data_3hsw_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 3hsw _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.503 2.175 0 N-CA-C 108.771 -0.825 . . . . 17.329999999999998 108.771 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 16.4 tp -32.59 -60.13 0.3 Allowed 'General case' 0 C--O 1.242 0.664 0 O-C-N 124.345 1.028 . . . . 22.129999999999999 113.563 -179.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 46.8 p-90 -60.42 -33.22 72.21 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 118.195 -1.402 . . . . 22.48 111.552 -175.131 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -68.15 -32.31 72.5 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 117.775 -1.57 . . . . 21.02 110.771 -176.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -66.77 -47.03 73.42 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.658 1.183 . . . . 21.640000000000001 109.179 178.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 14.6 mtm180 -51.89 -47.57 64.51 Favored 'General case' 0 CA--C 1.491 -1.316 0 N-CA-C 107.727 -1.212 . . . . 40.600000000000001 107.727 174.111 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . 0.351 84.1 p -80.6 -17.27 51.87 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 114.777 -2.769 . . . . 20.390000000000001 115.203 -179.038 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 32.4 mtt -59.47 -43.4 93.23 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 119.111 -1.035 . . . . 21.109999999999999 112.198 165.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 34.3 mt -61.02 -47.78 92.06 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.81 0 C-N-CA 123.824 0.849 . . . . 21.190000000000001 110.363 178.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.6 mttm -59.25 -30.35 68.21 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-N 118.338 0.517 . . . . 40.469999999999999 111.563 176.616 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' CYS . . . . . 1.159 ' CB ' ' SG ' ' A' ' 77' ' ' CYS . 13.4 t -68.17 -47.05 69.03 Favored 'General case' 0 C--O 1.252 1.219 0 C-N-CA 122.591 0.356 . . . . 22.870000000000001 110.538 179.809 169.441 103.062 86.63 104.233 1.079 139.084 99.42 -168.973 2 2 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -80.72 -37.6 30.3 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 115.783 -0.644 . . . . 24.66 110.281 -173.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.8 mt -117.0 83.27 14.53 Favored Pre-proline 0 CA--C 1.547 0.851 0 C-N-CA 123.551 0.741 . . . . 26.620000000000001 110.142 173.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_exo -51.69 -42.88 54.41 Favored 'Trans proline' 0 C--N 1.353 0.776 0 N-CA-C 116.54 1.708 . . . . 28.100000000000001 116.54 -177.514 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -79.05 42.02 2.28 Favored Glycine 0 N--CA 1.473 1.157 0 C-N-CA 120.226 -0.988 . . . . 32.439999999999998 115.082 -178.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -135.66 151.1 49.87 Favored 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 118.955 2.946 . . . . 34.07 118.955 -166.169 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -122.05 93.92 48.35 Favored Pre-proline 0 N--CA 1.434 -1.265 0 N-CA-C 107.576 -1.268 . . . . 47.310000000000002 107.576 178.596 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_exo -54.75 -58.56 1.17 Allowed 'Trans proline' 0 CA--C 1.549 1.234 0 C-N-CA 123.559 2.839 . . . . 36.490000000000002 115.412 -170.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -44.51 -48.88 10.17 Favored 'General case' 0 C--N 1.288 -2.076 0 C-N-CA 126.891 2.076 . . . . 42.170000000000002 108.438 -177.955 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 1.6 ttt -75.15 -36.0 61.58 Favored 'General case' 1 C--N 1.448 4.876 0 C-N-CA 125.624 1.57 . . . . 43.049999999999997 114.582 -179.374 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 65.5 m-20 -81.86 -50.24 9.43 Favored 'General case' 0 C--O 1.248 1.013 0 N-CA-C 113.53 0.937 . . . . 35.579999999999998 113.53 -176.161 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -108.36 9.63 27.74 Favored 'General case' 0 C--O 1.202 -1.414 0 N-CA-C 116.439 2.014 . . . . 31.350000000000001 116.439 -170.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 38.3 t30 -101.29 137.11 40.07 Favored 'General case' 0 C--O 1.245 0.843 0 N-CA-C 106.608 -1.627 . . . . 32.049999999999997 106.608 173.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.4 m120 46.96 62.23 2.47 Favored 'General case' 0 C--O 1.242 0.702 0 CA-C-O 122.566 1.174 . . . . 38.729999999999997 110.806 -168.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' TYR . . . . . . . . . . . . . 48.0 t80 -116.45 127.66 54.79 Favored 'General case' 0 C--O 1.25 1.082 0 CA-C-N 113.244 -1.798 . . . . 24.91 106.774 166.534 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 54.76 -149.59 19.96 Favored Glycine 0 N--CA 1.442 -0.965 0 N-CA-C 111.363 -0.695 . . . . 19.73 111.363 176.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 79.3 m -92.65 -20.05 21.25 Favored 'General case' 0 C--O 1.262 1.747 0 N-CA-C 113.772 1.027 . . . . 15.859999999999999 113.772 -169.044 -60.552 -57.563 -82.008 101.773 2.023 102.074 -73.362 -62.13 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' TYR . . . . . . . . . . . . . 71.9 m-85 -130.49 3.81 4.64 Favored 'General case' 0 N--CA 1.501 2.078 0 N-CA-C 116.779 2.14 . . . . 14.960000000000001 116.779 -172.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 87.9 m -95.05 87.49 4.93 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 108.169 -1.049 . . . . 20.829999999999998 108.169 175.695 -67.968 -45.245 95.078 105.191 2.05 107.542 150.68 -76.279 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 144.38 179.43 20.83 Favored Glycine 0 C--O 1.255 1.439 0 N-CA-C 107.444 -2.262 . . . . 23.440000000000001 107.444 -174.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 59.5 tp -57.92 130.9 48.62 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 119.413 -0.915 . . . . 26.059999999999999 110.597 -172.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 59.1 -141.5 47.18 Favored Glycine 0 C--N 1.347 1.191 0 O-C-N 125.227 1.579 . . . . 22.550000000000001 111.11 -175.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 165.68 157.09 9.7 Favored Glycine 0 N--CA 1.467 0.708 0 N-CA-C 107.554 -2.218 . . . . 19.199999999999999 107.554 -179.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.2 p -148.58 161.32 41.92 Favored 'General case' 0 C--O 1.205 -1.256 0 CA-C-N 117.676 0.738 . . . . 12.51 111.365 172.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 69.71 -157.42 53.5 Favored Glycine 0 CA--C 1.532 1.15 0 N-CA-C 115.673 1.029 . . . . 10.0 115.673 171.689 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 99.1 m -97.6 137.89 21.07 Favored Pre-proline 0 C--O 1.196 -1.753 0 N-CA-C 108.566 -0.901 . . . . 10.0 108.566 179.583 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -58.98 147.16 91.29 Favored 'Trans proline' 0 C--O 1.246 0.912 0 C-N-CA 114.756 -3.029 . . . . 12.99 113.152 177.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 18.2 m -82.46 -5.23 8.75 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 N-CA-C 116.001 1.852 . . . . 17.620000000000001 116.001 -176.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ASP . . . . . 0.865 ' CA ' ' O ' ' A' ' 507' ' ' HOH 0.295 0.7 OUTLIER -158.73 164.42 35.9 Favored 'General case' 1 C--N 1.432 4.173 0 C-N-CA 125.786 1.634 . . . . 30.73 114.999 -152.404 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.78 -49.3 71.28 Favored 'General case' 0 C--N 1.275 -2.632 0 C-N-CA 116.116 -2.233 . . . . 30.719999999999999 109.048 159.825 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.41 -62.32 1.73 Allowed 'General case' 0 CA--C 1.554 1.115 0 N-CA-C 108.69 -0.855 . . . . 19.739999999999998 108.69 -177.846 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -51.89 -32.67 33.5 Favored 'General case' 0 C--O 1.268 2.065 0 O-C-N 121.264 -0.897 . . . . 18.739999999999998 112.035 178.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.6 -44.79 92.96 Favored 'General case' 0 C--O 1.247 0.953 0 N-CA-C 108.555 -0.905 . . . . 42.579999999999998 108.555 175.481 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 82.0 m -55.06 -36.3 65.43 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 119.465 -0.894 . . . . 17.219999999999999 110.423 179.362 -60.144 -78.191 -73.759 101.066 1.995 104.545 -85.979 -156.407 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' CYS . . . . . . . . . . . . . 51.4 m -73.77 -38.47 64.66 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 124.204 0.94 . . . . 21.260000000000002 111.18 -178.117 -76.279 150.68 95.078 107.542 2.05 105.191 -45.245 -67.968 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -63.44 -47.02 83.61 Favored 'General case' 0 C--O 1.262 1.75 0 O-C-N 123.749 0.655 . . . . 20.57 110.612 177.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 63.5 m -56.78 -38.83 73.04 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 116.019 -0.537 . . . . 18.059999999999999 112.048 175.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 29.7 t-80 -67.02 -48.24 68.97 Favored 'General case' 0 C--O 1.256 1.435 0 N-CA-C 107.381 -1.34 . . . . 23.140000000000001 107.381 179.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -52.03 -43.97 63.98 Favored 'General case' 0 N--CA 1.428 -1.551 0 N-CA-C 108.302 -0.999 . . . . 