211 . . . . 24.59 112.873 178.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ASP . . . . . 0.454 ' OD1' ' N ' ' A' ' 28' ' ' TYR . 23.5 t0 -60.59 -35.88 77.18 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-N 114.605 -1.179 . . . . 22.129999999999999 109.661 176.934 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 91.9 mtm-85 -63.81 -41.39 97.9 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 119.611 -0.836 . . . . 38.539999999999999 112.725 175.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 64.0 m -51.68 -46.62 63.9 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 118.892 -1.123 . . . . 23.199999999999999 110.675 172.68 -57.284 -64.304 -76.279 106.056 2.026 103.299 -85.175 -170.244 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 88.5 m -63.87 -41.11 97.83 Favored 'General case' 0 C--O 1.222 -0.39 0 O-C-N 122.041 -0.412 . . . . 20.77 112.111 -179.663 -66.934 156.469 83.204 113.084 1.923 108.768 -43.59 -58.421 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -57.49 -50.72 72.12 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 123.548 0.53 . . . . 29.16 111.354 176.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 69.7 t -64.05 -36.57 77.3 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.826 0 CA-C-O 122.178 0.989 . . . . 19.350000000000001 110.306 179.846 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 49.8 t-80 -63.43 -44.46 94.51 Favored 'General case' 0 C--O 1.255 1.349 0 O-C-N 121.355 -0.84 . . . . 19.760000000000002 111.225 176.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 51.1 m-20 -59.94 -40.66 89.74 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 120.615 -0.434 . . . . 29.969999999999999 111.595 174.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 91.2 m -64.91 -39.26 93.24 Favored 'General case' 0 C--O 1.253 1.27 0 CA-C-O 121.401 0.619 . . . . 22.41 110.054 179.062 -68.352 -70.585 -74.359 102.626 2.009 103.467 -70.674 -64.752 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 7.5 t -58.38 -50.75 72.56 Favored 'General case' 0 CA--C 1.562 1.421 0 CA-C-N 114.558 -1.201 . . . . 21.309999999999999 111.634 178.802 -161.212 -86.958 -81.653 104.957 2.013 104.601 -56.286 -72.488 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 6.9 m-30 -58.41 -42.8 88.01 Favored 'General case' 0 C--O 1.214 -0.802 0 C-N-CA 124.757 1.223 . . . . 23.300000000000001 109.257 173.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -56.41 -23.91 43.83 Favored Glycine 0 C--O 1.206 -1.622 0 CA-C-O 118.771 -1.016 . . . . 25.800000000000001 114.636 176.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 91.7 m-20 -76.6 -9.11 58.42 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 118.26 1.03 . . . . 36.049999999999997 111.892 177.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 7.3 mt -115.98 95.32 44.08 Favored Pre-proline 0 N--CA 1.421 -1.898 0 C-N-CA 123.032 0.533 . . . . 27.48 110.24 179.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_exo -66.13 -60.82 0.1 Allowed 'Trans proline' 0 CA--C 1.496 -1.413 0 N-CA-C 115.665 1.371 . . . . 29.23 115.665 176.177 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -89.2 25.03 1.98 Allowed 'General case' 0 N--CA 1.427 -1.584 0 CA-C-N 113.013 -1.903 . . . . 41.310000000000002 113.18 -174.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 77.0 m -107.66 172.66 6.71 Favored 'General case' 0 CA--C 1.481 -1.69 0 C-N-CA 114.785 -2.766 . . . . 20.52 107.4 168.99 -60.972 -58.128 -77.81 107.427 2.013 105.528 -66.102 -86.597 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ASN . . . . . 0.445 ' N ' ' CD ' ' A' ' 68' ' ' PRO . 15.8 m120 -136.01 84.48 31.05 Favored Pre-proline 1 C--N 1.454 5.124 3 O-C-N 109.853 -8.029 . . . . 25.59 106.062 -176.327 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' PRO . . . . . 0.445 ' CD ' ' N ' ' A' ' 67' ' ' ASN . 9.1 Cg_exo -61.35 -15.52 41.1 Favored 'Trans proline' 0 N--CA 1.495 1.594 0 C-N-CA 124.468 3.445 . . . . 27.879999999999999 119.711 -179.005 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 46.6 mttt -99.67 -16.22 18.26 Favored 'General case' 0 CA--C 1.441 -3.25 0 C-N-CA 118.234 -1.386 . . . . 52.710000000000001 109.254 -171.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 28.2 p -128.0 -23.36 3.35 Favored 'General case' 0 CA--C 1.483 -1.618 0 CA-C-O 123.552 1.644 . . . . 30.48 111.678 -173.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -72.91 126.51 30.11 Favored 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 117.485 -1.686 . . . . 24.41 111.492 -179.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ARG . . . . . . . . . . . . . 20.0 mtp180 -98.83 127.73 44.83 Favored 'General case' 0 C--N 1.372 1.586 0 N-CA-C 114.402 1.26 . . . . 40.770000000000003 114.402 -174.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 31.7 p90 -120.21 170.49 9.27 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 115.059 -0.973 . . . . 22.41 110.902 177.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 34.0 mmtt -117.97 144.26 45.67 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 107.674 -1.232 . . . . 45.619999999999997 107.674 179.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 24.9 p90 -146.38 157.08 43.74 Favored 'General case' 0 C--O 1.217 -0.633 0 N-CA-C 107.944 -1.132 . . . . 27.809999999999999 107.944 175.355 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 45.6 pttt -132.65 164.85 25.8 Favored 'General case' 0 C--O 1.209 -1.054 0 N-CA-C 108.013 -1.106 . . . . 44.710000000000001 108.013 179.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -107.97 130.87 55.02 Favored 'General case' 0 CA--C 1.507 -0.681 0 N-CA-C 105.463 -2.051 . . . . 37.939999999999998 105.463 179.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 58.8 t -120.58 93.89 2.74 Favored 'Isoleucine or valine' 0 C--O 1.243 0.76 0 N-CA-C 104.12 -2.548 . . . . 42.380000000000003 104.12 176.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 47.47 67.51 0.8 Allowed 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 114.3 -1.318 . . . . 54.380000000000003 111.747 -170.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 78.01 -40.39 1.89 Allowed Glycine 0 CA--C 1.542 1.751 0 C-N-CA 117.026 -2.511 . . . . 41.899999999999999 116.743 -174.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -61.81 138.09 58.31 Favored 'General case' 0 CA--C 1.558 1.277 0 CA-C-N 119.324 1.562 . . . . 35.530000000000001 113.652 -179.71 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 97.2 mt -87.21 125.32 41.01 Favored 'Isoleucine or valine' 0 C--O 1.243 0.74 0 N-CA-C 106.804 -1.554 . . . . 30.23 106.804 177.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 60.4 t -125.97 116.52 46.19 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 N-CA-C 108.031 -1.1 . . . . 28.0 108.031 179.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 63.4 m -76.96 125.13 28.8 Favored 'General case' 0 C--O 1.219 -0.539 0 N-CA-C 107.83 -1.174 . . . . 26.789999999999999 107.83 -176.716 -73.386 -72.754 -88.431 104.515 2.033 103.099 -91.018 -179.009 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -85.75 157.21 20.33 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 119.439 -0.904 . . . . 44.939999999999998 110.775 -178.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 15.6 ttpp -75.86 111.57 11.36 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 114.902 1.445 . . . . 49.729999999999997 114.902 -171.234 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -122.84 -139.43 5.51 Favored Glycine 1 C--N 1.588 14.575 1 O-C-N 104.861 -11.149 . . . . 23.280000000000001 106.876 174.389 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 66.6 p -73.43 168.17 19.78 Favored 'General case' 0 C--N 1.317 -0.848 0 N-CA-C 107.819 -1.178 . . . . 21.969999999999999 107.819 178.212 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 26.0 p -64.29 -35.94 82.5 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 116.838 -1.945 . . . . 29.309999999999999 111.165 -179.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 4.5 m -59.96 -46.63 88.79 Favored 'General case' 0 CA--C 1.564 1.508 0 CA-C-O 121.844 0.83 . . . . 19.07 111.761 174.603 -86.597 -66.102 -77.81 105.528 2.013 107.427 -58.128 -60.972 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -61.69 -42.35 98.82 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 119.221 -0.991 . . . . 22.210000000000001 110.65 178.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -60.37 -46.47 89.85 Favored 'General case' 0 C--O 1.212 -0.888 0 C-N-CA 120.507 -0.477 . . . . 26.460000000000001 111.801 179.333 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 43.3 mtp180 -73.99 -36.15 64.51 Favored 'General case' 0 C--O 1.202 -1.408 0 N-CA-C 109.85 -0.426 . . . . 39.310000000000002 109.85 -175.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 67.6 mt -61.33 -46.04 97.41 Favored 'Isoleucine or valine' 0 C--O 1.25 1.114 0 CA-C-N 118.495 0.589 . . . . 21.32 109.955 176.047 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 53.3 t -58.81 -43.03 90.48 Favored 'General case' 0 CA--C 1.554 1.097 0 O-C-N 122.274 -0.266 . . . . 21.43 111.556 -179.977 -179.009 -91.018 -88.431 103.099 2.033 104.515 -72.754 -73.386 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -61.41 -40.11 93.21 Favored 'General case' 0 C--O 1.204 -1.339 0 N-CA-C 113.841 1.052 . . . . 30.809999999999999 113.841 176.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 66.8 m -59.74 -44.74 93.66 Favored 'General case' 0 CA--C 1.559 1.31 0 CA-C-N 119.268 0.94 . . . . 19.800000000000001 111.629 175.071 -72.488 -56.286 -81.653 104.601 2.013 104.957 -86.958 -161.212 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 68.3 m-20 -67.25 -46.99 72.08 Favored 'General case' 0 C--O 1.213 -0.842 0 C-N-CA 123.881 0.873 . . . . 19.48 110.076 -177.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -54.03 -45.96 71.71 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 123.725 0.64 . . . . 30.829999999999998 110.234 176.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.02 -43.61 95.08 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 109.443 -0.577 . . . . 17.199999999999999 109.443 -179.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.4 -43.06 97.05 Favored 'General case' 0 CA--C 1.566 1.591 0 C-N-CA 119.847 -0.741 . . . . 17.02 112.566 178.279 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.33 -42.34 98.52 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 121.358 0.599 . . . . 20.469999999999999 110.933 -176.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 22.5 mt -69.72 -43.78 79.77 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 115.105 -0.952 . . . . 