data_4i6o_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 4i6o _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 ' 10' ' ' ASP . . . . . 0.913 ' CB ' ' CA ' ' A' ' 11' ' ' LYS . 4.6 m-20 . . . . . 0 C--O 1.223 -0.322 0 N-CA-C 112.391 0.515 . . . . 109.87 112.391 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LYS . . . . . 0.913 ' CA ' ' CB ' ' A' ' 10' ' ' ASP . 4.4 tptp -129.07 97.2 4.54 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 113.578 0.955 . . . . 113.12 113.578 2.86 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' VAL . . . . . 0.779 ' O ' ' CG1' ' A' ' 12' ' ' VAL . 3.8 p -69.55 61.9 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.212 -0.884 0 N-CA-C 107.074 -1.454 . . . . 108.98 107.074 175.463 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLY . . . . . 0.694 ' O ' ' C ' ' A' ' 14' ' ' LYS . . . -47.04 -37.11 9.55 Favored Glycine 0 N--CA 1.438 -1.184 0 N-CA-C 107.249 -2.34 . . . . 121.29000000000001 107.249 -179.044 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LYS . . . . . 0.694 ' C ' ' O ' ' A' ' 13' ' ' GLY . 34.3 tptt 20.96 55.34 0.02 OUTLIER 'General case' 0 N--CA 1.437 -1.093 0 N-CA-C 109.027 -0.731 . . . . 122.5 109.027 -175.723 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' TYR . . . . . 0.501 ' N ' ' O ' ' A' ' 13' ' ' GLY . 28.1 m-85 -47.19 136.97 8.58 Favored Pre-proline 0 N--CA 1.434 -1.233 0 N-CA-C 104.567 -2.383 . . . . 98.170000000000002 104.567 169.762 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -53.38 148.83 31.92 Favored 'Trans proline' 0 C--O 1.24 0.595 0 O-C-N 122.922 0.959 . . . . 75.439999999999998 110.083 174.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.6 mtmm -52.31 -28.35 18.84 Favored 'General case' 0 C--N 1.322 -0.61 0 O-C-N 124.478 1.111 . . . . 96.099999999999994 112.689 -177.114 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.62 -51.33 63.21 Favored 'General case' 0 C--O 1.206 -1.214 0 N-CA-C 109.519 -0.548 . . . . 98.120000000000005 109.519 -178.679 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 72.2 mt -67.91 -28.43 67.49 Favored 'General case' 0 N--CA 1.437 -1.095 0 N-CA-C 114.513 1.301 . . . . 59.340000000000003 114.513 -179.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.7 mtt85 -62.52 -40.29 96.27 Favored 'General case' 0 CA--C 1.489 -1.382 0 CA-C-O 121.267 0.556 . . . . 105.93000000000001 112.12 171.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.2 tptm -67.66 -35.58 79.13 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 119.418 -0.913 . . . . 97.629999999999995 112.883 172.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 76.7 m -62.87 -36.79 84.47 Favored 'General case' 0 CA--C 1.553 1.091 0 O-C-N 120.061 -1.649 . . . . 53.909999999999997 108.766 179.992 -63.643 -115.781 -107.748 104.036 2.065 100.393 70.627 176.066 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 37.8 t -68.8 -51.18 43.57 Favored 'General case' 0 C--O 1.271 2.215 0 CA-C-O 123.795 1.76 . . . . 45.049999999999997 109.627 -176.795 174.743 72.551 -98.436 100.464 2.064 103.252 -154.163 -60.315 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -50.41 -46.66 56.46 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 113.255 -1.793 . . . . 71.359999999999999 115.572 171.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 86.8 m-20 -63.99 -30.6 71.66 Favored 'General case' 0 CA--C 1.563 1.447 0 C-N-CA 118.898 -1.121 . . . . 58.880000000000003 111.801 176.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.17 -24.63 70.57 Favored Glycine 0 N--CA 1.492 2.424 0 N-CA-C 110.851 -0.9 . . . . 51.619999999999997 110.851 176.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 29.7 mtm -95.82 5.28 51.71 Favored 'General case' 0 N--CA 1.432 -1.351 0 N-CA-C 118.913 2.931 . . . . 64.489999999999995 118.913 -177.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.6 mmt85 -60.49 153.65 22.75 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-O 122.516 1.151 . . . . 96.340000000000003 112.702 172.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -61.17 153.68 25.27 Favored 'General case' 0 C--O 1.209 -1.064 0 N-CA-C 105.134 -2.173 . . . . 83.430000000000007 105.134 175.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -135.45 66.18 64.26 Favored Pre-proline 0 N--CA 1.495 1.816 0 N-CA-C 107.32 -1.363 . . . . 53.670000000000002 107.32 -168.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -64.25 -29.01 64.1 Favored 'Trans proline' 0 N--CA 1.507 2.305 0 O-C-N 123.129 1.068 . . . . 60.490000000000002 114.579 -178.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 18.1 mmt -76.79 -8.7 57.8 Favored 'General case' 0 C--O 1.208 -1.129 0 O-C-N 121.453 -0.779 . . . . 57.200000000000003 111.804 175.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 11.4 mmm180 59.9 39.0 20.87 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 118.272 0.487 . . . . 90.150000000000006 112.112 177.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -78.87 145.24 34.28 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 120.097 -0.641 . . . . 57.939999999999998 109.336 171.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 16.8 p -72.5 156.38 39.08 Favored 'General case' 0 N--CA 1.418 -2.074 0 N-CA-C 107.171 -1.418 . . . . 