20.079999999999998 108.302 175.603 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 62.9 m-20 -75.04 -32.17 61.49 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 119.701 -0.8 . . . . 30.760000000000002 109.909 -175.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 7.1 t -61.35 -35.16 76.65 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 116.24 -0.437 . . . . 19.41 110.199 176.929 -160.803 -96.728 -78.322 106.499 2.055 102.677 -64.214 -61.099 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' TYR . . . . . 0.468 ' OH ' ' OD2' ' A' ' 99' ' ' ASP . 3.9 m-85 -79.43 -23.68 43.01 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 109.219 -0.66 . . . . 21.079999999999998 109.219 -177.195 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -69.74 -44.42 70.3 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.7 -0.682 . . . . 48.270000000000003 109.792 175.196 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -62.09 -51.43 67.95 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 115.526 1.676 . . . . 29.52 115.526 178.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -50.26 -53.2 30.09 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.279 1.031 . . . . 28.09 111.888 169.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 13.8 mtmm -48.23 -42.85 31.46 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 106.146 -1.798 . . . . 35.82 106.146 175.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -88.05 27.84 1.14 Allowed 'General case' 0 N--CA 1.497 1.914 0 N-CA-C 118.029 2.603 . . . . 39.270000000000003 118.029 -174.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 4.1 mt -106.37 124.17 49.18 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 107.182 -1.414 . . . . 42.170000000000002 107.182 175.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.86 -28.49 69.89 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-N 120.109 1.322 . . . . 43.07 111.105 -170.355 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.32 -22.27 61.2 Favored 'General case' 0 C--O 1.245 0.841 0 O-C-N 124.159 0.912 . . . . 37.759999999999998 111.875 -169.386 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 64.7 m -102.97 122.39 44.49 Favored 'General case' 0 C--O 1.219 -0.515 0 C-N-CA 124.555 1.142 . . . . 34.899999999999999 112.63 -173.211 -57.505 -62.428 -96.443 103.852 2.019 103.201 -78.043 -53.769 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.2 tmtm? -125.57 89.14 2.99 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 108.427 -0.953 . . . . 42.200000000000003 108.427 174.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 68.0 m-85 -67.22 151.74 46.98 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 116.452 2.019 . . . . 27.719999999999999 116.452 -179.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' LEU . . . . . 0.463 ' C ' ' N ' ' A' ' 66' ' ' ASP . 9.3 tp -64.39 127.84 33.21 Favored 'General case' 0 C--O 1.235 0.322 0 O-C-N 123.957 0.786 . . . . 25.43 109.176 -179.922 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER 65.38 2.49 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 0.984 0 N-CA-C 107.806 -1.183 . . . . 28.109999999999999 107.806 171.41 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ASP . . . . . 0.463 ' N ' ' C ' ' A' ' 64' ' ' LEU . 0.6 OUTLIER 81.04 26.82 0.22 Allowed 'General case' 0 CA--C 1.472 -2.024 0 CA-C-N 112.6 -2.091 . . . . 41.770000000000003 114.1 168.824 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -128.59 112.52 19.24 Favored Pre-proline 0 N--CA 1.419 -1.976 0 N-CA-C 102.758 -3.053 . . . . 29.969999999999999 102.758 -167.711 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' PRO . . . . . . . . . . . . . 81.6 Cg_exo -53.84 -24.95 33.05 Favored 'Trans proline' 0 CA--C 1.502 -1.095 0 C-N-CA 121.978 1.785 . . . . 24.59 111.551 175.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' TYR . . . . . . . . . . . . . 3.0 m-85 -62.84 -16.88 60.26 Favored 'General case' 0 C--O 1.262 1.758 0 N-CA-C 114.636 1.347 . . . . 42.5 114.636 -178.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . 0.28 0.9 OUTLIER -81.57 -7.29 59.57 Favored 'General case' 0 N--CA 1.433 -1.276 0 CA-C-N 112.64 -2.073 . . . . 16.68 109.098 -176.086 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -105.32 111.43 24.17 Favored 'General case' 0 N--CA 1.433 -1.295 0 O-C-N 121.115 -0.991 . . . . 23.390000000000001 108.533 -164.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.7 m -82.43 142.94 31.53 Favored 'General case' 0 CA--C 1.504 -0.789 0 C-N-CA 124.646 1.178 . . . . 14.859999999999999 108.957 -179.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' TYR . . . . . 1.025 ' O ' ' CB ' ' A' ' 74' ' ' SER . 2.7 p90 -131.67 -22.35 2.41 Favored 'General case' 0 C--O 1.265 1.9 0 N-CA-C 116.038 1.866 . . . . 19.699999999999999 116.038 -174.109 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' SER . . . . . 1.025 ' CB ' ' O ' ' A' ' 73' ' ' TYR . 22.7 t 77.57 94.77 0.06 Allowed 'General case' 0 C--N 1.271 -2.826 2 C-N-CA 107.799 -5.56 . . . . 22.620000000000001 118.327 -170.68 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 3.8 p90 -130.11 171.28 13.01 Favored 'General case' 0 C--O 1.188 -2.136 0 CA-C-N 111.306 -2.679 . . . . 24.25 114.866 166.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 78.9 p -129.94 151.74 50.17 Favored 'General case' 0 C--O 1.201 -1.491 0 N-CA-C 115.419 1.637 . . . . 19.82 115.419 170.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' CYS . . . . . 1.159 ' SG ' ' CB ' ' A' ' 11' ' ' CYS . 22.6 t -132.21 101.63 5.46 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 121.607 -0.683 . . . . 22.530000000000001 112.161 -175.857 -168.973 99.42 86.63 139.084 1.079 104.233 103.062 169.441 2 2 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' SER . . . . . 0.965 ' O ' ' ND2' ' A' ' 79' ' ' ASN . 40.6 t -107.32 98.84 8.42 Favored 'General case' 0 C--O 1.251 1.135 0 CA-C-O 122.676 1.227 . . . . 28.100000000000001 112.706 176.651 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ASN . . . . . 0.965 ' ND2' ' O ' ' A' ' 78' ' ' SER . 0.5 OUTLIER 54.96 65.19 1.57 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.722 -1.126 . . . . 25.16 113.631 174.227 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' THR . . . . . 0.77 ' O ' ' CG2' ' A' ' 80' ' ' THR . 7.8 m 70.64 27.24 3.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.167 -0.469 . . . . 23.16 112.154 176.064 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 41.6 mm-40 -132.6 108.89 9.36 Favored 'General case' 0 CA--C 1.504 -0.809 0 N-CA-C 105.363 -2.088 . . . . 36.509999999999998 105.363 178.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 43.2 mt -82.42 138.21 19.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 C-N-CA 119.078 -1.049 . . . . 18.449999999999999 109.531 175.56 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 30.0 m -129.3 120.33 25.46 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 121.439 -0.788 . . . . 18.41 110.424 173.348 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 62.6 m -83.28 116.47 22.44 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-O 122.214 1.007 . . . . 15.85 108.985 173.547 -73.586 -76.364 -98.75 102.774 2.059 104.744 -90.882 -167.177 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -44.87 133.55 6.16 Favored 'General case' 0 CA--C 1.491 -1.311 0 CA-C-N 115.349 -0.841 . . . . 18.100000000000001 111.269 172.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 45.4 p -76.44 -19.95 57.55 Favored 'General case' 0 CA--C 1.547 0.863 0 O-C-N 124.957 1.41 . . . . 14.42 109.278 -176.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt -84.11 2.21 40.52 Favored 'General case' 0 N--CA 1.425 -1.678 0 CA-C-N 115.34 -0.845 . . . . 23.670000000000002 111.738 178.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ASN . . . . . 0.697 ' ND2' ' O ' ' A' ' 73' ' ' TYR . 8.3 m120 -56.31 138.17 51.17 Favored 'General case' 0 C--O 1.209 -1.043 0 O-C-N 120.687 -1.258 . . . . 12.91 110.352 163.547 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 15.1 p30 -66.42 168.07 9.57 Favored 'General case' 0 N--CA 1.484 1.238 0 CA-C-N 120.108 1.322 . . . . 13.06 108.438 170.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -53.13 -43.03 66.61 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.785 1.032 . . . . 13.9 113.785 -174.085 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 56.1 m -71.53 -44.86 63.83 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-N 118.374 0.534 . . . . 19.960000000000001 112.012 -177.379 -53.769 -78.043 -96.443 103.201 2.019 103.852 -62.428 -57.505 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 82.2 mt-10 -56.9 -46.0 82.25 Favored 'General case' 0 C--O 1.255 1.359 0 C-N-CA 123.59 0.756 . . . . 14.390000000000001 112.356 171.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -58.74 -40.48 83.94 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 120.818 -0.353 . . . . 14.08 111.536 176.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -67.88 -53.26 27.99 Favored 'General case' 0 CA--C 1.491 -1.292 0 N-CA-C 107.416 -1.327 . . . . 20.879999999999999 107.416 -178.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 11.3 mm -52.83 -54.84 14.4 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 C-N-CA 119.074 -1.05 . . . . 16.510000000000002 108.49 175.273 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 16.2 t -43.82 -53.48 5.96 Favored 'General case' 0 CA--C 1.565 1.54 0 CA-C-N 118.872 0.76 . . . . 