29.98 109.887 179.102 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 31.5 t -54.79 -47.6 73.78 Favored 'General case' 0 C--O 1.263 1.8 0 C-N-CA 119.274 -0.97 . . . . 20.289999999999999 109.766 175.639 -170.244 -85.175 -76.279 103.299 2.026 106.056 -64.304 -57.284 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 14.9 m-30 -55.99 -47.21 78.12 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 112.741 0.645 . . . . 24.039999999999999 112.741 175.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ARG . . . . . . . . . . . . . 41.4 tpt85 -59.1 -42.95 91.7 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.399 -0.364 . . . . 36.219999999999999 110.117 179.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -63.43 -26.38 68.71 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 113.022 0.749 . . . . 39.340000000000003 113.022 -179.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 70.2 m-80 -108.48 0.76 21.14 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 118.349 -1.341 . . . . 26.989999999999998 114.332 -172.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 5.9 mt -42.16 -41.61 2.73 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 113.193 0.812 . . . . 32.130000000000003 113.193 -179.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' ASN . . . . . 0.446 ' N ' ' ND2' ' A' ' 111' ' ' ASN . 0.0 OUTLIER -52.66 -31.98 39.85 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 114.272 1.212 . . . . 44.75 114.272 178.907 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 44.7 p -108.53 8.79 27.41 Favored 'General case' 0 C--O 1.217 -0.635 0 N-CA-C 114.43 1.27 . . . . 33.270000000000003 114.43 -178.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -56.36 128.99 38.63 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 107.259 -1.385 . . . . 33.32 107.259 173.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 75.7 m -126.32 129.64 49.25 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.479 0.918 . . . . 40.840000000000003 113.479 178.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 11.0 mttt -64.74 -21.54 66.78 Favored 'General case' 0 C--O 1.214 -0.775 0 CA-C-N 115.698 -0.683 . . . . 54.689999999999998 112.339 -178.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 18.7 tttt -55.63 -22.14 21.12 Favored 'General case' 0 C--N 1.317 -0.846 0 C-N-CA 123.999 0.92 . . . . 50.060000000000002 112.656 175.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -98.48 -6.78 29.69 Favored 'General case' 0 C--O 1.215 -0.74 0 N-CA-C 112.203 0.445 . . . . 38.119999999999997 112.203 -178.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 45.2 mtm -65.11 144.38 57.28 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 119.894 -0.722 . . . . 43.039999999999999 109.562 175.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 77.6 mt 50.98 39.94 24.16 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 112.293 0.479 . . . . 33.840000000000003 112.293 -179.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' TYR . . . . . . . . . . . . . 22.2 t80 -66.82 131.1 93.94 Favored Pre-proline 0 N--CA 1.438 -1.045 0 CA-C-N 116.187 -0.46 . . . . 29.989999999999998 111.754 -177.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -68.14 137.1 39.64 Favored 'Trans proline' 0 N--CA 1.476 0.497 0 N-CA-C 113.732 0.628 . . . . 27.399999999999999 113.732 -177.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ASP . . . . . 1.446 ' C ' ' N ' ' A' ' 124' ' ' PHE . 14.5 t70 -46.41 -46.69 18.78 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 115.069 -0.969 . . . . 32.409999999999997 113.606 178.227 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' PHE . . . . . 1.446 ' N ' ' C ' ' A' ' 122' ' ' ASP . 11.8 p90 -64.28 -18.67 64.8 Favored 'General case' 1 C--N 1.685 15.159 0 O-C-N 116.847 -3.658 . . . . 37.340000000000003 108.9 -164.911 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 79.8 mt -91.18 22.03 4.02 Favored 'General case' 0 CA--C 1.482 -1.642 0 N-CA-C 107.761 -1.199 . . . . 36.759999999999998 107.761 -177.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 1.3 m -115.3 87.11 2.59 Favored 'General case' 0 C--N 1.292 -1.905 0 C-N-CA 112.163 -3.815 . . . . 39.649999999999999 107.158 176.597 -94.82 -61.241 -95.975 119.99 2.042 85.798 -73.307 -41.154 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' LYS . . . . . 0.686 ' CG ' ' O ' ' A' 1287 ' ' HOH . 0.3 OUTLIER -109.31 145.01 36.69 Favored 'General case' 0 C--N 1.378 1.823 0 CA-C-N 108.726 -3.852 . . . . 57.509999999999998 120.23 -172.418 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' GLY . . . . . 0.711 ' N ' ' O ' ' A' 1238 ' ' HOH . . . 100.46 -168.16 20.61 Favored Glycine 0 C--N 1.346 1.129 0 N-CA-C 109.959 -1.256 . . . . 54.82 109.959 177.798 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -146.49 150.4 35.51 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 113.716 1.006 . . . . 67.269999999999996 113.716 -177.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 17.6 tp -147.18 123.96 11.23 Favored 'General case' 0 N--CA 1.42 -1.962 0 N-CA-C 108.118 -1.067 . . . . 55.68 108.118 179.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 1.4 mttt -91.32 132.57 36.08 Favored 'General case' 1 CA--C 1.639 4.401 0 CA-C-O 115.793 -2.051 . . . . 55.789999999999999 111.631 174.549 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 89.3 m . . . . . 1 C--N 1.478 6.184 1 CA-C-N 127.331 4.605 . . . . 30.870000000000001 107.885 173.903 -64.752 -70.674 -74.359 103.467 2.009 102.626 -70.585 -68.352 2 1 . 1 . 001 ecloud orig full ' P' P ' 1' ' ' ALA . . . . . 0.402 ' O ' ' CB ' ' P' ' 2' ' ' VAL . . . . . . . . 0 N--CA 1.427 -1.612 0 CA-C-O 117.718 -1.134 . . . . 48.299999999999997 113.662 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' P' P ' 2' ' ' VAL . . . . . 0.402 ' CB ' ' O ' ' P' ' 1' ' ' ALA . 3.7 p -167.32 89.77 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.154 0 CA-C-N 123.527 2.876 . . . . 48.789999999999999 116.043 167.448 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' P' P ' 3' ' ' TYR . . . . . 0.491 ' O ' ' CB ' ' P' ' 4' ' ' SER . 0.0 OUTLIER -67.56 3.11 1.47 Allowed 'General case' 0 N--CA 1.529 3.476 0 N-CA-C 105.651 -1.981 . . . . 49.009999999999998 105.651 176.286 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' P' P ' 4' ' ' SER . . . . . 0.491 ' CB ' ' O ' ' P' ' 3' ' ' TYR . 74.1 m . . . . . 0 C--N 1.29 -1.983 0 C-N-CA 119.823 -0.751 . . . . 49.210000000000001 111.299 179.345 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1209 ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1210 ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1211 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1212 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1213 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1214 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1215 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1216 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1217 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1218 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1219 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1220 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1221 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1222 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1223 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1224 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1225 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1226 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1227 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1228 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1229 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1230 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1231 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1232 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1233 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1234 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1235 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1236 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1237 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1238 ' ' HOH . . . . . 0.711 ' O ' ' N ' ' A' ' 128' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1239 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1240 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1241 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1242 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1243 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1244 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1245 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1246 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1247 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1248 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1249 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1250 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1251 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1252 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1253 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1254 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1255 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1256 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1257 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1258 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1259 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1260 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1261 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1262 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1263 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1264 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1265 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1266 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1267 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1268 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1269 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1270 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1271 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1272 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1273 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1274 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1275 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1276 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1277 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1278 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1279 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1280 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1281 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1282 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1283 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1284 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1285 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1286 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1287 ' ' HOH . . . . . 