47.340000000000003 107.171 -175.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 96.8 m -48.11 -42.17 28.41 Favored 'General case' 0 C--O 1.278 2.601 0 C-N-CA 118.687 -1.205 . . . . 45.969999999999999 111.77 171.612 -65.898 -63.954 -85.792 105.863 2.09 103.178 -81.698 179.485 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 51.5 mm-40 -69.97 -42.42 73.17 Favored 'General case' 0 CA--C 1.499 -0.993 0 CA-C-O 122.083 0.944 . . . . 63.240000000000002 108.844 -170.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.3 -44.01 92.55 Favored 'General case' 0 C--N 1.294 -1.815 0 N-CA-C 114.469 1.285 . . . . 96.849999999999994 114.469 176.583 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ARG . . . . . . . . . . . . . 43.9 mtm180 -62.51 -20.94 65.12 Favored 'General case' 0 N--CA 1.44 -0.951 0 C-N-CA 117.494 -1.682 . . . . 53.390000000000001 110.419 -176.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -76.57 -12.53 60.04 Favored 'General case' 0 CA--C 1.57 1.747 0 O-C-N 123.885 0.741 . . . . 67.469999999999999 112.486 -178.834 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 14.2 mtt180 -97.41 -3.88 39.37 Favored 'General case' 0 C--O 1.215 -0.733 0 C-N-CA 124.15 0.98 . . . . 88.739999999999995 112.31 -175.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 21.8 m-85 -77.22 -31.29 55.1 Favored 'General case' 0 CA--C 1.498 -1.043 0 CA-C-N 118.77 0.714 . . . . 73.909999999999997 109.938 -178.676 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ILE . . . . . . . . . . . . . 0.4 OUTLIER -146.55 148.2 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.403 0 N-CA-C 105.932 -1.877 . . . . 60.609999999999999 105.932 -176.452 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 7.5 t -93.3 109.65 21.19 Favored 'General case' 0 CA--C 1.504 -0.795 0 N-CA-C 107.876 -1.157 . . . . 84.439999999999998 107.876 -174.074 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 17.8 mt -99.59 156.61 16.97 Favored 'General case' 0 C--O 1.21 -1.012 0 CA-C-N 115.023 -0.989 . . . . 61.460000000000001 110.35 -174.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -58.48 155.38 23.99 Favored Glycine 0 C--O 1.254 1.376 0 CA-C-O 121.955 0.753 . . . . 65.349999999999994 112.906 166.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -61.23 -34.64 75.44 Favored 'General case' 0 C--O 1.247 0.928 0 CA-C-N 114.615 -0.792 . . . . 96.269999999999996 111.676 -175.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -78.67 -40.61 33.51 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 124.442 1.089 . . . . 62.759999999999998 108.902 -175.586 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 42.8 t -64.51 -46.6 82.25 Favored 'General case' 0 C--O 1.203 -1.362 0 CA-C-N 115.466 -0.788 . . . . 53.880000000000003 108.997 -179.527 176.066 70.627 -107.748 100.393 2.065 104.036 -115.781 -63.643 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 50.0 tttm -59.88 -48.67 80.76 Favored 'General case' 0 N--CA 1.426 -1.638 0 C-N-CA 123.591 0.757 . . . . 78.959999999999994 111.179 -179.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 3.3 tptm -55.16 -51.12 67.5 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.64 -0.874 . . . . 68.950000000000003 108.64 178.676 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 73.2 t -61.26 -44.52 98.56 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.945 0 O-C-N 123.879 0.737 . . . . 50.32 111.291 179.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -56.71 -50.65 71.55 Favored 'General case' 0 CA--C 1.556 1.178 0 CA-C-O 121.772 0.796 . . . . 54.859999999999999 109.905 178.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 91.5 mt -57.92 -48.05 81.02 Favored 'General case' 0 CA--C 1.492 -1.265 0 N-CA-C 112.401 0.519 . . . . 50.32 112.401 178.111 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -63.07 -45.74 90.74 Favored 'General case' 0 N--CA 1.441 -0.889 0 C-N-CA 117.985 -1.486 . . . . 47.369999999999997 110.288 -175.655 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 80.8 m -64.98 -42.13 94.81 Favored 'General case' 0 C--O 1.251 1.182 0 C-N-CA 117.925 -1.51 . . . . 44.189999999999998 113.762 177.813 -60.315 -154.163 -98.436 103.252 2.064 100.464 72.551 174.743 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 50.2 t -64.3 -43.07 95.85 Favored 'General case' 0 N--CA 1.425 -1.68 0 N-CA-C 109.085 -0.709 . . . . 41.960000000000001 109.085 -177.777 179.485 -81.698 -85.792 103.178 2.09 105.863 -63.954 -65.898 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -59.62 -39.35 83.97 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 112.813 0.672 . . . . 46.219999999999999 112.813 175.076 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -64.55 -49.43 71.28 Favored 'General case' 0 N--CA 1.421 -1.893 0 CA-C-O 122.277 1.037 . . . . 52.759999999999998 110.582 -177.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 9.8 tp -76.02 -34.85 27.84 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.52 0 C-N-CA 118.799 -1.161 . . . . 43.060000000000002 108.531 -170.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 65.6 m -56.08 -49.45 73.78 Favored 'General case' 0 C--O 1.247 0.97 0 N-CA-C 109.786 -0.45 . . . . 