17.59 112.501 -179.891 -167.177 -90.882 -98.75 104.744 2.059 102.774 -76.364 -73.586 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 20.6 m120 -63.54 -30.18 71.33 Favored 'General case' 0 N--CA 1.444 -0.728 0 N-CA-C 114.902 1.445 . . . . 29.41 114.902 -178.945 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 76.4 m -61.01 -48.29 82.51 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 118.451 -1.3 . . . . 18.149999999999999 109.015 171.06 -61.099 -64.214 -78.322 102.677 2.055 106.499 -96.728 -160.803 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ASP . . . . . 0.468 ' OD2' ' OH ' ' A' ' 52' ' ' TYR . 66.0 m-20 -65.47 -45.83 82.15 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 108.009 -1.108 . . . . 17.289999999999999 108.009 -174.486 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ARG . . . . . 0.571 ' CD ' ' O ' ' A' ' 521' ' ' HOH . 0.0 OUTLIER -64.2 -49.02 73.65 Favored 'General case' 0 C--O 1.193 -1.88 0 N-CA-C 113.0 0.741 . . . . 28.620000000000001 113.0 -175.135 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 96.7 m-20 -55.55 -39.15 70.25 Favored 'General case' 0 C--N 1.312 -1.053 0 C-N-CA 123.405 0.682 . . . . 19.129999999999999 111.183 173.242 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -70.63 -41.61 71.96 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 118.214 -1.395 . . . . 17.140000000000001 109.884 178.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.75 -43.5 93.13 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 119.28 0.945 . . . . 18.309999999999999 111.53 177.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 32.8 mt -57.39 -47.49 84.6 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 N-CA-C 106.423 -1.695 . . . . 17.149999999999999 106.423 176.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 4.4 t -55.54 -53.54 55.13 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.505 1.122 . . . . 15.710000000000001 113.241 178.389 -156.407 -85.979 -73.759 104.545 1.995 101.066 -78.191 -60.144 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -56.1 -41.27 74.96 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-O 119.122 -0.466 . . . . 15.779999999999999 110.355 177.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 60.6 p -57.2 -24.49 54.85 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 120.093 -0.643 . . . . 17.68 112.685 -176.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 20.0 mttp -112.09 -10.64 13.88 Favored 'General case' 0 C--O 1.205 -1.245 0 N-CA-C 114.112 1.153 . . . . 24.460000000000001 114.112 -171.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -74.89 147.61 84.07 Favored Pre-proline 0 C--O 1.254 1.318 0 CA-C-N 119.085 0.857 . . . . 20.300000000000001 110.029 171.041 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_endo -69.84 141.65 45.49 Favored 'Trans proline' 0 N--CA 1.449 -1.128 0 N-CA-C 108.113 -1.534 . . . . 22.949999999999999 108.113 167.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -100.5 121.62 41.86 Favored 'General case' 0 CA--C 1.475 -1.927 0 N-CA-C 106.191 -1.781 . . . . 22.440000000000001 106.191 176.457 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 -109.27 117.54 34.36 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 109.101 -0.703 . . . . 24.039999999999999 109.101 177.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 1.3 mtpm? -56.43 -41.8 77.01 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.118 -0.633 . . . . 31.609999999999999 109.633 -177.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 6.0 mp0 -40.31 -34.24 0.31 Allowed 'General case' 0 C--O 1.249 1.038 0 N-CA-C 117.956 2.576 . . . . 38.409999999999997 117.956 178.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 35.7 m170 -99.78 4.27 45.26 Favored 'General case' 0 C--O 1.245 0.853 0 N-CA-C 116.991 2.219 . . . . 28.32 116.991 -172.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.48 137.49 48.24 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 104.549 -2.389 . . . . 29.449999999999999 104.549 173.85 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 1.6 m120 45.49 56.48 5.7 Favored 'General case' 0 C--O 1.257 1.467 0 CA-C-N 118.978 0.808 . . . . 32.340000000000003 112.221 -178.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.75 150.38 46.98 Favored 'General case' 0 C--O 1.251 1.147 0 N-CA-C 107.193 -1.41 . . . . 26.68 107.193 177.771 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -73.05 92.4 1.67 Allowed 'General case' 0 C--O 1.196 -1.745 0 N-CA-C 107.315 -1.365 . . . . 26.899999999999999 107.315 168.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 35.8 p -61.2 -30.59 70.52 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 115.47 1.656 . . . . 26.289999999999999 115.47 -179.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.08 -8.31 59.65 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 117.1 -1.84 . . . . 36.43 113.891 -176.052 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 1.3 tttm -98.09 -42.43 7.47 Favored 'General case' 0 C--O 1.216 -0.684 0 CA-C-N 115.3 -0.863 . . . . 27.100000000000001 110.694 172.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -113.68 1.55 14.93 Favored 'General case' 0 C--O 1.255 1.349 0 N-CA-C 117.274 2.324 . . . . 31.300000000000001 117.274 -164.089 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 72.0 m . . . . . 0 CA--C 1.494 -1.195 0 CA-C-O 124.808 2.242 . . . . 17.800000000000001 109.476 -172.999 -62.13 -73.362 -82.008 102.074 2.023 101.773 -57.563 -60.552 0 0 . 1 . 001 ecloud orig full ' A' A ' 500' ' ' MCW . . . . . 0.657 ' C7 ' ' O ' ' A' ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 507' ' ' HOH . . . . . 0.865 ' O ' ' CA ' ' A' ' 39' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 521' ' ' HOH . . . . . 0.571 ' O ' ' CD ' ' A' ' 100' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 534' ' ' HOH . . . . . 0.657 ' O ' ' C7 ' ' A' ' 500' ' ' MCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 1' ' ' ALA . . . . . 0.517 ' HA ' ' O ' ' A' ' 69' ' ' TYR . . . . . . . . 0 N--CA 1.503 2.175 0 N-CA-C 108.771 -0.825 . . . . 17.33 108.771 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 16.4 tp -32.59 -60.13 0.3 Allowed 'General case' 0 C--O 1.242 0.664 0 O-C-N 124.345 1.028 . . . . 22.13 113.563 -179.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 46.8 p-90 -60.42 -33.22 72.21 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 118.195 -1.402 . . . . 22.48 111.552 -175.131 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLN . . . . . 0.475 HE22 ' H ' ' A' ' 74' ' ' SER . 72.9 mt-30 -68.15 -32.31 72.5 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 117.775 -1.57 . . . . 21.02 110.771 -176.9 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -66.77 -47.03 73.42 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.658 1.183 . . . . 21.64 109.179 178.342 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ARG . . . . . 0.405 ' HD3' ' CD1' ' A' ' 19' ' ' LEU . 14.6 mtm180 -51.89 -47.57 64.51 Favored 'General case' 0 CA--C 1.491 -1.316 0 N-CA-C 107.727 -1.212 . . . . 40.6 107.727 174.111 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . 0.351 84.1 p -80.6 -17.27 51.87 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 114.777 -2.769 . . . . 20.39 115.203 -179.038 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 32.4 mtt -59.47 -43.4 93.23 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 119.111 -1.035 . . . . 21.11 112.198 165.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 34.3 mt -61.02 -47.78 92.06 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.81 0 C-N-CA 123.824 0.849 . . . . 21.19 110.363 178.488 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.6 mttm -59.25 -30.35 68.21 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-N 118.338 0.517 . . . . 40.47 111.563 176.616 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' CYS . . . . . 1.159 ' CB ' ' SG ' ' A' ' 77' ' ' CYS . 13.4 t -68.17 -47.05 69.03 Favored 'General case' 0 C--O 1.252 1.219 0 C-N-CA 122.591 0.356 . . . . 22.87 110.538 179.809 169.441 103.062 86.63 104.233 1.079 139.084 99.42 -168.973 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -80.72 -37.6 30.3 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 115.783 -0.644 . . . . 24.66 110.281 -173.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.8 mt -117.0 83.27 14.53 Favored Pre-proline 0 CA--C 1.547 0.851 0 C-N-CA 123.551 0.741 . . . . 26.62 110.142 173.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_exo -51.69 -42.88 54.41 Favored 'Trans proline' 0 C--N 1.353 0.776 0 N-CA-C 116.54 1.708 . . . . 28.1 116.54 -177.514 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -79.05 42.02 2.28 Favored Glycine 0 N--CA 1.473 1.157 0 C-N-CA 120.226 -0.988 . . . . 32.44 115.082 -178.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -135.66 151.1 49.87 Favored 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 118.955 2.946 . . . . 34.07 118.955 -166.169 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' HIS . . . . . 0.467 ' C ' ' CD2' ' A' ' 17' ' ' HIS . 7.4 t-160 -122.05 93.92 48.35 Favored Pre-proline 0 N--CA 1.434 -1.265 0 N-CA-C 107.576 -1.268 . . . . 47.31 107.576 178.596 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_exo -54.75 -58.56 1.17 Allowed 'Trans proline' 0 CA--C 1.549 1.234 0 C-N-CA 123.559 2.839 . . . . 36.49 115.412 -170.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' LEU . . . . . 0.559 ' CD1' ' H ' ' A' ' 19' ' ' LEU . 