0.686 ' O ' ' CG ' ' A' ' 127' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1288 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1289 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1290 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1291 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1292 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1293 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1294 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1295 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1296 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1297 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1298 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1299 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1300 ' ' HOH . . . . . 0.853 ' O ' ' CD1' ' A' ' 2' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1301 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1302 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1303 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' P' P ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' P' P ' 72' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' P' P ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' P' P ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 84.0 p . . . . . 0 N--CA 1.487 1.414 0 N-CA-C 115.018 1.488 . . . . 26.48 115.018 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' LEU . . . . . 1.033 HD23 HG23 ' P' ' 2' ' ' VAL . 0.0 OUTLIER -57.22 -22.93 44.44 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 123.887 0.742 . . . . 39.530000000000001 110.988 178.056 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 3' ' ' LEU . . . . . 0.786 ' HG ' ' O ' ' A' 1297 ' ' HOH . 14.9 mt -68.05 -51.04 51.33 Favored 'General case' 0 C--O 1.214 -0.765 0 CA-C-N 115.647 -0.706 . . . . 40.119999999999997 110.308 178.829 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 -66.03 -37.93 87.13 Favored 'General case' 0 C--O 1.223 -0.336 0 O-C-N 123.494 0.496 . . . . 37.729999999999997 109.741 177.124 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -68.01 -46.05 72.3 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 118.064 0.393 . . . . 27.43 110.079 -173.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -54.84 -42.42 79.19 Favored Glycine 0 CA--C 1.53 0.973 0 N-CA-C 114.987 0.755 . . . . 27.649999999999999 114.987 174.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 49.2 tttm -69.98 -41.9 73.83 Favored 'General case' 0 N--CA 1.425 -1.711 0 O-C-N 121.983 -0.716 . . . . 44.609999999999999 110.977 -179.226 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.0 mtt -54.73 -54.04 47.08 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 112.488 0.551 . . . . 27.969999999999999 112.488 172.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 75.9 mt -54.1 -50.4 54.9 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.715 0 CA-C-N 115.544 -0.753 . . . . 25.68 111.169 178.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 56.1 tp -56.81 -48.49 77.86 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 109.866 -0.42 . . . . 30.219999999999999 109.866 177.688 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -59.69 -40.09 86.71 Favored 'General case' 0 CA--C 1.508 -0.641 0 CA-C-O 122.441 1.115 . . . . 30.52 112.186 -178.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' GLU . . . . . 0.524 ' HG3' ' HB2' ' A' ' 107' ' ' ARG . 11.1 tp10 -75.5 -46.29 33.2 Favored 'General case' 0 N--CA 1.439 -0.984 0 CA-C-N 114.139 -1.391 . . . . 36.460000000000001 111.784 -172.674 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 43.9 p -109.99 -13.62 14.38 Favored 'General case' 0 C--O 1.212 -0.869 0 N-CA-C 116.952 2.205 . . . . 27.219999999999999 116.952 -169.827 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 69.89 7.37 58.96 Favored Glycine 0 N--CA 1.404 -3.448 0 O-C-N 126.526 2.392 . . . . 33.68 113.074 -172.446 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 39.7 mttm -101.99 149.81 23.85 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-N 122.45 3.125 . . . . 37.590000000000003 107.658 175.391 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.8 mt -78.68 134.34 37.12 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 108.465 -0.939 . . . . 38.920000000000002 108.465 174.786 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -51.95 -51.18 58.86 Favored 'General case' 0 CA--C 1.508 -0.658 0 CA-C-N 115.698 -0.683 . . . . 32.479999999999997 111.798 -178.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ILE . . . . . 1.067 HD11 ' H ' ' P' ' 2' ' ' VAL . 67.7 mt -104.14 124.85 36.08 Favored Pre-proline 0 N--CA 1.453 -0.3 1 N-CA-C 98.396 -4.668 . . . . 40.789999999999999 98.396 171.957 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -101.04 7.29 20.29 Favored 'Cis proline' 0 C--N 1.325 -0.707 0 N-CA-C 117.887 2.226 . . . . 36.140000000000001 117.887 7.168 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 67.7 m -74.91 -33.85 62.06 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 115.836 1.791 . . . . 32.850000000000001 115.836 -174.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' TYR . . . . . 0.587 ' O ' ' HB3' ' A' ' 29' ' ' CYS . 95.9 m-85 -123.75 5.5 8.81 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 113.854 1.057 . . . . 30.93 113.854 -174.82 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 57.8 p -89.59 -17.84 27.72 Favored 'General case' 0 C--O 1.208 -1.115 0 N-CA-C 113.299 0.852 . . . . 30.940000000000001 113.299 -179.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 89.6 p -136.83 36.9 2.62 Favored 'General case' 0 C--O 1.247 0.937 0 C-N-CA 119.181 -1.008 . . . . 33.770000000000003 111.997 178.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -98.6 131.59 44.68 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.848 -0.615 . . . . 26.489999999999998 112.081 -173.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 49.51 -148.29 5.88 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 125.355 1.455 . . . . 24.91 112.778 -179.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 4.4 m -89.74 -14.6 34.28 Favored 'General case' 0 N--CA 1.421 -1.884 0 CA-C-O 117.159 -1.401 . . . . 28.199999999999999 113.964 -179.97 -41.154 -73.307 -95.975 85.798 2.042 119.99 -61.241 -94.82 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' TYR . . . . . 0.413 ' CE2' ' HA2' ' A' ' 33' ' ' GLY . 49.4 m-85 -120.8 -26.42 5.24 Favored 'General case' 0 CA--C 1.566 1.558 0 C-N-CA 112.74 -3.584 . . . . 25.98 115.312 -175.41 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' CYS . . . . . 0.587 ' HB3' ' O ' ' A' ' 22' ' ' TYR . 69.9 m -64.64 110.48 2.37 Favored 'General case' 0 C--N 1.352 0.713 0 N-CA-C 107.769 -1.197 . . . . 32.68 107.769 177.636 -58.421 -43.59 83.204 108.768 1.923 113.084 156.469 -66.934 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLY . . . . . 0.747 ' HA2' ' O ' ' P' ' 3' ' ' TYR . . . 110.45 -168.36 12.98 Favored Glycine 0 N--CA 1.419 -2.454 0 CA-C-O 124.535 2.186 . . . . 43.590000000000003 113.316 179.231 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' TRP . . . . . 0.405 ' C ' ' O ' ' A' ' 30' ' ' GLY . 7.1 t90 -27.73 -51.6 0.07 Allowed 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 109.125 -3.537 . . . . 59.68 111.495 176.604 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -45.19 165.54 0.05 OUTLIER Glycine 0 CA--C 1.529 0.942 0 N-CA-C 122.749 3.86 . . . . 49.729999999999997 122.749 -173.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' GLY . . . . . 0.413 ' HA2' ' CE2' ' A' ' 28' ' ' TYR . . . -178.15 53.03 0.1 OUTLIER Glycine 0 N--CA 1.444 -0.808 0 CA-C-N 114.702 -0.749 . . . . 48.939999999999998 112.398 177.097 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 4.7 mmtt -146.08 149.32 33.84 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 117.758 0.779 . . . . 55.119999999999997 111.37 178.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 80.37 -166.66 49.81 Favored Glycine 0 C--O 1.217 -0.917 0 N-CA-C 120.025 2.77 . . . . 40.439999999999998 120.025 172.973 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 76.1 m -88.35 127.55 56.54 Favored Pre-proline 0 C--O 1.217 -0.62 0 C-N-CA 123.297 0.639 . . . . 39.039999999999999 110.886 178.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_exo -59.87 139.89 90.39 Favored 'Trans proline' 0 CA--C 1.514 -0.515 0 N-CA-C 108.758 -1.286 . . . . 31.050000000000001 108.758 179.582 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' LYS . . . . . 0.688 ' HA ' ' HE2' ' A' ' 38' ' ' LYS . 9.5 mmpt? -75.3 -32.16 60.9 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 118.234 2.679 . . . . 38.670000000000002 118.234 -174.217 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 35.5 p-10 -159.92 177.66 10.55 Favored 'General case' 0 N--CA 1.448 -0.544 0 O-C-N 123.748 0.655 . . . . 27.32 109.925 -178.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -49.26 -47.22 46.76 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 113.53 0.937 . . . . 22.960000000000001 113.53 -177.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 5.6 m -56.84 -47.18 80.93 Favored 'General case' 0 C--O 1.254 1.323 0 CA-C-O 122.644 1.211 . . . . 24.59 112.873 178.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -60.59 -35.88 77.18 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-N 114.605 -1.179 . . . . 22.129999999999999 109.661 176.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 91.9 mtm-85 -63.81 -41.39 97.9 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 119.611 -0.836 . . . . 38.539999999999999 112.725 175.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 64.0 m -51.68 -46.62 63.9 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 118.892 -1.123 . . . . 23.199999999999999 110.675 172.68 -57.284 -64.304 -76.279 106.056 2.026 103.299 -85.175 -170.244 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 88.5 m -63.87 -41.11 97.83 Favored 'General case' 0 C--O 1.222 -0.39 0 O-C-N 122.041 -0.412 . . . . 20.77 112.111 -179.663 -66.934 156.469 83.204 113.084 1.923 108.768 -43.59 -58.421 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -57.49 -50.72 72.12 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 123.548 0.53 . . . . 