40.439999999999998 109.786 178.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 24.0 tp10 -72.4 -34.45 67.89 Favored 'General case' 0 C--O 1.249 1.079 0 CA-C-N 116.03 -0.532 . . . . 53.289999999999999 110.157 -178.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 15.6 tp -64.32 -46.2 84.57 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 117.83 -1.548 . . . . 59.740000000000002 112.016 176.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 10.3 mtm180 -63.33 -33.82 76.36 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 119.488 -0.885 . . . . 61.990000000000002 112.895 176.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 54.7 mtt180 -65.17 -44.16 89.41 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 119.41 -0.916 . . . . 85.700000000000003 109.759 177.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.02 -39.82 93.57 Favored 'General case' 0 N--CA 1.436 -1.167 0 N-CA-C 112.455 0.539 . . . . 83.950000000000003 112.455 176.469 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 59.8 t60 -66.94 -39.22 87.24 Favored 'General case' 0 N--CA 1.407 -2.589 0 N-CA-C 108.757 -0.831 . . . . 75.510000000000005 108.757 179.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.3 -43.49 73.7 Favored 'General case' 0 CA--C 1.565 1.52 0 N-CA-C 108.386 -0.968 . . . . 43.549999999999997 108.386 -179.02 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 45.9 mtt85 -51.7 -50.63 60.09 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.541 -0.725 . . . . 76.019999999999996 111.956 173.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.2 -43.0 99.57 Favored 'General case' 0 N--CA 1.442 -0.87 0 O-C-N 124.386 1.054 . . . . 52.810000000000002 112.646 -178.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.0 t -63.37 -44.62 94.22 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.791 -0.568 . . . . 66.659999999999997 111.063 -179.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 66.1 m170 -60.06 -26.85 66.47 Favored 'General case' 0 CA--C 1.489 -1.387 0 N-CA-C 114.31 1.226 . . . . 49.57 114.31 178.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 52.0 mt -96.59 2.87 52.72 Favored 'General case' 0 C--O 1.198 -1.634 0 O-C-N 124.991 1.432 . . . . 59.229999999999997 111.378 179.008 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 60.03 33.33 78.76 Favored Glycine 0 CA--C 1.524 0.655 0 CA-C-N 118.171 0.441 . . . . 91.060000000000002 113.399 -179.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 47.0 mt -100.98 8.43 43.04 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 106.663 -1.606 . . . . 88.280000000000001 106.663 177.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ALA . . . . . 0.7 ' O ' ' OXT' ' A' ' 77' ' ' ARG . . . -178.54 -169.73 0.19 Allowed 'General case' 0 C--O 1.235 0.313 0 N-CA-C 101.819 -3.4 . . . . 114.73999999999999 101.819 -178.147 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ARG . . . . . 0.7 ' OXT' ' O ' ' A' ' 76' ' ' ALA . 8.3 ttp180 . . . . . 0 CA--C 1.564 1.482 0 N-CA-C 118.367 2.729 . . . . 123.81 118.367 176.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' MPD . . . . . 0.518 ' O2 ' ' C5 ' ' A' ' 101' ' ' MPD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ASP . . . . . 1.233 ' CB ' ' HA ' ' A' ' 11' ' ' LYS . 4.6 m-20 . . . . . 0 C--O 1.223 -0.322 0 N-CA-C 112.391 0.515 . . . . 109.87 112.391 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LYS . . . . . 1.233 ' HA ' ' CB ' ' A' ' 10' ' ' ASP . 4.4 tptp -129.07 97.2 4.54 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 113.578 0.955 . . . . 113.12 113.578 2.86 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' VAL . . . . . 0.998 HG13 ' O ' ' A' ' 12' ' ' VAL . 3.8 p -69.55 61.9 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.212 -0.884 0 N-CA-C 107.074 -1.454 . . . . 108.98 107.074 175.463 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLY . . . . . 0.694 ' O ' ' C ' ' A' ' 14' ' ' LYS . . . -47.04 -37.11 9.55 Favored Glycine 0 N--CA 1.438 -1.184 0 N-CA-C 107.249 -2.34 . . . . 121.29000000000001 107.249 -179.044 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LYS . . . . . 0.694 ' C ' ' O ' ' A' ' 13' ' ' GLY . 34.3 tptt 20.96 55.34 0.02 OUTLIER 'General case' 0 N--CA 1.437 -1.093 0 N-CA-C 109.027 -0.731 . . . . 122.5 109.027 -175.723 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' TYR . . . . . 0.501 ' N ' ' O ' ' A' ' 13' ' ' GLY . 28.1 m-85 -47.19 136.97 8.58 Favored Pre-proline 0 N--CA 1.434 -1.233 0 N-CA-C 104.567 -2.383 . . . . 98.170000000000002 104.567 169.762 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -53.38 148.83 31.92 Favored 'Trans proline' 0 C--O 1.24 0.595 0 O-C-N 122.922 0.959 . . . . 75.439999999999998 110.083 174.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.6 mtmm -52.31 -28.35 18.84 Favored 'General case' 0 C--N 1.322 -0.61 0 O-C-N 124.478 1.111 . . . . 96.099999999999994 112.689 -177.114 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.62 -51.33 63.21 Favored 'General case' 0 C--O 1.206 -1.214 0 N-CA-C 109.519 -0.548 . . . . 98.120000000000005 109.519 -178.679 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 72.2 mt -67.91 -28.43 67.49 Favored 'General case' 0 N--CA 1.437 -1.095 0 N-CA-C 114.513 1.301 . . . . 