0.0 OUTLIER -44.51 -48.88 10.17 Favored 'General case' 0 C--N 1.288 -2.076 0 C-N-CA 126.891 2.076 . . . . 42.17 108.438 -177.955 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 1.6 ttt -75.15 -36.0 61.58 Favored 'General case' 1 C--N 1.448 4.876 0 C-N-CA 125.624 1.57 . . . . 43.05 114.582 -179.374 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 65.5 m-20 -81.86 -50.24 9.43 Favored 'General case' 0 C--O 1.248 1.013 0 N-CA-C 113.53 0.937 . . . . 35.58 113.53 -176.161 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -108.36 9.63 27.74 Favored 'General case' 0 C--O 1.202 -1.414 0 N-CA-C 116.439 2.014 . . . . 31.35 116.439 -170.57 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 38.3 t30 -101.29 137.11 40.07 Favored 'General case' 0 C--O 1.245 0.843 0 N-CA-C 106.608 -1.627 . . . . 32.05 106.608 173.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 8.3 m-20 46.96 62.23 2.47 Favored 'General case' 0 C--O 1.242 0.702 0 CA-C-O 122.566 1.174 . . . . 38.73 110.806 -168.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' TYR . . . . . 0.569 ' O ' ' HB2' ' A' ' 29' ' ' CYS . 48.0 t80 -116.45 127.66 54.79 Favored 'General case' 0 C--O 1.25 1.082 0 CA-C-N 113.244 -1.798 . . . . 24.91 106.774 166.534 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 54.76 -149.59 19.96 Favored Glycine 0 N--CA 1.442 -0.965 0 N-CA-C 111.363 -0.695 . . . . 19.73 111.363 176.468 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 79.3 m -92.65 -20.05 21.25 Favored 'General case' 0 C--O 1.262 1.747 0 N-CA-C 113.772 1.027 . . . . 15.86 113.772 -169.044 -60.552 -57.563 -82.008 101.773 2.023 102.074 -73.362 -62.13 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' TYR . . . . . 0.535 ' O ' ' HB3' ' A' ' 45' ' ' CYS . 71.9 m-85 -130.49 3.81 4.64 Favored 'General case' 0 N--CA 1.501 2.078 0 N-CA-C 116.779 2.14 . . . . 14.96 116.779 -172.352 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' CYS . . . . . 0.569 ' HB2' ' O ' ' A' ' 25' ' ' TYR . 87.9 m -95.05 87.49 4.93 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 108.169 -1.049 . . . . 20.83 108.169 175.695 -67.968 -45.245 95.078 105.191 2.05 107.542 150.68 -76.279 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 144.38 179.43 20.83 Favored Glycine 0 C--O 1.255 1.439 0 N-CA-C 107.444 -2.262 . . . . 23.44 107.444 -174.584 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 59.5 tp -57.92 130.9 48.62 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 119.413 -0.915 . . . . 26.06 110.597 -172.825 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 59.1 -141.5 47.18 Favored Glycine 0 C--N 1.347 1.191 0 O-C-N 125.227 1.579 . . . . 22.55 111.11 -175.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 165.68 157.09 9.7 Favored Glycine 0 N--CA 1.467 0.708 0 N-CA-C 107.554 -2.218 . . . . 19.2 107.554 -179.414 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.2 p -148.58 161.32 41.92 Favored 'General case' 0 C--O 1.205 -1.256 0 CA-C-N 117.676 0.738 . . . . 12.51 111.365 172.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 69.71 -157.42 53.5 Favored Glycine 0 CA--C 1.532 1.15 0 N-CA-C 115.673 1.029 . . . . 10.0 115.673 171.689 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 99.1 m -97.6 137.89 21.07 Favored Pre-proline 0 C--O 1.196 -1.753 0 N-CA-C 108.566 -0.901 . . . . 10.0 108.566 179.583 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -58.98 147.16 91.29 Favored 'Trans proline' 0 C--O 1.246 0.912 0 C-N-CA 114.756 -3.029 . . . . 12.99 113.152 177.137 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 18.2 m -82.46 -5.23 8.75 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 N-CA-C 116.001 1.852 . . . . 17.62 116.001 -176.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ASP . . . . . 1.02 ' HA ' ' O ' ' A' ' 507' ' ' HOH 0.295 0.7 OUTLIER -158.73 164.42 35.9 Favored 'General case' 1 C--N 1.432 4.173 0 C-N-CA 125.786 1.634 . . . . 30.73 114.999 -152.404 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.78 -49.3 71.28 Favored 'General case' 0 C--N 1.275 -2.632 0 C-N-CA 116.116 -2.233 . . . . 30.72 109.048 159.825 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.41 -62.32 1.73 Allowed 'General case' 0 CA--C 1.554 1.115 0 N-CA-C 108.69 -0.855 . . . . 19.74 108.69 -177.846 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ASP . . . . . 0.626 ' H ' ' HB3' ' A' ' 39' ' ' ASP . 37.0 t0 -51.89 -32.67 33.5 Favored 'General case' 0 C--O 1.268 2.065 0 O-C-N 121.264 -0.897 . . . . 18.74 112.035 178.94 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ARG . . . . . 0.507 ' HB2' ' O ' ' A' ' 39' ' ' ASP . 0.0 OUTLIER -63.6 -44.79 92.96 Favored 'General case' 0 C--O 1.247 0.953 0 N-CA-C 108.555 -0.905 . . . . 42.58 108.555 175.481 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 82.0 m -55.06 -36.3 65.43 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 119.465 -0.894 . . . . 17.22 110.423 179.362 -60.144 -78.191 -73.759 101.066 1.995 104.545 -85.979 -156.407 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' CYS . . . . . 0.535 ' HB3' ' O ' ' A' ' 28' ' ' TYR . 51.4 m -73.77 -38.47 64.66 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 124.204 0.94 . . . . 21.26 111.18 -178.117 -76.279 150.68 95.078 107.542 2.05 105.191 -45.245 -67.968 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -63.44 -47.02 83.61 Favored 'General case' 0 C--O 1.262 1.75 0 O-C-N 123.749 0.655 . . . . 20.57 110.612 177.027 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 63.5 m -56.78 -38.83 73.04 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 116.019 -0.537 . . . . 18.06 112.048 175.138 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 29.7 t-80 -67.02 -48.24 68.97 Favored 'General case' 0 C--O 1.256 1.435 0 N-CA-C 107.381 -1.34 . . . . 23.14 107.381 179.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -52.03 -43.97 63.98 Favored 'General case' 0 N--CA 1.428 -1.551 0 N-CA-C 108.302 -0.999 . . . . 20.08 108.302 175.603 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 62.9 m-20 -75.04 -32.17 61.49 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 119.701 -0.8 . . . . 30.76 109.909 -175.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 7.1 t -61.35 -35.16 76.65 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 116.24 -0.437 . . . . 19.41 110.199 176.929 -160.803 -96.728 -78.322 106.499 2.055 102.677 -64.214 -61.099 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' TYR . . . . . 0.492 ' CD2' ' HB2' ' A' ' 68' ' ' PRO . 3.9 m-85 -79.43 -23.68 43.01 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 109.219 -0.66 . . . . 21.08 109.219 -177.195 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -69.74 -44.42 70.3 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.7 -0.682 . . . . 48.27 109.792 175.196 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -62.09 -51.43 67.95 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 115.526 1.676 . . . . 29.52 115.526 178.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ALA . . . . . 0.909 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -50.26 -53.2 30.09 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.279 1.031 . . . . 28.09 111.888 169.581 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 13.8 mtmm -48.23 -42.85 31.46 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 106.146 -1.798 . . . . 35.82 106.146 175.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -88.05 27.84 1.14 Allowed 'General case' 0 N--CA 1.497 1.914 0 N-CA-C 118.029 2.603 . . . . 39.27 118.029 -174.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' LEU . . . . . 0.909 HD12 ' HA ' ' A' ' 55' ' ' ALA . 4.1 mt -106.37 124.17 49.18 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 107.182 -1.414 . . . . 42.17 107.182 175.468 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.86 -28.49 69.89 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-N 120.109 1.322 . . . . 43.07 111.105 -170.355 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.32 -22.27 61.2 Favored 'General case' 0 C--O 1.245 0.841 0 O-C-N 124.159 0.912 . . . . 37.76 111.875 -169.386 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 64.7 m -102.97 122.39 44.49 Favored 'General case' 0 C--O 1.219 -0.515 0 C-N-CA 124.555 1.142 . . . . 34.9 112.63 -173.211 -57.505 -62.428 -96.443 103.852 2.019 103.201 -78.043 -53.769 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' LYS . . . . . 0.411 ' C ' ' HD3' ' A' ' 62' ' ' LYS . 2.2 tmtm? -125.57 89.14 2.99 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 108.427 -0.953 . . . . 42.2 108.427 174.675 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 68.0 m-85 -67.22 151.74 46.98 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 116.452 2.019 . . . . 27.72 116.452 -179.199 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' LEU . . . . . 0.853 ' HB3' HG21 ' A' ' 70' ' ' THR . 9.3 tp -64.39 127.84 33.21 Favored 'General case' 0 C--O 1.235 0.322 0 O-C-N 123.957 0.786 . . . . 25.43 109.176 -179.922 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER 65.38 2.49 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 0.984 0 N-CA-C 107.806 -1.183 . . . . 28.11 107.806 171.41 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ASP . . . . . 0.59 ' H ' ' C ' ' A' ' 64' ' ' LEU . 0.6 OUTLIER 81.04 26.82 0.22 Allowed 'General case' 0 CA--C 1.472 -2.024 0 CA-C-N 112.6 -2.091 . . . . 41.77 114.1 168.824 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ASN . . . . . 0.648 ' O ' ' HB ' ' A' ' 70' ' ' THR . 