29.16 111.354 176.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 69.7 t -64.05 -36.57 77.3 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.826 0 CA-C-O 122.178 0.989 . . . . 19.350000000000001 110.306 179.846 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 49.8 t-80 -63.43 -44.46 94.51 Favored 'General case' 0 C--O 1.255 1.349 0 O-C-N 121.355 -0.84 . . . . 19.760000000000002 111.225 176.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 51.1 m-20 -59.94 -40.66 89.74 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 120.615 -0.434 . . . . 29.969999999999999 111.595 174.215 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 91.2 m -64.91 -39.26 93.24 Favored 'General case' 0 C--O 1.253 1.27 0 CA-C-O 121.401 0.619 . . . . 22.41 110.054 179.062 -68.352 -70.585 -74.359 102.626 2.009 103.467 -70.674 -64.752 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 7.5 t -58.38 -50.75 72.56 Favored 'General case' 0 CA--C 1.562 1.421 0 CA-C-N 114.558 -1.201 . . . . 21.309999999999999 111.634 178.802 -161.212 -86.958 -81.653 104.957 2.013 104.601 -56.286 -72.488 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 6.9 m-30 -58.41 -42.8 88.01 Favored 'General case' 0 C--O 1.214 -0.802 0 C-N-CA 124.757 1.223 . . . . 23.300000000000001 109.257 173.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -56.41 -23.91 43.83 Favored Glycine 0 C--O 1.206 -1.622 0 CA-C-O 118.771 -1.016 . . . . 25.800000000000001 114.636 176.821 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ASN . . . . . 0.563 ' HB2' ' O ' ' A' 1235 ' ' HOH . 91.7 m-20 -76.6 -9.11 58.42 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 118.26 1.03 . . . . 36.049999999999997 111.892 177.09 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 7.3 mt -115.98 95.32 44.08 Favored Pre-proline 0 N--CA 1.421 -1.898 0 C-N-CA 123.032 0.533 . . . . 27.48 110.24 179.513 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_exo -66.13 -60.82 0.1 Allowed 'Trans proline' 0 CA--C 1.496 -1.413 0 N-CA-C 115.665 1.371 . . . . 29.23 115.665 176.177 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -89.2 25.03 1.98 Allowed 'General case' 0 N--CA 1.427 -1.584 0 CA-C-N 113.013 -1.903 . . . . 41.310000000000002 113.18 -174.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 77.0 m -107.66 172.66 6.71 Favored 'General case' 0 CA--C 1.481 -1.69 0 C-N-CA 114.785 -2.766 . . . . 20.52 107.4 168.99 -60.972 -58.128 -77.81 107.427 2.013 105.528 -66.102 -86.597 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ASN . . . . . 0.445 ' N ' ' CD ' ' A' ' 68' ' ' PRO . 15.8 m120 -136.01 84.48 31.05 Favored Pre-proline 1 C--N 1.454 5.124 3 O-C-N 109.853 -8.029 . . . . 25.59 106.062 -176.327 . . . . . . . . 4 3 . 1 . 001 ecloud build full ' A' A ' 68' ' ' PRO . . . . . 0.445 ' CD ' ' N ' ' A' ' 67' ' ' ASN . 9.1 Cg_exo -61.35 -15.52 41.1 Favored 'Trans proline' 0 N--CA 1.495 1.594 0 C-N-CA 124.468 3.445 . . . . 27.879999999999999 119.711 -179.005 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 46.6 mttt -99.67 -16.22 18.26 Favored 'General case' 0 CA--C 1.441 -3.25 0 C-N-CA 118.234 -1.386 . . . . 52.710000000000001 109.254 -171.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 28.2 p -128.0 -23.36 3.35 Favored 'General case' 0 CA--C 1.483 -1.618 0 CA-C-O 123.552 1.644 . . . . 30.48 111.678 -173.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -72.91 126.51 30.11 Favored 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 117.485 -1.686 . . . . 24.41 111.492 -179.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ARG . . . . . 0.697 ' HB2' ' O ' ' A' 1231 ' ' HOH . 20.0 mtp180 -98.83 127.73 44.83 Favored 'General case' 0 C--N 1.372 1.586 0 N-CA-C 114.402 1.26 . . . . 40.770000000000003 114.402 -174.128 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 31.7 p90 -120.21 170.49 9.27 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 115.059 -0.973 . . . . 22.41 110.902 177.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 34.0 mmtt -117.97 144.26 45.67 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 107.674 -1.232 . . . . 45.619999999999997 107.674 179.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 24.9 p90 -146.38 157.08 43.74 Favored 'General case' 0 C--O 1.217 -0.633 0 N-CA-C 107.944 -1.132 . . . . 27.809999999999999 107.944 175.355 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 45.6 pttt -132.65 164.85 25.8 Favored 'General case' 0 C--O 1.209 -1.054 0 N-CA-C 108.013 -1.106 . . . . 44.710000000000001 108.013 179.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -107.97 130.87 55.02 Favored 'General case' 0 CA--C 1.507 -0.681 0 N-CA-C 105.463 -2.051 . . . . 37.939999999999998 105.463 179.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 58.8 t -120.58 93.89 2.74 Favored 'Isoleucine or valine' 0 C--O 1.243 0.76 0 N-CA-C 104.12 -2.548 . . . . 42.380000000000003 104.12 176.674 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 11.0 m-20 47.47 67.51 0.8 Allowed 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 114.3 -1.318 . . . . 54.380000000000003 111.747 -170.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 78.01 -40.39 1.89 Allowed Glycine 0 CA--C 1.542 1.751 0 C-N-CA 117.026 -2.511 . . . . 41.899999999999999 116.743 -174.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -61.81 138.09 58.31 Favored 'General case' 0 CA--C 1.558 1.277 0 CA-C-N 119.324 1.562 . . . . 35.530000000000001 113.652 -179.71 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 97.2 mt -87.21 125.32 41.01 Favored 'Isoleucine or valine' 0 C--O 1.243 0.74 0 N-CA-C 106.804 -1.554 . . . . 30.23 106.804 177.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 60.4 t -125.97 116.52 46.19 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 N-CA-C 108.031 -1.1 . . . . 28.0 108.031 179.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 63.4 m -76.96 125.13 28.8 Favored 'General case' 0 C--O 1.219 -0.539 0 N-CA-C 107.83 -1.174 . . . . 26.789999999999999 107.83 -176.716 -73.386 -72.754 -88.431 104.515 2.033 103.099 -91.018 -179.009 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -85.75 157.21 20.33 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 119.439 -0.904 . . . . 44.939999999999998 110.775 -178.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 15.6 ttpp -75.86 111.57 11.36 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 114.902 1.445 . . . . 49.729999999999997 114.902 -171.234 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -122.84 -139.43 5.51 Favored Glycine 1 C--N 1.588 14.575 1 O-C-N 104.861 -11.149 . . . . 23.280000000000001 106.876 174.389 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 66.6 p -73.43 168.17 19.78 Favored 'General case' 0 C--N 1.317 -0.848 0 N-CA-C 107.819 -1.178 . . . . 21.969999999999999 107.819 178.212 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 26.0 p -64.29 -35.94 82.5 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 116.838 -1.945 . . . . 29.309999999999999 111.165 -179.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 4.5 m -59.96 -46.63 88.79 Favored 'General case' 0 CA--C 1.564 1.508 0 CA-C-O 121.844 0.83 . . . . 19.07 111.761 174.603 -86.597 -66.102 -77.81 105.528 2.013 107.427 -58.128 -60.972 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -61.69 -42.35 98.82 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 119.221 -0.991 . . . . 22.210000000000001 110.65 178.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -60.37 -46.47 89.85 Favored 'General case' 0 C--O 1.212 -0.888 0 C-N-CA 120.507 -0.477 . . . . 26.460000000000001 111.801 179.333 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 43.3 mtp180 -73.99 -36.15 64.51 Favored 'General case' 0 C--O 1.202 -1.408 0 N-CA-C 109.85 -0.426 . . . . 39.310000000000002 109.85 -175.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 67.6 mt -61.33 -46.04 97.41 Favored 'Isoleucine or valine' 0 C--O 1.25 1.114 0 CA-C-N 118.495 0.589 . . . . 21.32 109.955 176.047 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 53.3 t -58.81 -43.03 90.48 Favored 'General case' 0 CA--C 1.554 1.097 0 O-C-N 122.274 -0.266 . . . . 21.43 111.556 -179.977 -179.009 -91.018 -88.431 103.099 2.033 104.515 -72.754 -73.386 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -61.41 -40.11 93.21 Favored 'General case' 0 C--O 1.204 -1.339 0 N-CA-C 113.841 1.052 . . . . 30.809999999999999 113.841 176.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 66.8 m -59.74 -44.74 93.66 Favored 'General case' 0 CA--C 1.559 1.31 0 CA-C-N 119.268 0.94 . . . . 19.800000000000001 111.629 175.071 -72.488 -56.286 -81.653 104.601 2.013 104.957 -86.958 -161.212 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 68.3 m-20 -67.25 -46.99 72.08 Favored 'General case' 0 C--O 1.213 -0.842 0 C-N-CA 123.881 0.873 . . . . 19.48 110.076 -177.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -54.03 -45.96 71.71 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 123.725 0.64 . . . . 30.829999999999998 110.234 176.367 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.02 -43.61 95.08 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 109.443 -0.577 . . . . 17.199999999999999 109.443 -179.023 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.4 -43.06 97.05 Favored 'General case' 0 CA--C 1.566 1.591 0 C-N-CA 119.847 -0.741 . . . . 17.02 112.566 178.279 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.33 -42.34 98.52 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 121.358 0.599 . . . . 20.469999999999999 110.933 -176.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 22.5 mt -69.72 -43.78 79.77 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 115.105 -0.952 . . . . 29.98 109.887 179.102 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 31.5 t -54.79 -47.6 73.78 Favored 'General case' 0 C--O 1.263 1.8 0 C-N-CA 119.274 -0.97 . . . . 20.289999999999999 109.766 175.639 -170.244 -85.175 -76.279 103.299 2.026 106.056 -64.304 -57.284 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 14.9 m-30 -55.99 -47.21 78.12 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 112.741 0.645 . . . . 24.039999999999999 112.741 175.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ARG . . . . . 0.524 ' HB2' ' HG3' ' A' ' 12' ' ' GLU . 41.4 tpt85 -59.1 -42.95 91.7 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.399 -0.364 . . . . 36.219999999999999 110.117 179.948 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -63.43 -26.38 68.71 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 113.022 0.749 . . . . 