59.340000000000003 114.513 -179.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.7 mtt85 -62.52 -40.29 96.27 Favored 'General case' 0 CA--C 1.489 -1.382 0 CA-C-O 121.267 0.556 . . . . 105.93000000000001 112.12 171.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.2 tptm -67.66 -35.58 79.13 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 119.418 -0.913 . . . . 97.629999999999995 112.883 172.007 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 76.7 m -62.87 -36.79 84.47 Favored 'General case' 0 CA--C 1.553 1.091 0 O-C-N 120.061 -1.649 . . . . 53.909999999999997 108.766 179.992 -63.643 -115.781 -107.748 104.036 2.065 100.393 70.627 176.066 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 37.8 t -68.8 -51.18 43.57 Favored 'General case' 0 C--O 1.271 2.215 0 CA-C-O 123.795 1.76 . . . . 45.049999999999997 109.627 -176.795 174.743 72.551 -98.436 100.464 2.064 103.252 -154.163 -60.315 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -50.41 -46.66 56.46 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 113.255 -1.793 . . . . 71.359999999999999 115.572 171.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 86.8 m-20 -63.99 -30.6 71.66 Favored 'General case' 0 CA--C 1.563 1.447 0 C-N-CA 118.898 -1.121 . . . . 58.880000000000003 111.801 176.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.17 -24.63 70.57 Favored Glycine 0 N--CA 1.492 2.424 0 N-CA-C 110.851 -0.9 . . . . 51.619999999999997 110.851 176.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 29.7 mtm -95.82 5.28 51.71 Favored 'General case' 0 N--CA 1.432 -1.351 0 N-CA-C 118.913 2.931 . . . . 64.489999999999995 118.913 -177.973 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.6 mmt85 -60.49 153.65 22.75 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-O 122.516 1.151 . . . . 96.340000000000003 112.702 172.538 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -61.17 153.68 25.27 Favored 'General case' 0 C--O 1.209 -1.064 0 N-CA-C 105.134 -2.173 . . . . 83.430000000000007 105.134 175.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -135.45 66.18 64.26 Favored Pre-proline 0 N--CA 1.495 1.816 0 N-CA-C 107.32 -1.363 . . . . 53.670000000000002 107.32 -168.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -64.25 -29.01 64.1 Favored 'Trans proline' 0 N--CA 1.507 2.305 0 O-C-N 123.129 1.068 . . . . 60.490000000000002 114.579 -178.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 18.1 mmt -76.79 -8.7 57.8 Favored 'General case' 0 C--O 1.208 -1.129 0 O-C-N 121.453 -0.779 . . . . 57.200000000000003 111.804 175.956 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 11.4 mmm180 59.9 39.0 20.87 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 118.272 0.487 . . . . 90.150000000000006 112.112 177.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -78.87 145.24 34.28 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 120.097 -0.641 . . . . 57.939999999999998 109.336 171.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 16.8 p -72.5 156.38 39.08 Favored 'General case' 0 N--CA 1.418 -2.074 0 N-CA-C 107.171 -1.418 . . . . 47.340000000000003 107.171 -175.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 96.8 m -48.11 -42.17 28.41 Favored 'General case' 0 C--O 1.278 2.601 0 C-N-CA 118.687 -1.205 . . . . 45.969999999999999 111.77 171.612 -65.898 -63.954 -85.792 105.863 2.09 103.178 -81.698 179.485 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 51.5 mm-40 -69.97 -42.42 73.17 Favored 'General case' 0 CA--C 1.499 -0.993 0 CA-C-O 122.083 0.944 . . . . 63.240000000000002 108.844 -170.973 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ARG . . . . . 0.414 ' HG2' ' NH1' ' A' ' 41' ' ' ARG . 0.0 OUTLIER -59.3 -44.01 92.55 Favored 'General case' 0 C--N 1.294 -1.815 0 N-CA-C 114.469 1.285 . . . . 96.849999999999994 114.469 176.583 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ARG . . . . . 0.401 ' HA ' ' CE2' ' A' ' 42' ' ' PHE . 43.9 mtm180 -62.51 -20.94 65.12 Favored 'General case' 0 N--CA 1.44 -0.951 0 C-N-CA 117.494 -1.682 . . . . 53.390000000000001 110.419 -176.596 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -76.57 -12.53 60.04 Favored 'General case' 0 CA--C 1.57 1.747 0 O-C-N 123.885 0.741 . . . . 67.469999999999999 112.486 -178.834 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ARG . . . . . 0.414 ' NH1' ' HG2' ' A' ' 38' ' ' ARG . 14.2 mtt180 -97.41 -3.88 39.37 Favored 'General case' 0 C--O 1.215 -0.733 0 C-N-CA 124.15 0.98 . . . . 88.739999999999995 112.31 -175.598 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' PHE . . . . . 0.401 ' CE2' ' HA ' ' A' ' 39' ' ' ARG . 21.8 m-85 -77.22 -31.29 55.1 Favored 'General case' 0 CA--C 1.498 -1.043 0 CA-C-N 118.77 0.714 . . . . 73.909999999999997 109.938 -178.676 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ILE . . . . . 0.407 HD12 HG23 ' A' ' 43' ' ' ILE . 0.4 OUTLIER -146.55 148.2 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.403 0 N-CA-C 105.932 -1.877 . . . . 60.609999999999999 105.932 -176.452 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 7.5 t -93.3 109.65 21.19 Favored 'General case' 0 CA--C 1.504 -0.795 0 N-CA-C 107.876 -1.157 . . . . 