61.0 t-20 -128.59 112.52 19.24 Favored Pre-proline 0 N--CA 1.419 -1.976 0 N-CA-C 102.758 -3.053 . . . . 29.97 102.758 -167.711 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' PRO . . . . . 0.492 ' HB2' ' CD2' ' A' ' 52' ' ' TYR . 81.6 Cg_exo -53.84 -24.95 33.05 Favored 'Trans proline' 0 CA--C 1.502 -1.095 0 C-N-CA 121.978 1.785 . . . . 24.59 111.551 175.977 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' TYR . . . . . 0.517 ' O ' ' HA ' ' A' ' 1' ' ' ALA . 3.0 m-85 -62.84 -16.88 60.26 Favored 'General case' 0 C--O 1.262 1.758 0 N-CA-C 114.636 1.347 . . . . 42.5 114.636 -178.565 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' THR . . . . . 0.853 HG21 ' HB3' ' A' ' 64' ' ' LEU 0.28 0.9 OUTLIER -81.57 -7.29 59.57 Favored 'General case' 0 N--CA 1.433 -1.276 0 CA-C-N 112.64 -2.073 . . . . 16.68 109.098 -176.086 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -105.32 111.43 24.17 Favored 'General case' 0 N--CA 1.433 -1.295 0 O-C-N 121.115 -0.991 . . . . 23.39 108.533 -164.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.7 m -82.43 142.94 31.53 Favored 'General case' 0 CA--C 1.504 -0.789 0 C-N-CA 124.646 1.178 . . . . 14.86 108.957 -179.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' TYR . . . . . 1.098 ' O ' ' HB3' ' A' ' 74' ' ' SER . 2.7 p90 -131.67 -22.35 2.41 Favored 'General case' 0 C--O 1.265 1.9 0 N-CA-C 116.038 1.866 . . . . 19.7 116.038 -174.109 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 74' ' ' SER . . . . . 1.098 ' HB3' ' O ' ' A' ' 73' ' ' TYR . 22.7 t 77.57 94.77 0.06 Allowed 'General case' 0 C--N 1.271 -2.826 2 C-N-CA 107.799 -5.56 . . . . 22.62 118.327 -170.68 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 3.8 p90 -130.11 171.28 13.01 Favored 'General case' 0 C--O 1.188 -2.136 0 CA-C-N 111.306 -2.679 . . . . 24.25 114.866 166.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 78.9 p -129.94 151.74 50.17 Favored 'General case' 0 C--O 1.201 -1.491 0 N-CA-C 115.419 1.637 . . . . 19.82 115.419 170.056 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' CYS . . . . . 1.159 ' SG ' ' CB ' ' A' ' 11' ' ' CYS . 22.6 t -132.21 101.63 5.46 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 121.607 -0.683 . . . . 22.53 112.161 -175.857 -168.973 99.42 86.63 139.084 1.079 104.233 103.062 169.441 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' SER . . . . . 0.965 ' O ' ' ND2' ' A' ' 79' ' ' ASN . 40.6 t -107.32 98.84 8.42 Favored 'General case' 0 C--O 1.251 1.135 0 CA-C-O 122.676 1.227 . . . . 28.1 112.706 176.651 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ASN . . . . . 0.965 ' ND2' ' O ' ' A' ' 78' ' ' SER . 0.5 OUTLIER 54.96 65.19 1.57 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.722 -1.126 . . . . 25.16 113.631 174.227 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 80' ' ' THR . . . . . 0.97 HG22 ' O ' ' A' ' 80' ' ' THR . 7.8 m 70.64 27.24 3.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.167 -0.469 . . . . 23.16 112.154 176.064 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 41.6 mm-40 -132.6 108.89 9.36 Favored 'General case' 0 CA--C 1.504 -0.809 0 N-CA-C 105.363 -2.088 . . . . 36.51 105.363 178.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 43.2 mt -82.42 138.21 19.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 C-N-CA 119.078 -1.049 . . . . 18.45 109.531 175.56 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 30.0 m -129.3 120.33 25.46 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 121.439 -0.788 . . . . 18.41 110.424 173.348 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 62.6 m -83.28 116.47 22.44 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-O 122.214 1.007 . . . . 15.85 108.985 173.547 -73.586 -76.364 -98.75 102.774 2.059 104.744 -90.882 -167.177 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -44.87 133.55 6.16 Favored 'General case' 0 CA--C 1.491 -1.311 0 CA-C-N 115.349 -0.841 . . . . 18.1 111.269 172.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 45.4 p -76.44 -19.95 57.55 Favored 'General case' 0 CA--C 1.547 0.863 0 O-C-N 124.957 1.41 . . . . 14.42 109.278 -176.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt -84.11 2.21 40.52 Favored 'General case' 0 N--CA 1.425 -1.678 0 CA-C-N 115.34 -0.845 . . . . 23.67 111.738 178.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ASN . . . . . 0.547 ' OD1' ' O ' ' A' ' 73' ' ' TYR . 94.1 m-20 -56.31 138.17 51.17 Favored 'General case' 0 C--O 1.209 -1.043 0 O-C-N 120.687 -1.258 . . . . 12.91 110.352 163.547 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 15.1 p30 -66.42 168.07 9.57 Favored 'General case' 0 N--CA 1.484 1.238 0 CA-C-N 120.108 1.322 . . . . 13.06 108.438 170.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -53.13 -43.03 66.61 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.785 1.032 . . . . 13.9 113.785 -174.085 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 56.1 m -71.53 -44.86 63.83 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-N 118.374 0.534 . . . . 19.96 112.012 -177.379 -53.769 -78.043 -96.443 103.201 2.019 103.852 -62.428 -57.505 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 82.2 mt-10 -56.9 -46.0 82.25 Favored 'General case' 0 C--O 1.255 1.359 0 C-N-CA 123.59 0.756 . . . . 14.39 112.356 171.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -58.74 -40.48 83.94 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 120.818 -0.353 . . . . 14.08 111.536 176.245 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -67.88 -53.26 27.99 Favored 'General case' 0 CA--C 1.491 -1.292 0 N-CA-C 107.416 -1.327 . . . . 20.88 107.416 -178.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ILE . . . . . 0.471 ' CD1' ' HB3' ' A' ' 68' ' ' PRO . 11.3 mm -52.83 -54.84 14.4 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 C-N-CA 119.074 -1.05 . . . . 16.51 108.49 175.273 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 16.2 t -43.82 -53.48 5.96 Favored 'General case' 0 CA--C 1.565 1.54 0 CA-C-N 118.872 0.76 . . . . 17.59 112.501 -179.891 -167.177 -90.882 -98.75 104.744 2.059 102.774 -76.364 -73.586 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 74.1 m-20 -63.54 -30.18 71.33 Favored 'General case' 0 N--CA 1.444 -0.728 0 N-CA-C 114.902 1.445 . . . . 29.41 114.902 -178.945 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 76.4 m -61.01 -48.29 82.51 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 118.451 -1.3 . . . . 18.15 109.015 171.06 -61.099 -64.214 -78.322 102.677 2.055 106.499 -96.728 -160.803 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 -65.47 -45.83 82.15 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 108.009 -1.108 . . . . 17.29 108.009 -174.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ARG . . . . . 0.877 ' HG3' HH11 ' A' ' 100' ' ' ARG . 0.0 OUTLIER -64.2 -49.02 73.65 Favored 'General case' 0 C--O 1.193 -1.88 0 N-CA-C 113.0 0.741 . . . . 28.62 113.0 -175.135 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 96.7 m-20 -55.55 -39.15 70.25 Favored 'General case' 0 C--N 1.312 -1.053 0 C-N-CA 123.405 0.682 . . . . 19.13 111.183 173.242 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -70.63 -41.61 71.96 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 118.214 -1.395 . . . . 17.14 109.884 178.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.75 -43.5 93.13 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 119.28 0.945 . . . . 18.31 111.53 177.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 32.8 mt -57.39 -47.49 84.6 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 N-CA-C 106.423 -1.695 . . . . 17.15 106.423 176.097 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 4.4 t -55.54 -53.54 55.13 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.505 1.122 . . . . 15.71 113.241 178.389 -156.407 -85.979 -73.759 104.545 1.995 101.066 -78.191 -60.144 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -56.1 -41.27 74.96 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-O 119.122 -0.466 . . . . 15.78 110.355 177.014 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 60.6 p -57.2 -24.49 54.85 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 120.093 -0.643 . . . . 17.68 112.685 -176.069 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 20.0 mttp -112.09 -10.64 13.88 Favored 'General case' 0 C--O 1.205 -1.245 0 N-CA-C 114.112 1.153 . . . . 24.46 114.112 -171.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -74.89 147.61 84.07 Favored Pre-proline 0 C--O 1.254 1.318 0 CA-C-N 119.085 0.857 . . . . 20.3 110.029 171.041 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_endo -69.84 141.65 45.49 Favored 'Trans proline' 0 N--CA 1.449 -1.128 0 N-CA-C 108.113 -1.534 . . . . 22.95 108.113 167.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -100.5 121.62 41.86 Favored 'General case' 0 CA--C 1.475 -1.927 0 N-CA-C 106.191 -1.781 . . . . 22.44 106.191 176.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 -109.27 117.54 34.36 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 109.101 -0.703 . . . . 24.04 109.101 177.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 1.3 mtpm? -56.43 -41.8 77.01 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.118 -0.633 . . . . 31.61 109.633 -177.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 6.0 mp0 -40.31 -34.24 0.31 Allowed 'General case' 0 C--O 1.249 1.038 0 N-CA-C 117.956 2.576 . . . . 38.41 117.956 178.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 35.7 m170 -99.78 4.27 45.26 Favored 'General case' 0 C--O 1.245 0.853 0 N-CA-C 116.991 2.219 . . . . 