39.340000000000003 113.022 -179.379 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 70.2 m-80 -108.48 0.76 21.14 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 118.349 -1.341 . . . . 26.989999999999998 114.332 -172.581 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 5.9 mt -42.16 -41.61 2.73 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 113.193 0.812 . . . . 32.130000000000003 113.193 -179.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 14.4 p-10 -52.66 -31.98 39.85 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 114.272 1.212 . . . . 44.75 114.272 178.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 44.7 p -108.53 8.79 27.41 Favored 'General case' 0 C--O 1.217 -0.635 0 N-CA-C 114.43 1.27 . . . . 33.270000000000003 114.43 -178.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -56.36 128.99 38.63 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 107.259 -1.385 . . . . 33.32 107.259 173.488 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 75.7 m -126.32 129.64 49.25 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.479 0.918 . . . . 40.840000000000003 113.479 178.591 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 11.0 mttt -64.74 -21.54 66.78 Favored 'General case' 0 C--O 1.214 -0.775 0 CA-C-N 115.698 -0.683 . . . . 54.689999999999998 112.339 -178.856 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 18.7 tttt -55.63 -22.14 21.12 Favored 'General case' 0 C--N 1.317 -0.846 0 C-N-CA 123.999 0.92 . . . . 50.060000000000002 112.656 175.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -98.48 -6.78 29.69 Favored 'General case' 0 C--O 1.215 -0.74 0 N-CA-C 112.203 0.445 . . . . 38.119999999999997 112.203 -178.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 45.2 mtm -65.11 144.38 57.28 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 119.894 -0.722 . . . . 43.039999999999999 109.562 175.028 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 77.6 mt 50.98 39.94 24.16 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 112.293 0.479 . . . . 33.840000000000003 112.293 -179.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' TYR . . . . . 0.467 ' CE2' ' HD2' ' A' ' 38' ' ' LYS . 22.2 t80 -66.82 131.1 93.94 Favored Pre-proline 0 N--CA 1.438 -1.045 0 CA-C-N 116.187 -0.46 . . . . 29.989999999999998 111.754 -177.977 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -68.14 137.1 39.64 Favored 'Trans proline' 0 N--CA 1.476 0.497 0 N-CA-C 113.732 0.628 . . . . 27.399999999999999 113.732 -177.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ASP . . . . . 1.446 ' C ' ' N ' ' A' ' 124' ' ' PHE . 14.5 t70 -46.41 -46.69 18.78 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 115.069 -0.969 . . . . 32.409999999999997 113.606 178.227 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 124' ' ' PHE . . . . . 1.446 ' N ' ' C ' ' A' ' 122' ' ' ASP . 11.8 p90 -64.28 -18.67 64.8 Favored 'General case' 1 C--N 1.685 15.159 0 O-C-N 116.847 -3.658 . . . . 37.340000000000003 108.9 -164.911 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 79.8 mt -91.18 22.03 4.02 Favored 'General case' 0 CA--C 1.482 -1.642 0 N-CA-C 107.761 -1.199 . . . . 36.759999999999998 107.761 -177.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 1.3 m -115.3 87.11 2.59 Favored 'General case' 0 C--N 1.292 -1.905 0 C-N-CA 112.163 -3.815 . . . . 39.649999999999999 107.158 176.597 -94.82 -61.241 -95.975 119.99 2.042 85.798 -73.307 -41.154 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' LYS . . . . . 1.079 ' HG3' ' O ' ' A' 1287 ' ' HOH . 0.3 OUTLIER -109.31 145.01 36.69 Favored 'General case' 0 C--N 1.378 1.823 0 CA-C-N 108.726 -3.852 . . . . 57.509999999999998 120.23 -172.418 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 128' ' ' GLY . . . . . 0.711 ' N ' ' O ' ' A' 1238 ' ' HOH . . . 100.46 -168.16 20.61 Favored Glycine 0 C--N 1.346 1.129 0 N-CA-C 109.959 -1.256 . . . . 54.82 109.959 177.798 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -146.49 150.4 35.51 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 113.716 1.006 . . . . 67.269999999999996 113.716 -177.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 17.6 tp -147.18 123.96 11.23 Favored 'General case' 0 N--CA 1.42 -1.962 0 N-CA-C 108.118 -1.067 . . . . 55.68 108.118 179.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 1.4 mttt -91.32 132.57 36.08 Favored 'General case' 1 CA--C 1.639 4.401 0 CA-C-O 115.793 -2.051 . . . . 55.789999999999999 111.631 174.549 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 89.3 m . . . . . 1 C--N 1.478 6.184 1 CA-C-N 127.331 4.605 . . . . 30.870000000000001 107.885 173.903 -64.752 -70.674 -74.359 103.467 2.009 102.626 -70.585 -68.352 2 1 . 1 . 001 ecloud build full ' P' P ' 1' ' ' ALA . . . . . 0.609 ' O ' ' HB ' ' P' ' 2' ' ' VAL . . . . . . . . 0 N--CA 1.427 -1.612 0 CA-C-O 117.718 -1.134 . . . . 48.299999999999997 113.662 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' P' P ' 2' ' ' VAL . . . . . 1.067 ' H ' HD11 ' A' ' 19' ' ' ILE . 3.7 p -167.32 89.77 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.154 0 CA-C-N 123.527 2.876 . . . . 48.789999999999999 116.043 167.448 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' P' P ' 3' ' ' TYR . . . . . 0.747 ' O ' ' HA2' ' A' ' 30' ' ' GLY . 0.0 OUTLIER -67.56 3.11 1.47 Allowed 'General case' 0 N--CA 1.529 3.476 0 N-CA-C 105.651 -1.981 . . . . 49.009999999999998 105.651 176.286 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' P' P ' 4' ' ' SER . . . . . 0.7 ' HB2' ' O ' ' P' ' 3' ' ' TYR . 74.1 m . . . . . 0 C--N 1.29 -1.983 0 C-N-CA 119.823 -0.751 . . . . 49.210000000000001 111.299 179.345 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1209 ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1210 ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1211 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1212 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1213 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1214 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1215 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1216 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1217 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1218 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1219 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1220 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1221 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1222 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1223 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1224 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1225 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1226 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1227 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1228 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1229 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1230 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1231 ' ' HOH . . . . . 0.697 ' O ' ' HB2' ' A' ' 72' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1232 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1233 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1234 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1235 ' ' HOH . . . . . 0.563 ' O ' ' HB2' ' A' ' 54' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1236 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1237 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1238 ' ' HOH . . . . . 0.711 ' O ' ' N ' ' A' ' 128' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1239 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1240 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1241 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1242 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1243 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1244 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1245 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1246 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1247 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1248 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1249 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1250 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1251 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1252 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1253 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1254 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1255 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1256 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1257 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1258 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1259 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1260 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1261 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1262 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1263 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1264 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1265 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1266 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1267 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1268 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1269 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1270 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1271 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1272 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1273 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1274 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1275 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1276 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1277 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1278 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1279 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1280 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1281 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1282 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1283 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1284 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1285 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1286 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1287 ' ' HOH . . . . . 1.079 ' O ' ' HG3' ' A' ' 127' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1288 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1289 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1290 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1291 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1292 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1293 ' ' HOH . . . . . 