84.439999999999998 107.876 -174.074 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 17.8 mt -99.59 156.61 16.97 Favored 'General case' 0 C--O 1.21 -1.012 0 CA-C-N 115.023 -0.989 . . . . 61.460000000000001 110.35 -174.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -58.48 155.38 23.99 Favored Glycine 0 C--O 1.254 1.376 0 CA-C-O 121.955 0.753 . . . . 65.349999999999994 112.906 166.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -61.23 -34.64 75.44 Favored 'General case' 0 C--O 1.247 0.928 0 CA-C-N 114.615 -0.792 . . . . 96.269999999999996 111.676 -175.485 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -78.67 -40.61 33.51 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 124.442 1.089 . . . . 62.759999999999998 108.902 -175.586 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 42.8 t -64.51 -46.6 82.25 Favored 'General case' 0 C--O 1.203 -1.362 0 CA-C-N 115.466 -0.788 . . . . 53.880000000000003 108.997 -179.527 176.066 70.627 -107.748 100.393 2.065 104.036 -115.781 -63.643 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 50.0 tttm -59.88 -48.67 80.76 Favored 'General case' 0 N--CA 1.426 -1.638 0 C-N-CA 123.591 0.757 . . . . 78.959999999999994 111.179 -179.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 3.3 tptm -55.16 -51.12 67.5 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.64 -0.874 . . . . 68.950000000000003 108.64 178.676 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 73.2 t -61.26 -44.52 98.56 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.945 0 O-C-N 123.879 0.737 . . . . 50.32 111.291 179.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -56.71 -50.65 71.55 Favored 'General case' 0 CA--C 1.556 1.178 0 CA-C-O 121.772 0.796 . . . . 54.859999999999999 109.905 178.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 91.5 mt -57.92 -48.05 81.02 Favored 'General case' 0 CA--C 1.492 -1.265 0 N-CA-C 112.401 0.519 . . . . 50.32 112.401 178.111 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -63.07 -45.74 90.74 Favored 'General case' 0 N--CA 1.441 -0.889 0 C-N-CA 117.985 -1.486 . . . . 47.369999999999997 110.288 -175.655 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 80.8 m -64.98 -42.13 94.81 Favored 'General case' 0 C--O 1.251 1.182 0 C-N-CA 117.925 -1.51 . . . . 44.189999999999998 113.762 177.813 -60.315 -154.163 -98.436 103.252 2.064 100.464 72.551 174.743 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 50.2 t -64.3 -43.07 95.85 Favored 'General case' 0 N--CA 1.425 -1.68 0 N-CA-C 109.085 -0.709 . . . . 41.960000000000001 109.085 -177.777 179.485 -81.698 -85.792 103.178 2.09 105.863 -63.954 -65.898 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -59.62 -39.35 83.97 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 112.813 0.672 . . . . 46.219999999999999 112.813 175.076 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -64.55 -49.43 71.28 Favored 'General case' 0 N--CA 1.421 -1.893 0 CA-C-O 122.277 1.037 . . . . 52.759999999999998 110.582 -177.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 9.8 tp -76.02 -34.85 27.84 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.52 0 C-N-CA 118.799 -1.161 . . . . 43.060000000000002 108.531 -170.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 65.6 m -56.08 -49.45 73.78 Favored 'General case' 0 C--O 1.247 0.97 0 N-CA-C 109.786 -0.45 . . . . 40.439999999999998 109.786 178.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 24.0 tp10 -72.4 -34.45 67.89 Favored 'General case' 0 C--O 1.249 1.079 0 CA-C-N 116.03 -0.532 . . . . 53.289999999999999 110.157 -178.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 15.6 tp -64.32 -46.2 84.57 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 117.83 -1.548 . . . . 59.740000000000002 112.016 176.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 10.3 mtm180 -63.33 -33.82 76.36 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 119.488 -0.885 . . . . 61.990000000000002 112.895 176.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 54.7 mtt180 -65.17 -44.16 89.41 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 119.41 -0.916 . . . . 85.700000000000003 109.759 177.251 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 2.3 mm-40 -62.02 -39.82 93.57 Favored 'General case' 0 N--CA 1.436 -1.167 0 N-CA-C 112.455 0.539 . . . . 83.950000000000003 112.455 176.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 59.8 t60 -66.94 -39.22 87.24 Favored 'General case' 0 N--CA 1.407 -2.589 0 N-CA-C 108.757 -0.831 . . . . 75.510000000000005 108.757 179.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.3 -43.49 73.7 Favored 'General case' 0 CA--C 1.565 1.52 0 N-CA-C 108.386 -0.968 . . . . 43.549999999999997 108.386 -179.02 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 45.9 mtt85 -51.7 -50.63 60.09 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.541 -0.725 . . . . 76.019999999999996 111.956 173.152 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.2 -43.0 99.57 Favored 'General case' 0 N--CA 1.442 -0.87 0 O-C-N 124.386 1.054 . . . . 52.810000000000002 112.646 -178.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.0 t -63.37 -44.62 94.22 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.791 -0.568 . . . . 