28.32 116.991 -172.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.48 137.49 48.24 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 104.549 -2.389 . . . . 29.45 104.549 173.85 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 117' ' ' ASN . . . . . . . . . . . . . 37.9 m-20 45.49 56.48 5.7 Favored 'General case' 0 C--O 1.257 1.467 0 CA-C-N 118.978 0.808 . . . . 32.34 112.221 -178.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.75 150.38 46.98 Favored 'General case' 0 C--O 1.251 1.147 0 N-CA-C 107.193 -1.41 . . . . 26.68 107.193 177.771 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -73.05 92.4 1.67 Allowed 'General case' 0 C--O 1.196 -1.745 0 N-CA-C 107.315 -1.365 . . . . 26.9 107.315 168.326 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 35.8 p -61.2 -30.59 70.52 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 115.47 1.656 . . . . 26.29 115.47 -179.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.08 -8.31 59.65 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 117.1 -1.84 . . . . 36.43 113.891 -176.052 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 1.3 tttm -98.09 -42.43 7.47 Favored 'General case' 0 C--O 1.216 -0.684 0 CA-C-N 115.3 -0.863 . . . . 27.1 110.694 172.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -113.68 1.55 14.93 Favored 'General case' 0 C--O 1.255 1.349 0 N-CA-C 117.274 2.324 . . . . 31.3 117.274 -164.089 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 72.0 m . . . . . 0 CA--C 1.494 -1.195 0 CA-C-O 124.808 2.242 . . . . 17.8 109.476 -172.999 -62.13 -73.362 -82.008 102.074 2.023 101.773 -57.563 -60.552 0 0 . 1 . 001 ecloud build full ' A' A ' 500' ' ' MCW . . . . . 0.81 ' H7 ' ' O ' ' A' ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 507' ' ' HOH . . . . . 1.02 ' O ' ' HA ' ' A' ' 39' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 516' ' ' HOH . . . . . 0.629 ' O ' ' HA ' ' A' ' 74' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 521' ' ' HOH . . . . . 0.732 ' O ' ' HD3' ' A' ' 100' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 534' ' ' HOH . . . . . 0.81 ' O ' ' H7 ' ' A' ' 500' ' ' MCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' ALA . . . . . 0.517 ' HA ' ' O ' ' A' ' 69' ' ' TYR . . . . . . . . 0 N--CA 1.503 2.175 0 N-CA-C 108.771 -0.825 . . . . 17.33 108.771 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 16.4 tp -32.59 -60.13 0.3 Allowed 'General case' 0 C--O 1.242 0.664 0 O-C-N 124.345 1.028 . . . . 22.13 113.563 -179.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' TRP . . . . . . . . . . . . . 46.8 p-90 -60.42 -33.22 72.21 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 118.195 -1.402 . . . . 22.48 111.552 -175.131 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.475 HE22 ' H ' ' A' ' 74' ' ' SER . 72.9 mt-30 -68.15 -32.31 72.5 Favored 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 117.775 -1.57 . . . . 21.02 110.771 -176.9 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 8.3 t80 -66.77 -47.03 73.42 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.658 1.183 . . . . 21.64 109.179 178.342 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.405 ' HD3' ' CD1' ' A' ' 19' ' ' LEU . 14.6 mtm180 -51.89 -47.57 64.51 Favored 'General case' 0 CA--C 1.491 -1.316 0 N-CA-C 107.727 -1.212 . . . . 40.6 107.727 174.111 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . 0.351 84.1 p -80.6 -17.27 51.87 Favored 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 114.777 -2.769 . . . . 20.39 115.203 -179.038 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' MET . . . . . . . . . . . . . 32.4 mtt -59.47 -43.4 93.23 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 119.111 -1.035 . . . . 21.11 112.198 165.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ILE . . . . . . . . . . . . . 34.3 mt -61.02 -47.78 92.06 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.81 0 C-N-CA 123.824 0.849 . . . . 21.19 110.363 178.488 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.6 mttm -59.25 -30.35 68.21 Favored 'General case' 0 N--CA 1.481 1.12 0 CA-C-N 118.338 0.517 . . . . 40.47 111.563 176.616 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' CYS . . . . . 1.159 ' CB ' ' SG ' ' A' ' 77' ' ' CYS . 13.4 t -68.17 -47.05 69.03 Favored 'General case' 0 C--O 1.252 1.219 0 C-N-CA 122.591 0.356 . . . . 22.87 110.538 179.809 169.441 103.062 86.63 104.233 1.079 139.084 99.42 -168.973 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -80.72 -37.6 30.3 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 115.783 -0.644 . . . . 24.66 110.281 -173.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 3.8 mt -117.0 83.27 14.53 Favored Pre-proline 0 CA--C 1.547 0.851 0 C-N-CA 123.551 0.741 . . . . 26.62 110.142 173.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_exo -51.69 -42.88 54.41 Favored 'Trans proline' 0 C--N 1.353 0.776 0 N-CA-C 116.54 1.708 . . . . 28.1 116.54 -177.514 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -79.05 42.02 2.28 Favored Glycine 0 N--CA 1.473 1.157 0 C-N-CA 120.226 -0.988 . . . . 32.44 115.082 -178.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -135.66 151.1 49.87 Favored 'General case' 0 N--CA 1.482 1.163 0 N-CA-C 118.955 2.946 . . . . 34.07 118.955 -166.169 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' HIS . . . . . 0.638 ' HE1' HD22 ' A' ' 19' ' ' LEU . 0.3 OUTLIER -122.05 93.92 48.35 Favored Pre-proline 0 N--CA 1.434 -1.265 0 N-CA-C 107.576 -1.268 . . . . 47.31 107.576 178.596 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_exo -54.75 -58.56 1.17 Allowed 'Trans proline' 0 CA--C 1.549 1.234 0 C-N-CA 123.559 2.839 . . . . 36.49 115.412 -170.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.638 HD22 ' HE1' ' A' ' 17' ' ' HIS . 0.0 OUTLIER -44.51 -48.88 10.17 Favored 'General case' 0 C--N 1.288 -2.076 0 C-N-CA 126.891 2.076 . . . . 42.17 108.438 -177.955 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 1.6 ttt -75.15 -36.0 61.58 Favored 'General case' 1 C--N 1.448 4.876 0 C-N-CA 125.624 1.57 . . . . 43.05 114.582 -179.374 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 65.5 m-20 -81.86 -50.24 9.43 Favored 'General case' 0 C--O 1.248 1.013 0 N-CA-C 113.53 0.937 . . . . 35.58 113.53 -176.161 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' PHE . . . . . . . . . . . . . 33.9 m-85 -108.36 9.63 27.74 Favored 'General case' 0 C--O 1.202 -1.414 0 N-CA-C 116.439 2.014 . . . . 31.35 116.439 -170.57 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 38.3 t30 -101.29 137.11 40.07 Favored 'General case' 0 C--O 1.245 0.843 0 N-CA-C 106.608 -1.627 . . . . 32.05 106.608 173.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ASN . . . . . 0.456 HD22 ' N ' ' A' ' 24' ' ' ASN . 1.4 m120 46.96 62.23 2.47 Favored 'General case' 0 C--O 1.242 0.702 0 CA-C-O 122.566 1.174 . . . . 38.73 110.806 -168.948 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' TYR . . . . . 0.569 ' O ' ' HB2' ' A' ' 29' ' ' CYS . 48.0 t80 -116.45 127.66 54.79 Favored 'General case' 0 C--O 1.25 1.082 0 CA-C-N 113.244 -1.798 . . . . 24.91 106.774 166.534 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 54.76 -149.59 19.96 Favored Glycine 0 N--CA 1.442 -0.965 0 N-CA-C 111.363 -0.695 . . . . 19.73 111.363 176.468 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' CYS . . . . . . . . . . . . . 79.3 m -92.65 -20.05 21.25 Favored 'General case' 0 C--O 1.262 1.747 0 N-CA-C 113.772 1.027 . . . . 15.86 113.772 -169.044 -60.552 -57.563 -82.008 101.773 2.023 102.074 -73.362 -62.13 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' TYR . . . . . 0.535 ' O ' ' HB3' ' A' ' 45' ' ' CYS . 71.9 m-85 -130.49 3.81 4.64 Favored 'General case' 0 N--CA 1.501 2.078 0 N-CA-C 116.779 2.14 . . . . 14.96 116.779 -172.352 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.569 ' HB2' ' O ' ' A' ' 25' ' ' TYR . 87.9 m -95.05 87.49 4.93 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 108.169 -1.049 . . . . 20.83 108.169 175.695 -67.968 -45.245 95.078 105.191 2.05 107.542 150.68 -76.279 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLY . . . . . . . . . . . . . . . 144.38 179.43 20.83 Favored Glycine 0 C--O 1.255 1.439 0 N-CA-C 107.444 -2.262 . . . . 23.44 107.444 -174.584 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 59.5 tp -57.92 130.9 48.62 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 119.413 -0.915 . . . . 26.06 110.597 -172.825 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 59.1 -141.5 47.18 Favored Glycine 0 C--N 1.347 1.191 0 O-C-N 125.227 1.579 . . . . 22.55 111.11 -175.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 165.68 157.09 9.7 Favored Glycine 0 N--CA 1.467 0.708 0 N-CA-C 107.554 -2.218 . . . . 19.2 107.554 -179.414 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 46.2 p -148.58 161.32 41.92 Favored 'General case' 0 C--O 1.205 -1.256 0 CA-C-N 117.676 0.738 . . . . 12.51 111.365 172.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 69.71 -157.42 53.5 Favored Glycine 0 CA--C 1.532 1.15 0 N-CA-C 115.673 1.029 . . . . 10.0 115.673 171.689 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' THR . . . . . . . . . . . . . 99.1 m -97.6 137.89 21.07 Favored Pre-proline 0 C--O 1.196 -1.753 0 N-CA-C 108.566 -0.901 . . . . 10.0 108.566 179.583 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -58.98 147.16 91.29 Favored 'Trans proline' 0 C--O 1.246 0.912 0 C-N-CA 114.756 -3.029 . . . . 