0.588 ' O ' HD11 ' A' ' 2' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1294 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1295 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1296 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1297 ' ' HOH . . . . . 0.786 ' O ' ' HG ' ' A' ' 3' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1298 ' ' HOH . . . . . 0.704 ' O ' ' HE2' ' P' ' 3' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1299 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1300 ' ' HOH . . . . . 0.853 ' O ' ' CD1' ' A' ' 2' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1301 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1302 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1303 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' P' P ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' P' P ' 72' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' P' P ' 96' ' ' HOH . . . . . 0.481 ' O ' HG12 ' P' ' 2' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' P' P ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 84.0 p . . . . . 0 N--CA 1.487 1.414 0 N-CA-C 115.018 1.488 . . . . 26.48 115.018 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' LEU . . . . . 1.033 HD23 HG23 ' P' ' 2' ' ' VAL . 0.0 OUTLIER -57.22 -22.93 44.44 Favored 'General case' 0 CA--C 1.547 0.831 0 O-C-N 123.887 0.742 . . . . 39.53 110.988 178.056 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' LEU . . . . . 0.786 ' HG ' ' O ' ' A' 1297 ' ' HOH . 14.9 mt -68.05 -51.04 51.33 Favored 'General case' 0 C--O 1.214 -0.765 0 CA-C-N 115.647 -0.706 . . . . 40.12 110.308 178.829 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.0 mp0 -66.03 -37.93 87.13 Favored 'General case' 0 C--O 1.223 -0.336 0 O-C-N 123.494 0.496 . . . . 37.73 109.741 177.124 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 7.5 t80 -68.01 -46.05 72.3 Favored 'General case' 0 CA--C 1.549 0.932 0 CA-C-N 118.064 0.393 . . . . 27.43 110.079 -173.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . -54.84 -42.42 79.19 Favored Glycine 0 CA--C 1.53 0.973 0 N-CA-C 114.987 0.755 . . . . 27.65 114.987 174.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 49.2 tttm -69.98 -41.9 73.83 Favored 'General case' 0 N--CA 1.425 -1.711 0 O-C-N 121.983 -0.716 . . . . 44.61 110.977 -179.226 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 3.0 mtt -54.73 -54.04 47.08 Favored 'General case' 0 N--CA 1.467 0.422 0 N-CA-C 112.488 0.551 . . . . 27.97 112.488 172.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 75.9 mt -54.1 -50.4 54.9 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.715 0 CA-C-N 115.544 -0.753 . . . . 25.68 111.169 178.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 56.1 tp -56.81 -48.49 77.86 Favored 'General case' 0 N--CA 1.474 0.742 0 N-CA-C 109.866 -0.42 . . . . 30.22 109.866 177.688 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -59.69 -40.09 86.71 Favored 'General case' 0 CA--C 1.508 -0.641 0 CA-C-O 122.441 1.115 . . . . 30.52 112.186 -178.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' GLU . . . . . 0.524 ' HG3' ' HB2' ' A' ' 107' ' ' ARG . 11.1 tp10 -75.5 -46.29 33.2 Favored 'General case' 0 N--CA 1.439 -0.984 0 CA-C-N 114.139 -1.391 . . . . 36.46 111.784 -172.674 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 43.9 p -109.99 -13.62 14.38 Favored 'General case' 0 C--O 1.212 -0.869 0 N-CA-C 116.952 2.205 . . . . 27.22 116.952 -169.827 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 69.89 7.37 58.96 Favored Glycine 0 N--CA 1.404 -3.448 0 O-C-N 126.526 2.392 . . . . 33.68 113.074 -172.446 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 39.7 mttm -101.99 149.81 23.85 Favored 'General case' 0 N--CA 1.492 1.653 0 CA-C-N 122.45 3.125 . . . . 37.59 107.658 175.391 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 4.8 mt -78.68 134.34 37.12 Favored 'General case' 0 N--CA 1.445 -0.721 0 N-CA-C 108.465 -0.939 . . . . 38.92 108.465 174.786 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -51.95 -51.18 58.86 Favored 'General case' 0 CA--C 1.508 -0.658 0 CA-C-N 115.698 -0.683 . . . . 32.48 111.798 -178.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ILE . . . . . 1.067 HD11 ' H ' ' P' ' 2' ' ' VAL . 67.7 mt -104.14 124.85 36.08 Favored Pre-proline 0 N--CA 1.453 -0.3 1 N-CA-C 98.396 -4.668 . . . . 40.79 98.396 171.957 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 8.6 Cg_endo -101.04 7.29 20.29 Favored 'Cis proline' 0 C--N 1.325 -0.707 0 N-CA-C 117.887 2.226 . . . . 36.14 117.887 7.168 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 67.7 m -74.91 -33.85 62.06 Favored 'General case' 0 C--N 1.312 -1.054 0 N-CA-C 115.836 1.791 . . . . 32.85 115.836 -174.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.587 ' O ' ' HB3' ' A' ' 29' ' ' CYS . 95.9 m-85 -123.75 5.5 8.81 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 113.854 1.057 . . . . 30.93 113.854 -174.82 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' SER . . . . . . . . . . . . . 57.8 p -89.59 -17.84 27.72 Favored 'General case' 0 C--O 1.208 -1.115 0 N-CA-C 113.299 0.852 . . . . 30.94 113.299 -179.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' SER . . . . . . . . . . . . . 89.6 p -136.83 36.9 2.62 Favored 'General case' 0 C--O 1.247 0.937 0 C-N-CA 119.181 -1.008 . . . . 33.77 111.997 178.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -98.6 131.59 44.68 Favored 'General case' 0 C--N 1.325 -0.488 0 CA-C-N 115.848 -0.615 . . . . 26.49 112.081 -173.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 49.51 -148.29 5.88 Favored Glycine 0 C--N 1.331 0.257 0 C-N-CA 125.355 1.455 . . . . 24.91 112.778 -179.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 4.4 m -89.74 -14.6 34.28 Favored 'General case' 0 N--CA 1.421 -1.884 0 CA-C-O 117.159 -1.401 . . . . 28.2 113.964 -179.97 -41.154 -73.307 -95.975 85.798 2.042 119.99 -61.241 -94.82 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.413 ' CE2' ' HA2' ' A' ' 33' ' ' GLY . 49.4 m-85 -120.8 -26.42 5.24 Favored 'General case' 0 CA--C 1.566 1.558 0 C-N-CA 112.74 -3.584 . . . . 25.98 115.312 -175.41 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.587 ' HB3' ' O ' ' A' ' 22' ' ' TYR . 69.9 m -64.64 110.48 2.37 Favored 'General case' 0 C--N 1.352 0.713 0 N-CA-C 107.769 -1.197 . . . . 32.68 107.769 177.636 -58.421 -43.59 83.204 108.768 1.923 113.084 156.469 -66.934 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLY . . . . . 0.747 ' HA2' ' O ' ' P' ' 3' ' ' TYR . . . 110.45 -168.36 12.98 Favored Glycine 0 N--CA 1.419 -2.454 0 CA-C-O 124.535 2.186 . . . . 43.59 113.316 179.231 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.405 ' C ' ' O ' ' A' ' 30' ' ' GLY . 7.1 t90 -27.73 -51.6 0.07 Allowed 'General case' 0 N--CA 1.432 -1.364 0 CA-C-N 109.125 -3.537 . . . . 59.68 111.495 176.604 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -45.19 165.54 0.05 OUTLIER Glycine 0 CA--C 1.529 0.942 0 N-CA-C 122.749 3.86 . . . . 49.73 122.749 -173.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.413 ' HA2' ' CE2' ' A' ' 28' ' ' TYR . . . -178.15 53.03 0.1 OUTLIER Glycine 0 N--CA 1.444 -0.808 0 CA-C-N 114.702 -0.749 . . . . 48.94 112.398 177.097 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 4.7 mmtt -146.08 149.32 33.84 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 117.758 0.779 . . . . 55.12 111.37 178.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 80.37 -166.66 49.81 Favored Glycine 0 C--O 1.217 -0.917 0 N-CA-C 120.025 2.77 . . . . 40.44 120.025 172.973 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 76.1 m -88.35 127.55 56.54 Favored Pre-proline 0 C--O 1.217 -0.62 0 C-N-CA 123.297 0.639 . . . . 39.04 110.886 178.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 45.6 Cg_exo -59.87 139.89 90.39 Favored 'Trans proline' 0 CA--C 1.514 -0.515 0 N-CA-C 108.758 -1.286 . . . . 31.05 108.758 179.582 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' LYS . . . . . 0.688 ' HE2' ' HA ' ' A' ' 38' ' ' LYS . 9.5 mmpt? -75.3 -32.16 60.9 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 118.234 2.679 . . . . 38.67 118.234 -174.217 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 35.5 p-10 -159.92 177.66 10.55 Favored 'General case' 0 N--CA 1.448 -0.544 0 O-C-N 123.748 0.655 . . . . 27.32 109.925 -178.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . -49.26 -47.22 46.76 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 113.53 0.937 . . . . 22.96 113.53 -177.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 5.6 m -56.84 -47.18 80.93 Favored 'General case' 0 C--O 1.254 1.323 0 CA-C-O 122.644 1.211 . . . . 24.59 112.873 178.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 23.5 t0 -60.59 -35.88 77.18 Favored 'General case' 0 C--O 1.24 0.601 0 CA-C-N 114.605 -1.179 . . . . 22.13 109.661 176.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 91.9 mtm-85 -63.81 -41.39 97.9 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 119.611 -0.836 . . . . 38.54 112.725 175.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 64.0 m -51.68 -46.62 63.9 Favored 'General case' 0 C--N 1.318 -0.772 0 C-N-CA 118.892 -1.123 . . . . 23.2 110.675 172.68 -57.284 -64.304 -76.279 106.056 2.026 103.299 -85.175 -170.244 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 88.5 m -63.87 -41.11 97.83 Favored 'General case' 0 C--O 1.222 -0.39 0 O-C-N 122.041 -0.412 . . . . 20.77 112.111 -179.663 -66.934 156.469 83.204 113.084 1.923 108.768 -43.59 -58.421 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 91.1 t80 -57.49 -50.72 72.12 Favored 'General case' 0 CA--C 1.544 0.734 0 O-C-N 123.548 0.53 . . . . 29.16 111.354 176.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 69.7 t -64.05 -36.57 77.3 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.826 0 CA-C-O 122.178 0.989 . . . . 19.35 110.306 179.846 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 49.8 t-80 -63.43 -44.46 94.51 Favored 'General case' 0 C--O 1.255 1.349 0 O-C-N 121.355 -0.84 . . . . 19.76 111.225 176.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 51.1 m-20 -59.94 -40.66 89.74 Favored 'General case' 0 CA--C 1.538 0.494 0 C-N-CA 120.615 -0.434 . . . . 29.97 111.595 174.215 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' CYS . . . . . . . . . . . . . 91.2 m -64.91 -39.26 93.24 Favored 'General case' 0 C--O 1.253 1.27 0 CA-C-O 121.401 0.619 . . . . 22.41 110.054 179.062 -68.352 -70.585 -74.359 102.626 2.009 103.467 -70.674 -64.752 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 7.5 t -58.38 -50.75 72.56 Favored 'General case' 0 CA--C 1.562 1.421 0 CA-C-N 114.558 -1.201 . . . . 