66.659999999999997 111.063 -179.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 66.1 m170 -60.06 -26.85 66.47 Favored 'General case' 0 CA--C 1.489 -1.387 0 N-CA-C 114.31 1.226 . . . . 49.57 114.31 178.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 52.0 mt -96.59 2.87 52.72 Favored 'General case' 0 C--O 1.198 -1.634 0 O-C-N 124.991 1.432 . . . . 59.229999999999997 111.378 179.008 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 60.03 33.33 78.76 Favored Glycine 0 CA--C 1.524 0.655 0 CA-C-N 118.171 0.441 . . . . 91.060000000000002 113.399 -179.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 47.0 mt -100.98 8.43 43.04 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 106.663 -1.606 . . . . 88.280000000000001 106.663 177.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ALA . . . . . 0.7 ' O ' ' OXT' ' A' ' 77' ' ' ARG . . . -178.54 -169.73 0.19 Allowed 'General case' 0 C--O 1.235 0.313 0 N-CA-C 101.819 -3.4 . . . . 114.73999999999999 101.819 -178.147 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ARG . . . . . 0.7 ' OXT' ' O ' ' A' ' 76' ' ' ALA . 8.3 ttp180 . . . . . 0 CA--C 1.564 1.482 0 N-CA-C 118.367 2.729 . . . . 123.81 118.367 176.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' MPD . . . . . 0.681 ' H52' ' O2 ' ' A' ' 101' ' ' MPD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ASP . . . . . 1.233 ' CB ' ' HA ' ' A' ' 11' ' ' LYS . 4.6 m-20 . . . . . 0 C--O 1.223 -0.322 0 N-CA-C 112.391 0.515 . . . . 109.87 112.391 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LYS . . . . . 1.233 ' HA ' ' CB ' ' A' ' 10' ' ' ASP . 4.4 tptp -129.07 97.2 4.54 Favored 'General case' 0 CA--C 1.514 -0.44 0 N-CA-C 113.578 0.955 . . . . 113.12 113.578 2.86 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' VAL . . . . . 0.998 HG13 ' O ' ' A' ' 12' ' ' VAL . 3.8 p -69.55 61.9 0.05 OUTLIER 'Isoleucine or valine' 0 C--O 1.212 -0.884 0 N-CA-C 107.074 -1.454 . . . . 108.98 107.074 175.463 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLY . . . . . 0.694 ' O ' ' C ' ' A' ' 14' ' ' LYS . . . -47.04 -37.11 9.55 Favored Glycine 0 N--CA 1.438 -1.184 0 N-CA-C 107.249 -2.34 . . . . 121.29000000000001 107.249 -179.044 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LYS . . . . . 0.694 ' C ' ' O ' ' A' ' 13' ' ' GLY . 34.3 tptt 20.96 55.34 0.02 OUTLIER 'General case' 0 N--CA 1.437 -1.093 0 N-CA-C 109.027 -0.731 . . . . 122.5 109.027 -175.723 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' TYR . . . . . 0.501 ' N ' ' O ' ' A' ' 13' ' ' GLY . 28.1 m-85 -47.19 136.97 8.58 Favored Pre-proline 0 N--CA 1.434 -1.233 0 N-CA-C 104.567 -2.383 . . . . 98.170000000000002 104.567 169.762 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 76.7 Cg_exo -53.38 148.83 31.92 Favored 'Trans proline' 0 C--O 1.24 0.595 0 O-C-N 122.922 0.959 . . . . 75.439999999999998 110.083 174.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.6 mtmm -52.31 -28.35 18.84 Favored 'General case' 0 C--N 1.322 -0.61 0 O-C-N 124.478 1.111 . . . . 96.099999999999994 112.689 -177.114 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -64.62 -51.33 63.21 Favored 'General case' 0 C--O 1.206 -1.214 0 N-CA-C 109.519 -0.548 . . . . 98.120000000000005 109.519 -178.679 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 72.2 mt -67.91 -28.43 67.49 Favored 'General case' 0 N--CA 1.437 -1.095 0 N-CA-C 114.513 1.301 . . . . 59.340000000000003 114.513 -179.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 2.7 mtt85 -62.52 -40.29 96.27 Favored 'General case' 0 CA--C 1.489 -1.382 0 CA-C-O 121.267 0.556 . . . . 105.93000000000001 112.12 171.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 6.2 tptm -67.66 -35.58 79.13 Favored 'General case' 0 N--CA 1.43 -1.436 0 C-N-CA 119.418 -0.913 . . . . 97.629999999999995 112.883 172.007 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . 76.7 m -62.87 -36.79 84.47 Favored 'General case' 0 CA--C 1.553 1.091 0 O-C-N 120.061 -1.649 . . . . 53.909999999999997 108.766 179.992 -63.643 -115.781 -107.748 104.036 2.065 100.393 70.627 176.066 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' CYS . . . . . . . . . . . . . 37.8 t -68.8 -51.18 43.57 Favored 'General case' 0 C--O 1.271 2.215 0 CA-C-O 123.795 1.76 . . . . 45.049999999999997 109.627 -176.795 174.743 72.551 -98.436 100.464 2.064 103.252 -154.163 -60.315 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 15.8 tt0 -50.41 -46.66 56.46 Favored 'General case' 0 C--N 1.313 -1.001 0 CA-C-N 113.255 -1.793 . . . . 71.359999999999999 115.572 171.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 86.8 m-20 -63.99 -30.6 71.66 Favored 'General case' 0 CA--C 1.563 1.447 0 C-N-CA 118.898 -1.121 . . . . 58.880000000000003 111.801 176.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -65.17 -24.63 70.57 Favored Glycine 0 N--CA 1.492 2.424 0 N-CA-C 110.851 -0.9 . . . . 51.619999999999997 110.851 176.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 29.7 mtm -95.82 5.28 51.71 Favored 'General case' 0 N--CA 1.432 -1.351 0 N-CA-C 118.913 2.931 . . . . 64.489999999999995 118.913 -177.973 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ARG . . . . . . . . . . . . . 