12.99 113.152 177.137 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 18.2 m -82.46 -5.23 8.75 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 N-CA-C 116.001 1.852 . . . . 17.62 116.001 -176.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ASP . . . . . 1.02 ' HA ' ' O ' ' A' ' 507' ' ' HOH 0.295 0.7 OUTLIER -158.73 164.42 35.9 Favored 'General case' 1 C--N 1.432 4.173 0 C-N-CA 125.786 1.634 . . . . 30.73 114.999 -152.404 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -64.78 -49.3 71.28 Favored 'General case' 0 C--N 1.275 -2.632 0 C-N-CA 116.116 -2.233 . . . . 30.72 109.048 159.825 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -53.41 -62.32 1.73 Allowed 'General case' 0 CA--C 1.554 1.115 0 N-CA-C 108.69 -0.855 . . . . 19.74 108.69 -177.846 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ASP . . . . . 0.626 ' H ' ' HB3' ' A' ' 39' ' ' ASP . 37.0 t0 -51.89 -32.67 33.5 Favored 'General case' 0 C--O 1.268 2.065 0 O-C-N 121.264 -0.897 . . . . 18.74 112.035 178.94 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.507 ' HB2' ' O ' ' A' ' 39' ' ' ASP . 0.0 OUTLIER -63.6 -44.79 92.96 Favored 'General case' 0 C--O 1.247 0.953 0 N-CA-C 108.555 -0.905 . . . . 42.58 108.555 175.481 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 82.0 m -55.06 -36.3 65.43 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 119.465 -0.894 . . . . 17.22 110.423 179.362 -60.144 -78.191 -73.759 101.066 1.995 104.545 -85.979 -156.407 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' CYS . . . . . 0.535 ' HB3' ' O ' ' A' ' 28' ' ' TYR . 51.4 m -73.77 -38.47 64.66 Favored 'General case' 0 N--CA 1.477 0.907 0 O-C-N 124.204 0.94 . . . . 21.26 111.18 -178.117 -76.279 150.68 95.078 107.542 2.05 105.191 -45.245 -67.968 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.1 tt0 -63.44 -47.02 83.61 Favored 'General case' 0 C--O 1.262 1.75 0 O-C-N 123.749 0.655 . . . . 20.57 110.612 177.027 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 63.5 m -56.78 -38.83 73.04 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-N 116.019 -0.537 . . . . 18.06 112.048 175.138 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 29.7 t-80 -67.02 -48.24 68.97 Favored 'General case' 0 C--O 1.256 1.435 0 N-CA-C 107.381 -1.34 . . . . 23.14 107.381 179.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -52.03 -43.97 63.98 Favored 'General case' 0 N--CA 1.428 -1.551 0 N-CA-C 108.302 -0.999 . . . . 20.08 108.302 175.603 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ASN . . . . . . . . . . . . . 62.9 m-20 -75.04 -32.17 61.49 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 119.701 -0.8 . . . . 30.76 109.909 -175.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 7.1 t -61.35 -35.16 76.65 Favored 'General case' 0 N--CA 1.429 -1.493 0 CA-C-N 116.24 -0.437 . . . . 19.41 110.199 176.929 -160.803 -96.728 -78.322 106.499 2.055 102.677 -64.214 -61.099 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' TYR . . . . . 0.492 ' CD2' ' HB2' ' A' ' 68' ' ' PRO . 3.9 m-85 -79.43 -23.68 43.01 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 109.219 -0.66 . . . . 21.08 109.219 -177.195 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -69.74 -44.42 70.3 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-N 115.7 -0.682 . . . . 48.27 109.792 175.196 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -62.09 -51.43 67.95 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 115.526 1.676 . . . . 29.52 115.526 178.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.909 ' HA ' HD12 ' A' ' 58' ' ' LEU . . . -50.26 -53.2 30.09 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.279 1.031 . . . . 28.09 111.888 169.581 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 13.8 mtmm -48.23 -42.85 31.46 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 106.146 -1.798 . . . . 35.82 106.146 175.469 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -88.05 27.84 1.14 Allowed 'General case' 0 N--CA 1.497 1.914 0 N-CA-C 118.029 2.603 . . . . 39.27 118.029 -174.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.909 HD12 ' HA ' ' A' ' 55' ' ' ALA . 4.1 mt -106.37 124.17 49.18 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 107.182 -1.414 . . . . 42.17 107.182 175.468 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -63.86 -28.49 69.89 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-N 120.109 1.322 . . . . 43.07 111.105 -170.355 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -72.32 -22.27 61.2 Favored 'General case' 0 C--O 1.245 0.841 0 O-C-N 124.159 0.912 . . . . 37.76 111.875 -169.386 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' CYS . . . . . . . . . . . . . 64.7 m -102.97 122.39 44.49 Favored 'General case' 0 C--O 1.219 -0.515 0 C-N-CA 124.555 1.142 . . . . 34.9 112.63 -173.211 -57.505 -62.428 -96.443 103.852 2.019 103.201 -78.043 -53.769 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.411 ' C ' ' HD3' ' A' ' 62' ' ' LYS . 2.2 tmtm? -125.57 89.14 2.99 Favored 'General case' 0 N--CA 1.446 -0.66 0 N-CA-C 108.427 -0.953 . . . . 42.2 108.427 174.675 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 68.0 m-85 -67.22 151.74 46.98 Favored 'General case' 0 N--CA 1.481 1.111 0 N-CA-C 116.452 2.019 . . . . 27.72 116.452 -179.199 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' LEU . . . . . 0.853 ' HB3' HG21 ' A' ' 70' ' ' THR . 9.3 tp -64.39 127.84 33.21 Favored 'General case' 0 C--O 1.235 0.322 0 O-C-N 123.957 0.786 . . . . 25.43 109.176 -179.922 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER 65.38 2.49 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 0.984 0 N-CA-C 107.806 -1.183 . . . . 28.11 107.806 171.41 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ASP . . . . . 0.59 ' H ' ' C ' ' A' ' 64' ' ' LEU . 0.6 OUTLIER 81.04 26.82 0.22 Allowed 'General case' 0 CA--C 1.472 -2.024 0 CA-C-N 112.6 -2.091 . . . . 41.77 114.1 168.824 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ASN . . . . . 0.648 ' O ' ' HB ' ' A' ' 70' ' ' THR . 0.4 OUTLIER -128.59 112.52 19.24 Favored Pre-proline 0 N--CA 1.419 -1.976 0 N-CA-C 102.758 -3.053 . . . . 29.97 102.758 -167.711 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' PRO . . . . . 0.492 ' HB2' ' CD2' ' A' ' 52' ' ' TYR . 81.6 Cg_exo -53.84 -24.95 33.05 Favored 'Trans proline' 0 CA--C 1.502 -1.095 0 C-N-CA 121.978 1.785 . . . . 24.59 111.551 175.977 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' TYR . . . . . 0.56 ' HB2' ' ND2' ' A' ' 67' ' ' ASN . 3.0 m-85 -62.84 -16.88 60.26 Favored 'General case' 0 C--O 1.262 1.758 0 N-CA-C 114.636 1.347 . . . . 42.5 114.636 -178.565 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' THR . . . . . 0.853 HG21 ' HB3' ' A' ' 64' ' ' LEU 0.28 0.9 OUTLIER -81.57 -7.29 59.57 Favored 'General case' 0 N--CA 1.433 -1.276 0 CA-C-N 112.64 -2.073 . . . . 16.68 109.098 -176.086 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -105.32 111.43 24.17 Favored 'General case' 0 N--CA 1.433 -1.295 0 O-C-N 121.115 -0.991 . . . . 23.39 108.533 -164.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 5.7 m -82.43 142.94 31.53 Favored 'General case' 0 CA--C 1.504 -0.789 0 C-N-CA 124.646 1.178 . . . . 14.86 108.957 -179.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' TYR . . . . . 1.098 ' O ' ' HB3' ' A' ' 74' ' ' SER . 2.7 p90 -131.67 -22.35 2.41 Favored 'General case' 0 C--O 1.265 1.9 0 N-CA-C 116.038 1.866 . . . . 19.7 116.038 -174.109 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' SER . . . . . 1.098 ' HB3' ' O ' ' A' ' 73' ' ' TYR . 22.7 t 77.57 94.77 0.06 Allowed 'General case' 0 C--N 1.271 -2.826 2 C-N-CA 107.799 -5.56 . . . . 22.62 118.327 -170.68 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 3.8 p90 -130.11 171.28 13.01 Favored 'General case' 0 C--O 1.188 -2.136 0 CA-C-N 111.306 -2.679 . . . . 24.25 114.866 166.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 78.9 p -129.94 151.74 50.17 Favored 'General case' 0 C--O 1.201 -1.491 0 N-CA-C 115.419 1.637 . . . . 19.82 115.419 170.056 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' CYS . . . . . 1.159 ' SG ' ' CB ' ' A' ' 11' ' ' CYS . 22.6 t -132.21 101.63 5.46 Favored 'General case' 0 C--N 1.326 -0.417 0 O-C-N 121.607 -0.683 . . . . 22.53 112.161 -175.857 -168.973 99.42 86.63 139.084 1.079 104.233 103.062 169.441 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' SER . . . . . 0.965 ' O ' ' ND2' ' A' ' 79' ' ' ASN . 40.6 t -107.32 98.84 8.42 Favored 'General case' 0 C--O 1.251 1.135 0 CA-C-O 122.676 1.227 . . . . 28.1 112.706 176.651 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.965 ' ND2' ' O ' ' A' ' 78' ' ' SER . 0.5 OUTLIER 54.96 65.19 1.57 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 114.722 -1.126 . . . . 25.16 113.631 174.227 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' THR . . . . . 0.97 HG22 ' O ' ' A' ' 80' ' ' THR . 7.8 m 70.64 27.24 3.77 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.167 -0.469 . . . . 23.16 112.154 176.064 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 41.6 mm-40 -132.6 108.89 9.36 Favored 'General case' 0 CA--C 1.504 -0.809 0 N-CA-C 105.363 -2.088 . . . . 36.51 105.363 178.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ILE . . . . . . . . . . . . . 43.2 mt -82.42 138.21 19.8 Favored 'Isoleucine or valine' 0 C--N 1.319 -0.744 0 C-N-CA 119.078 -1.049 . . . . 