21.31 111.634 178.802 -161.212 -86.958 -81.653 104.957 2.013 104.601 -56.286 -72.488 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' TYR . . . . . . . . . . . . . 6.9 m-30 -58.41 -42.8 88.01 Favored 'General case' 0 C--O 1.214 -0.802 0 C-N-CA 124.757 1.223 . . . . 23.3 109.257 173.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -56.41 -23.91 43.83 Favored Glycine 0 C--O 1.206 -1.622 0 CA-C-O 118.771 -1.016 . . . . 25.8 114.636 176.821 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ASN . . . . . 0.563 ' HB2' ' O ' ' A' 1235 ' ' HOH . 91.7 m-20 -76.6 -9.11 58.42 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 118.26 1.03 . . . . 36.05 111.892 177.09 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 7.3 mt -115.98 95.32 44.08 Favored Pre-proline 0 N--CA 1.421 -1.898 0 C-N-CA 123.032 0.533 . . . . 27.48 110.24 179.513 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 12.7 Cg_exo -66.13 -60.82 0.1 Allowed 'Trans proline' 0 CA--C 1.496 -1.413 0 N-CA-C 115.665 1.371 . . . . 29.23 115.665 176.177 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 28.4 m-20 -89.2 25.03 1.98 Allowed 'General case' 0 N--CA 1.427 -1.584 0 CA-C-N 113.013 -1.903 . . . . 41.31 113.18 -174.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 77.0 m -107.66 172.66 6.71 Favored 'General case' 0 CA--C 1.481 -1.69 0 C-N-CA 114.785 -2.766 . . . . 20.52 107.4 168.99 -60.972 -58.128 -77.81 107.427 2.013 105.528 -66.102 -86.597 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.445 ' N ' ' CD ' ' A' ' 68' ' ' PRO . 15.8 m120 -136.01 84.48 31.05 Favored Pre-proline 1 C--N 1.454 5.124 3 O-C-N 109.853 -8.029 . . . . 25.59 106.062 -176.327 . . . . . . . . 4 3 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.445 ' CD ' ' N ' ' A' ' 67' ' ' ASN . 9.1 Cg_exo -61.35 -15.52 41.1 Favored 'Trans proline' 0 N--CA 1.495 1.594 0 C-N-CA 124.468 3.445 . . . . 27.88 119.711 -179.005 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 46.6 mttt -99.67 -16.22 18.26 Favored 'General case' 0 CA--C 1.441 -3.25 0 C-N-CA 118.234 -1.386 . . . . 52.71 109.254 -171.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' SER . . . . . . . . . . . . . 28.2 p -128.0 -23.36 3.35 Favored 'General case' 0 CA--C 1.483 -1.618 0 CA-C-O 123.552 1.644 . . . . 30.48 111.678 -173.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 31.4 t0 -72.91 126.51 30.11 Favored 'General case' 0 CA--C 1.556 1.211 0 C-N-CA 117.485 -1.686 . . . . 24.41 111.492 -179.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ARG . . . . . 0.697 ' HB2' ' O ' ' A' 1231 ' ' HOH . 20.0 mtp180 -98.83 127.73 44.83 Favored 'General case' 0 C--N 1.372 1.586 0 N-CA-C 114.402 1.26 . . . . 40.77 114.402 -174.128 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 31.7 p90 -120.21 170.49 9.27 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 115.059 -0.973 . . . . 22.41 110.902 177.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LYS . . . . . . . . . . . . . 34.0 mmtt -117.97 144.26 45.67 Favored 'General case' 0 C--N 1.316 -0.856 0 N-CA-C 107.674 -1.232 . . . . 45.62 107.674 179.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 24.9 p90 -146.38 157.08 43.74 Favored 'General case' 0 C--O 1.217 -0.633 0 N-CA-C 107.944 -1.132 . . . . 27.81 107.944 175.355 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 45.6 pttt -132.65 164.85 25.8 Favored 'General case' 0 C--O 1.209 -1.054 0 N-CA-C 108.013 -1.106 . . . . 44.71 108.013 179.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ARG . . . . . . . . . . . . . 27.1 mmt180 -107.97 130.87 55.02 Favored 'General case' 0 CA--C 1.507 -0.681 0 N-CA-C 105.463 -2.051 . . . . 37.94 105.463 179.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' VAL . . . . . . . . . . . . . 58.8 t -120.58 93.89 2.74 Favored 'Isoleucine or valine' 0 C--O 1.243 0.76 0 N-CA-C 104.12 -2.548 . . . . 42.38 104.12 176.674 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 1.2 m-80 47.47 67.51 0.8 Allowed 'General case' 0 N--CA 1.466 0.36 0 CA-C-N 114.3 -1.318 . . . . 54.38 111.747 -170.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 78.01 -40.39 1.89 Allowed Glycine 0 CA--C 1.542 1.751 0 C-N-CA 117.026 -2.511 . . . . 41.9 116.743 -174.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ALA . . . . . . . . . . . . . . . -61.81 138.09 58.31 Favored 'General case' 0 CA--C 1.558 1.277 0 CA-C-N 119.324 1.562 . . . . 35.53 113.652 -179.71 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 97.2 mt -87.21 125.32 41.01 Favored 'Isoleucine or valine' 0 C--O 1.243 0.74 0 N-CA-C 106.804 -1.554 . . . . 30.23 106.804 177.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 60.4 t -125.97 116.52 46.19 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 N-CA-C 108.031 -1.1 . . . . 28.0 108.031 179.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 63.4 m -76.96 125.13 28.8 Favored 'General case' 0 C--O 1.219 -0.539 0 N-CA-C 107.83 -1.174 . . . . 26.79 107.83 -176.716 -73.386 -72.754 -88.431 104.515 2.033 103.099 -91.018 -179.009 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -85.75 157.21 20.33 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 119.439 -0.904 . . . . 44.94 110.775 -178.172 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LYS . . . . . . . . . . . . . 15.6 ttpp -75.86 111.57 11.36 Favored 'General case' 0 N--CA 1.446 -0.644 0 N-CA-C 114.902 1.445 . . . . 49.73 114.902 -171.234 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' GLY . . . . . . . . . . . . . . . -122.84 -139.43 5.51 Favored Glycine 1 C--N 1.588 14.575 1 O-C-N 104.861 -11.149 . . . . 23.28 106.876 174.389 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' THR . . . . . . . . . . . . . 66.6 p -73.43 168.17 19.78 Favored 'General case' 0 C--N 1.317 -0.848 0 N-CA-C 107.819 -1.178 . . . . 21.97 107.819 178.212 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 26.0 p -64.29 -35.94 82.5 Favored 'General case' 0 C--N 1.32 -0.717 0 C-N-CA 116.838 -1.945 . . . . 29.31 111.165 -179.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 4.5 m -59.96 -46.63 88.79 Favored 'General case' 0 CA--C 1.564 1.508 0 CA-C-O 121.844 0.83 . . . . 19.07 111.761 174.603 -86.597 -66.102 -77.81 105.528 2.013 107.427 -58.128 -60.972 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -61.69 -42.35 98.82 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 119.221 -0.991 . . . . 22.21 110.65 178.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 87.1 m-20 -60.37 -46.47 89.85 Favored 'General case' 0 C--O 1.212 -0.888 0 C-N-CA 120.507 -0.477 . . . . 26.46 111.801 179.333 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ARG . . . . . . . . . . . . . 43.3 mtp180 -73.99 -36.15 64.51 Favored 'General case' 0 C--O 1.202 -1.408 0 N-CA-C 109.85 -0.426 . . . . 39.31 109.85 -175.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 67.6 mt -61.33 -46.04 97.41 Favored 'Isoleucine or valine' 0 C--O 1.25 1.114 0 CA-C-N 118.495 0.589 . . . . 21.32 109.955 176.047 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 53.3 t -58.81 -43.03 90.48 Favored 'General case' 0 CA--C 1.554 1.097 0 O-C-N 122.274 -0.266 . . . . 21.43 111.556 -179.977 -179.009 -91.018 -88.431 103.099 2.033 104.515 -72.754 -73.386 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -61.41 -40.11 93.21 Favored 'General case' 0 C--O 1.204 -1.339 0 N-CA-C 113.841 1.052 . . . . 30.81 113.841 176.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 66.8 m -59.74 -44.74 93.66 Favored 'General case' 0 CA--C 1.559 1.31 0 CA-C-N 119.268 0.94 . . . . 19.8 111.629 175.071 -72.488 -56.286 -81.653 104.601 2.013 104.957 -86.958 -161.212 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 68.3 m-20 -67.25 -46.99 72.08 Favored 'General case' 0 C--O 1.213 -0.842 0 C-N-CA 123.881 0.873 . . . . 19.48 110.076 -177.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -54.03 -45.96 71.71 Favored 'General case' 0 C--N 1.33 -0.256 0 O-C-N 123.725 0.64 . . . . 30.83 110.234 176.367 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ALA . . . . . . . . . . . . . . . -64.02 -43.61 95.08 Favored 'General case' 0 N--CA 1.465 0.294 0 N-CA-C 109.443 -0.577 . . . . 17.2 109.443 -179.023 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -60.4 -43.06 97.05 Favored 'General case' 0 CA--C 1.566 1.591 0 C-N-CA 119.847 -0.741 . . . . 17.02 112.566 178.279 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -61.33 -42.34 98.52 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-O 121.358 0.599 . . . . 20.47 110.933 -176.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 22.5 mt -69.72 -43.78 79.77 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.726 0 CA-C-N 115.105 -0.952 . . . . 29.98 109.887 179.102 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 31.5 t -54.79 -47.6 73.78 Favored 'General case' 0 C--O 1.263 1.8 0 C-N-CA 119.274 -0.97 . . . . 20.29 109.766 175.639 -170.244 -85.175 -76.279 103.299 2.026 106.056 -64.304 -57.284 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 14.9 m-30 -55.99 -47.21 78.12 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 112.741 0.645 . . . . 24.04 112.741 175.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.524 ' HB2' ' HG3' ' A' ' 12' ' ' GLU . 41.4 tpt85 -59.1 -42.95 91.7 Favored 'General case' 0 C--N 1.331 -0.219 0 CA-C-N 116.399 -0.364 . . . . 36.22 110.117 179.948 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -63.43 -26.38 68.71 Favored 'General case' 0 N--CA 1.472 0.666 0 N-CA-C 113.022 0.749 . . . . 39.34 113.022 -179.379 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ASN . . . . . . . . . . . . . 70.2 m-80 -108.48 0.76 21.14 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 118.349 -1.341 . . . . 26.99 114.332 -172.581 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' LEU . . . . . . . . . . . . . 5.9 mt -42.16 -41.61 2.73 Favored 'General case' 0 C--N 1.314 -0.964 0 N-CA-C 113.193 0.812 . . . . 32.13 113.193 -179.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' ASN . . . . . 0.666 HD22 ' N ' ' A' ' 111' ' ' ASN . 0.0 OUTLIER -52.66 -31.98 39.85 Favored 'General case' 0 C--N 1.324 -0.51 0 N-CA-C 114.272 1.212 . . . . 44.75 114.272 178.907 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' THR . . . . . . . . . . . . . 44.7 p -108.53 8.79 27.41 Favored 'General case' 0 C--O 1.217 -0.635 0 N-CA-C 114.43 1.27 . . . . 33.27 114.43 -178.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' TYR . . . . . . . . . . . . . 33.7 t80 -56.36 128.99 38.63 Favored 'General case' 0 C--N 1.317 -0.816 0 N-CA-C 107.259 -1.385 . . . . 33.32 107.259 173.488 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' SER . . . . . . . . . . . . . 75.7 m -126.32 129.64 49.25 Favored 'General case' 0 N--CA 1.475 0.818 0 N-CA-C 113.479 0.918 . . . . 