12.6 mmt85 -60.49 153.65 22.75 Favored 'General case' 0 N--CA 1.483 1.206 0 CA-C-O 122.516 1.151 . . . . 96.340000000000003 112.702 172.538 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLU . . . . . . . . . . . . . 50.0 mm-40 -61.17 153.68 25.27 Favored 'General case' 0 C--O 1.209 -1.064 0 N-CA-C 105.134 -2.173 . . . . 83.430000000000007 105.134 175.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 46.6 t30 -135.45 66.18 64.26 Favored Pre-proline 0 N--CA 1.495 1.816 0 N-CA-C 107.32 -1.363 . . . . 53.670000000000002 107.32 -168.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 27.7 Cg_exo -64.25 -29.01 64.1 Favored 'Trans proline' 0 N--CA 1.507 2.305 0 O-C-N 123.129 1.068 . . . . 60.490000000000002 114.579 -178.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' MET . . . . . . . . . . . . . 18.1 mmt -76.79 -8.7 57.8 Favored 'General case' 0 C--O 1.208 -1.129 0 O-C-N 121.453 -0.779 . . . . 57.200000000000003 111.804 175.956 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 11.4 mmm180 59.9 39.0 20.87 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 118.272 0.487 . . . . 90.150000000000006 112.112 177.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -78.87 145.24 34.28 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 120.097 -0.641 . . . . 57.939999999999998 109.336 171.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 16.8 p -72.5 156.38 39.08 Favored 'General case' 0 N--CA 1.418 -2.074 0 N-CA-C 107.171 -1.418 . . . . 47.340000000000003 107.171 -175.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 96.8 m -48.11 -42.17 28.41 Favored 'General case' 0 C--O 1.278 2.601 0 C-N-CA 118.687 -1.205 . . . . 45.969999999999999 111.77 171.612 -65.898 -63.954 -85.792 105.863 2.09 103.178 -81.698 179.485 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLN . . . . . . . . . . . . . 51.5 mm-40 -69.97 -42.42 73.17 Favored 'General case' 0 CA--C 1.499 -0.993 0 CA-C-O 122.083 0.944 . . . . 63.240000000000002 108.844 -170.973 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ARG . . . . . 0.414 ' HG2' ' NH1' ' A' ' 41' ' ' ARG . 0.0 OUTLIER -59.3 -44.01 92.55 Favored 'General case' 0 C--N 1.294 -1.815 0 N-CA-C 114.469 1.285 . . . . 96.849999999999994 114.469 176.583 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ARG . . . . . 0.401 ' HA ' ' CE2' ' A' ' 42' ' ' PHE . 43.9 mtm180 -62.51 -20.94 65.12 Favored 'General case' 0 N--CA 1.44 -0.951 0 C-N-CA 117.494 -1.682 . . . . 53.390000000000001 110.419 -176.596 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -76.57 -12.53 60.04 Favored 'General case' 0 CA--C 1.57 1.747 0 O-C-N 123.885 0.741 . . . . 67.469999999999999 112.486 -178.834 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ARG . . . . . 0.414 ' NH1' ' HG2' ' A' ' 38' ' ' ARG . 14.2 mtt180 -97.41 -3.88 39.37 Favored 'General case' 0 C--O 1.215 -0.733 0 C-N-CA 124.15 0.98 . . . . 88.739999999999995 112.31 -175.598 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' PHE . . . . . 0.401 ' CE2' ' HA ' ' A' ' 39' ' ' ARG . 21.8 m-85 -77.22 -31.29 55.1 Favored 'General case' 0 CA--C 1.498 -1.043 0 CA-C-N 118.77 0.714 . . . . 73.909999999999997 109.938 -178.676 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ILE . . . . . 0.407 HD12 HG23 ' A' ' 43' ' ' ILE . 0.4 OUTLIER -146.55 148.2 17.18 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.403 0 N-CA-C 105.932 -1.877 . . . . 60.609999999999999 105.932 -176.452 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 7.5 t -93.3 109.65 21.19 Favored 'General case' 0 CA--C 1.504 -0.795 0 N-CA-C 107.876 -1.157 . . . . 84.439999999999998 107.876 -174.074 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 17.8 mt -99.59 156.61 16.97 Favored 'General case' 0 C--O 1.21 -1.012 0 CA-C-N 115.023 -0.989 . . . . 61.460000000000001 110.35 -174.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -58.48 155.38 23.99 Favored Glycine 0 C--O 1.254 1.376 0 CA-C-O 121.955 0.753 . . . . 65.349999999999994 112.906 166.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 2.0 mm-40 -61.23 -34.64 75.44 Favored 'General case' 0 C--O 1.247 0.928 0 CA-C-N 114.615 -0.792 . . . . 96.269999999999996 111.676 -175.485 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -78.67 -40.61 33.51 Favored 'General case' 0 N--CA 1.468 0.443 0 O-C-N 124.442 1.089 . . . . 62.759999999999998 108.902 -175.586 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 42.8 t -64.51 -46.6 82.25 Favored 'General case' 0 C--O 1.203 -1.362 0 CA-C-N 115.466 -0.788 . . . . 53.880000000000003 108.997 -179.527 176.066 70.627 -107.748 100.393 2.065 104.036 -115.781 -63.643 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 50.0 tttm -59.88 -48.67 80.76 Favored 'General case' 0 N--CA 1.426 -1.638 0 C-N-CA 123.591 0.757 . . . . 78.959999999999994 111.179 -179.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 3.3 tptm -55.16 -51.12 67.5 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 108.64 -0.874 . . . . 68.950000000000003 108.64 178.676 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 73.2 t -61.26 -44.52 98.56 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.945 0 O-C-N 123.879 0.737 . . . . 50.32 111.291 179.