18.45 109.531 175.56 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 30.0 m -129.3 120.33 25.46 Favored 'General case' 0 C--N 1.324 -0.539 0 O-C-N 121.439 -0.788 . . . . 18.41 110.424 173.348 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' CYS . . . . . . . . . . . . . 62.6 m -83.28 116.47 22.44 Favored 'General case' 0 C--O 1.24 0.581 0 CA-C-O 122.214 1.007 . . . . 15.85 108.985 173.547 -73.586 -76.364 -98.75 102.774 2.059 104.744 -90.882 -167.177 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ASN . . . . . . . . . . . . . 2.2 t-20 -44.87 133.55 6.16 Favored 'General case' 0 CA--C 1.491 -1.311 0 CA-C-N 115.349 -0.841 . . . . 18.1 111.269 172.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 45.4 p -76.44 -19.95 57.55 Favored 'General case' 0 CA--C 1.547 0.863 0 O-C-N 124.957 1.41 . . . . 14.42 109.278 -176.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 13.0 mtmt -84.11 2.21 40.52 Favored 'General case' 0 N--CA 1.425 -1.678 0 CA-C-N 115.34 -0.845 . . . . 23.67 111.738 178.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ASN . . . . . 0.665 ' ND2' ' O ' ' A' ' 73' ' ' TYR . 8.3 m120 -56.31 138.17 51.17 Favored 'General case' 0 C--O 1.209 -1.043 0 O-C-N 120.687 -1.258 . . . . 12.91 110.352 163.547 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 15.1 p30 -66.42 168.07 9.57 Favored 'General case' 0 N--CA 1.484 1.238 0 CA-C-N 120.108 1.322 . . . . 13.06 108.438 170.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -53.13 -43.03 66.61 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 113.785 1.032 . . . . 13.9 113.785 -174.085 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . 56.1 m -71.53 -44.86 63.83 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-N 118.374 0.534 . . . . 19.96 112.012 -177.379 -53.769 -78.043 -96.443 103.201 2.019 103.852 -62.428 -57.505 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 82.2 mt-10 -56.9 -46.0 82.25 Favored 'General case' 0 C--O 1.255 1.359 0 C-N-CA 123.59 0.756 . . . . 14.39 112.356 171.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ALA . . . . . . . . . . . . . . . -58.74 -40.48 83.94 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 120.818 -0.353 . . . . 14.08 111.536 176.245 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -67.88 -53.26 27.99 Favored 'General case' 0 CA--C 1.491 -1.292 0 N-CA-C 107.416 -1.327 . . . . 20.88 107.416 -178.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.471 ' CD1' ' HB3' ' A' ' 68' ' ' PRO . 11.3 mm -52.83 -54.84 14.4 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 C-N-CA 119.074 -1.05 . . . . 16.51 108.49 175.273 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' CYS . . . . . . . . . . . . . 16.2 t -43.82 -53.48 5.96 Favored 'General case' 0 CA--C 1.565 1.54 0 CA-C-N 118.872 0.76 . . . . 17.59 112.501 -179.891 -167.177 -90.882 -98.75 104.744 2.059 102.774 -76.364 -73.586 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 20.6 m120 -63.54 -30.18 71.33 Favored 'General case' 0 N--CA 1.444 -0.728 0 N-CA-C 114.902 1.445 . . . . 29.41 114.902 -178.945 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 76.4 m -61.01 -48.29 82.51 Favored 'General case' 0 C--O 1.215 -0.722 0 C-N-CA 118.451 -1.3 . . . . 18.15 109.015 171.06 -61.099 -64.214 -78.322 102.677 2.055 106.499 -96.728 -160.803 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 -65.47 -45.83 82.15 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 108.009 -1.108 . . . . 17.29 108.009 -174.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ARG . . . . . 0.877 ' HG3' HH11 ' A' ' 100' ' ' ARG . 0.0 OUTLIER -64.2 -49.02 73.65 Favored 'General case' 0 C--O 1.193 -1.88 0 N-CA-C 113.0 0.741 . . . . 28.62 113.0 -175.135 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ASN . . . . . . . . . . . . . 96.7 m-20 -55.55 -39.15 70.25 Favored 'General case' 0 C--N 1.312 -1.053 0 C-N-CA 123.405 0.682 . . . . 19.13 111.183 173.242 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ALA . . . . . . . . . . . . . . . -70.63 -41.61 71.96 Favored 'General case' 0 C--N 1.323 -0.568 0 C-N-CA 118.214 -1.395 . . . . 17.14 109.884 178.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ALA . . . . . . . . . . . . . . . -64.75 -43.5 93.13 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 119.28 0.945 . . . . 18.31 111.53 177.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 32.8 mt -57.39 -47.49 84.6 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 N-CA-C 106.423 -1.695 . . . . 17.15 106.423 176.097 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' CYS . . . . . . . . . . . . . 4.4 t -55.54 -53.54 55.13 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.505 1.122 . . . . 15.71 113.241 178.389 -156.407 -85.979 -73.759 104.545 1.995 101.066 -78.191 -60.144 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 9.9 m-30 -56.1 -41.27 74.96 Favored 'General case' 0 C--O 1.225 -0.215 0 CA-C-O 119.122 -0.466 . . . . 15.78 110.355 177.014 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 60.6 p -57.2 -24.49 54.85 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 120.093 -0.643 . . . . 17.68 112.685 -176.069 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 20.0 mttp -112.09 -10.64 13.88 Favored 'General case' 0 C--O 1.205 -1.245 0 N-CA-C 114.112 1.153 . . . . 24.46 114.112 -171.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ALA . . . . . . . . . . . . . . . -74.89 147.61 84.07 Favored Pre-proline 0 C--O 1.254 1.318 0 CA-C-N 119.085 0.857 . . . . 20.3 110.029 171.041 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' PRO . . . . . . . . . . . . . 3.3 Cg_endo -69.84 141.65 45.49 Favored 'Trans proline' 0 N--CA 1.449 -1.128 0 N-CA-C 108.113 -1.534 . . . . 22.95 108.113 167.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' TYR . . . . . . . . . . . . . 49.0 t80 -100.5 121.62 41.86 Favored 'General case' 0 CA--C 1.475 -1.927 0 N-CA-C 106.191 -1.781 . . . . 22.44 106.191 176.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 69.1 m-80 -109.27 117.54 34.36 Favored 'General case' 0 N--CA 1.478 0.94 0 N-CA-C 109.101 -0.703 . . . . 24.04 109.101 177.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 1.3 mtpm? -56.43 -41.8 77.01 Favored 'General case' 0 C--N 1.324 -0.5 0 C-N-CA 120.118 -0.633 . . . . 31.61 109.633 -177.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 6.0 mp0 -40.31 -34.24 0.31 Allowed 'General case' 0 C--O 1.249 1.038 0 N-CA-C 117.956 2.576 . . . . 38.41 117.956 178.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' HIS . . . . . . . . . . . . . 35.7 m170 -99.78 4.27 45.26 Favored 'General case' 0 C--O 1.245 0.853 0 N-CA-C 116.991 2.219 . . . . 28.32 116.991 -172.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.48 137.49 48.24 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 104.549 -2.389 . . . . 29.45 104.549 173.85 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' ASN . . . . . 0.413 HD22 ' HA ' ' A' ' 117' ' ' ASN . 1.6 m120 45.49 56.48 5.7 Favored 'General case' 0 C--O 1.257 1.467 0 CA-C-N 118.978 0.808 . . . . 32.34 112.221 -178.927 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -69.75 150.38 46.98 Favored 'General case' 0 C--O 1.251 1.147 0 N-CA-C 107.193 -1.41 . . . . 26.68 107.193 177.771 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ASP . . . . . . . . . . . . . 65.1 t0 -73.05 92.4 1.67 Allowed 'General case' 0 C--O 1.196 -1.745 0 N-CA-C 107.315 -1.365 . . . . 26.9 107.315 168.326 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 35.8 p -61.2 -30.59 70.52 Favored 'General case' 0 C--N 1.314 -0.975 0 N-CA-C 115.47 1.656 . . . . 26.29 115.47 -179.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.08 -8.31 59.65 Favored 'General case' 0 C--N 1.323 -0.547 0 C-N-CA 117.1 -1.84 . . . . 36.43 113.891 -176.052 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 1.3 tttm -98.09 -42.43 7.47 Favored 'General case' 0 C--O 1.216 -0.684 0 CA-C-N 115.3 -0.863 . . . . 27.1 110.694 172.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' TYR . . . . . . . . . . . . . 34.0 m-85 -113.68 1.55 14.93 Favored 'General case' 0 C--O 1.255 1.349 0 N-CA-C 117.274 2.324 . . . . 31.3 117.274 -164.089 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' CYS . . . . . . . . . . . . . 72.0 m . . . . . 0 CA--C 1.494 -1.195 0 CA-C-O 124.808 2.242 . . . . 17.8 109.476 -172.999 -62.13 -73.362 -82.008 102.074 2.023 101.773 -57.563 -60.552 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 500' ' ' MCW . . . . . 0.81 ' H7 ' ' O ' ' A' ' 534' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 501' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 502' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 507' ' ' HOH . . . . . 1.02 ' O ' ' HA ' ' A' ' 39' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 516' ' ' HOH . . . . . 0.629 ' O ' ' HA ' ' A' ' 74' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 521' ' ' HOH . . . . . 0.732 ' O ' ' HD3' ' A' ' 100' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 523' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 527' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 528' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 529' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 530' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 531' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 532' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 533' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 534' ' ' HOH . . . . . 0.81 ' O ' ' H7 ' ' A' ' 500' ' ' MCW . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_