40.84 113.479 178.591 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' LYS . . . . . . . . . . . . . 11.0 mttt -64.74 -21.54 66.78 Favored 'General case' 0 C--O 1.214 -0.775 0 CA-C-N 115.698 -0.683 . . . . 54.69 112.339 -178.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 18.7 tttt -55.63 -22.14 21.12 Favored 'General case' 0 C--N 1.317 -0.846 0 C-N-CA 123.999 0.92 . . . . 50.06 112.656 175.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -98.48 -6.78 29.69 Favored 'General case' 0 C--O 1.215 -0.74 0 N-CA-C 112.203 0.445 . . . . 38.12 112.203 -178.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' MET . . . . . . . . . . . . . 45.2 mtm -65.11 144.38 57.28 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 119.894 -0.722 . . . . 43.04 109.562 175.028 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 77.6 mt 50.98 39.94 24.16 Favored 'General case' 0 C--N 1.321 -0.644 0 N-CA-C 112.293 0.479 . . . . 33.84 112.293 -179.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' TYR . . . . . 0.467 ' CE2' ' HD2' ' A' ' 38' ' ' LYS . 22.2 t80 -66.82 131.1 93.94 Favored Pre-proline 0 N--CA 1.438 -1.045 0 CA-C-N 116.187 -0.46 . . . . 29.99 111.754 -177.977 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -68.14 137.1 39.64 Favored 'Trans proline' 0 N--CA 1.476 0.497 0 N-CA-C 113.732 0.628 . . . . 27.4 113.732 -177.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ASP . . . . . 1.446 ' C ' ' N ' ' A' ' 124' ' ' PHE . 14.5 t70 -46.41 -46.69 18.78 Favored 'General case' 0 N--CA 1.435 -1.189 0 CA-C-N 115.069 -0.969 . . . . 32.41 113.606 178.227 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' PHE . . . . . 1.446 ' N ' ' C ' ' A' ' 122' ' ' ASP . 11.8 p90 -64.28 -18.67 64.8 Favored 'General case' 1 C--N 1.685 15.159 0 O-C-N 116.847 -3.658 . . . . 37.34 108.9 -164.911 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 79.8 mt -91.18 22.03 4.02 Favored 'General case' 0 CA--C 1.482 -1.642 0 N-CA-C 107.761 -1.199 . . . . 36.76 107.761 -177.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 1.3 m -115.3 87.11 2.59 Favored 'General case' 0 C--N 1.292 -1.905 0 C-N-CA 112.163 -3.815 . . . . 39.65 107.158 176.597 -94.82 -61.241 -95.975 119.99 2.042 85.798 -73.307 -41.154 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' LYS . . . . . 1.079 ' HG3' ' O ' ' A' 1287 ' ' HOH . 0.3 OUTLIER -109.31 145.01 36.69 Favored 'General case' 0 C--N 1.378 1.823 0 CA-C-N 108.726 -3.852 . . . . 57.51 120.23 -172.418 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' GLY . . . . . 0.711 ' N ' ' O ' ' A' 1238 ' ' HOH . . . 100.46 -168.16 20.61 Favored Glycine 0 C--N 1.346 1.129 0 N-CA-C 109.959 -1.256 . . . . 54.82 109.959 177.798 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -146.49 150.4 35.51 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 113.716 1.006 . . . . 67.27 113.716 -177.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' LEU . . . . . . . . . . . . . 17.6 tp -147.18 123.96 11.23 Favored 'General case' 0 N--CA 1.42 -1.962 0 N-CA-C 108.118 -1.067 . . . . 55.68 108.118 179.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 1.4 mttt -91.32 132.57 36.08 Favored 'General case' 1 CA--C 1.639 4.401 0 CA-C-O 115.793 -2.051 . . . . 55.79 111.631 174.549 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' CYS . . . . . . . . . . . . . 89.3 m . . . . . 1 C--N 1.478 6.184 1 CA-C-N 127.331 4.605 . . . . 30.87 107.885 173.903 -64.752 -70.674 -74.359 103.467 2.009 102.626 -70.585 -68.352 2 1 . 1 . 001 ecloud nobuild full ' P' P ' 1' ' ' ALA . . . . . 0.609 ' O ' ' HB ' ' P' ' 2' ' ' VAL . . . . . . . . 0 N--CA 1.427 -1.612 0 CA-C-O 117.718 -1.134 . . . . 48.3 113.662 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' P' P ' 2' ' ' VAL . . . . . 1.067 ' H ' HD11 ' A' ' 19' ' ' ILE . 3.7 p -167.32 89.77 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.154 0 CA-C-N 123.527 2.876 . . . . 48.79 116.043 167.448 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' P' P ' 3' ' ' TYR . . . . . 0.747 ' O ' ' HA2' ' A' ' 30' ' ' GLY . 0.0 OUTLIER -67.56 3.11 1.47 Allowed 'General case' 0 N--CA 1.529 3.476 0 N-CA-C 105.651 -1.981 . . . . 49.01 105.651 176.286 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' P' P ' 4' ' ' SER . . . . . 0.7 ' HB2' ' O ' ' P' ' 3' ' ' TYR . 74.1 m . . . . . 0 C--N 1.29 -1.983 0 C-N-CA 119.823 -0.751 . . . . 49.21 111.299 179.345 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1209 ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1210 ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1211 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1212 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1213 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1214 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1215 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1216 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1217 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1218 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1219 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1220 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1221 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1222 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1223 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1224 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1225 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1226 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1227 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1228 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1229 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1230 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1231 ' ' HOH . . . . . 0.697 ' O ' ' HB2' ' A' ' 72' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1232 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1233 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1234 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1235 ' ' HOH . . . . . 0.563 ' O ' ' HB2' ' A' ' 54' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1236 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1237 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1238 ' ' HOH . . . . . 0.711 ' O ' ' N ' ' A' ' 128' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1239 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1240 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1241 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1242 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1243 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1244 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1245 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1246 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1247 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1248 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1249 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1250 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1251 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1252 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1253 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1254 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1255 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1256 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1257 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1258 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1259 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1260 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1261 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1262 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1263 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1264 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1265 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1266 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1267 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1268 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1269 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1270 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1271 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1272 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1273 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1274 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1275 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1276 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1277 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1278 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1279 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1280 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1281 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1282 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1283 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1284 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1285 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1286 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1287 ' ' HOH . . . . . 1.079 ' O ' ' HG3' ' A' ' 127' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1288 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1289 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1290 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1291 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1292 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1293 ' ' HOH . . . . . 0.588 ' O ' HD11 ' A' ' 2' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1294 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1295 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1296 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1297 ' ' HOH . . . . . 0.786 ' O ' ' HG ' ' A' ' 3' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1298 ' ' HOH . . . . . 0.704 ' O ' ' HE2' ' P' ' 3' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1299 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1300 ' ' HOH . . . . . 0.853 ' O ' ' CD1' ' A' ' 2' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1301 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1302 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1303 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' P' P ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' P' P ' 72' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' P' P ' 96' ' ' HOH . . . . . 0.481 ' O ' HG12 ' P' ' 2' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' P' P ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_