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 56.5 t80 -56.71 -50.65 71.55 Favored 'General case' 0 CA--C 1.556 1.178 0 CA-C-O 121.772 0.796 . . . . 54.859999999999999 109.905 178.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' LEU . . . . . . . . . . . . . 91.5 mt -57.92 -48.05 81.02 Favored 'General case' 0 CA--C 1.492 -1.265 0 N-CA-C 112.401 0.519 . . . . 50.32 112.401 178.111 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -63.07 -45.74 90.74 Favored 'General case' 0 N--CA 1.441 -0.889 0 C-N-CA 117.985 -1.486 . . . . 47.369999999999997 110.288 -175.655 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' CYS . . . . . . . . . . . . . 80.8 m -64.98 -42.13 94.81 Favored 'General case' 0 C--O 1.251 1.182 0 C-N-CA 117.925 -1.51 . . . . 44.189999999999998 113.762 177.813 -60.315 -154.163 -98.436 103.252 2.064 100.464 72.551 174.743 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' CYS . . . . . . . . . . . . . 50.2 t -64.3 -43.07 95.85 Favored 'General case' 0 N--CA 1.425 -1.68 0 N-CA-C 109.085 -0.709 . . . . 41.960000000000001 109.085 -177.777 179.485 -81.698 -85.792 103.178 2.09 105.863 -63.954 -65.898 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 94.2 m-20 -59.62 -39.35 83.97 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 112.813 0.672 . . . . 46.219999999999999 112.813 175.076 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' TYR . . . . . . . . . . . . . 47.6 t80 -64.55 -49.43 71.28 Favored 'General case' 0 N--CA 1.421 -1.893 0 CA-C-O 122.277 1.037 . . . . 52.759999999999998 110.582 -177.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 9.8 tp -76.02 -34.85 27.84 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.52 0 C-N-CA 118.799 -1.161 . . . . 43.060000000000002 108.531 -170.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' THR . . . . . . . . . . . . . 65.6 m -56.08 -49.45 73.78 Favored 'General case' 0 C--O 1.247 0.97 0 N-CA-C 109.786 -0.45 . . . . 40.439999999999998 109.786 178.469 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 24.0 tp10 -72.4 -34.45 67.89 Favored 'General case' 0 C--O 1.249 1.079 0 CA-C-N 116.03 -0.532 . . . . 53.289999999999999 110.157 -178.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 15.6 tp -64.32 -46.2 84.57 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 117.83 -1.548 . . . . 59.740000000000002 112.016 176.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 10.3 mtm180 -63.33 -33.82 76.36 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 119.488 -0.885 . . . . 61.990000000000002 112.895 176.476 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 54.7 mtt180 -65.17 -44.16 89.41 Favored 'General case' 0 N--CA 1.489 1.507 0 C-N-CA 119.41 -0.916 . . . . 85.700000000000003 109.759 177.251 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -62.02 -39.82 93.57 Favored 'General case' 0 N--CA 1.436 -1.167 0 N-CA-C 112.455 0.539 . . . . 83.950000000000003 112.455 176.469 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 59.8 t60 -66.94 -39.22 87.24 Favored 'General case' 0 N--CA 1.407 -2.589 0 N-CA-C 108.757 -0.831 . . . . 75.510000000000005 108.757 179.537 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -69.3 -43.49 73.7 Favored 'General case' 0 CA--C 1.565 1.52 0 N-CA-C 108.386 -0.968 . . . . 43.549999999999997 108.386 -179.02 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ARG . . . . . . . . . . . . . 45.9 mtt85 -51.7 -50.63 60.09 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.541 -0.725 . . . . 76.019999999999996 111.956 173.152 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -61.2 -43.0 99.57 Favored 'General case' 0 N--CA 1.442 -0.87 0 O-C-N 124.386 1.054 . . . . 52.810000000000002 112.646 -178.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 7.0 t -63.37 -44.62 94.22 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.791 -0.568 . . . . 66.659999999999997 111.063 -179.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' HIS . . . . . . . . . . . . . 66.1 m170 -60.06 -26.85 66.47 Favored 'General case' 0 CA--C 1.489 -1.387 0 N-CA-C 114.31 1.226 . . . . 49.57 114.31 178.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 52.0 mt -96.59 2.87 52.72 Favored 'General case' 0 C--O 1.198 -1.634 0 O-C-N 124.991 1.432 . . . . 59.229999999999997 111.378 179.008 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 60.03 33.33 78.76 Favored Glycine 0 CA--C 1.524 0.655 0 CA-C-N 118.171 0.441 . . . . 91.060000000000002 113.399 -179.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 47.0 mt -100.98 8.43 43.04 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 106.663 -1.606 . . . . 88.280000000000001 106.663 177.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.7 ' O ' ' OXT' ' A' ' 77' ' ' ARG . . . -178.54 -169.73 0.19 Allowed 'General case' 0 C--O 1.235 0.313 0 N-CA-C 101.819 -3.4 . . . . 114.73999999999999 101.819 -178.147 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.7 ' OXT' ' O ' ' A' ' 76' ' ' ALA . 8.3 ttp180 . . . . . 0 CA--C 1.564 1.482 0 N-CA-C 118.367 2.729 . . . . 123.81 118.367 176.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' MPD . . . . . 0.681 ' H52' ' O2 ' ' A' ' 101' ' ' MPD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_