data_4f17_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 4f17 _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 ' 7' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 . . . . . 0 C--O 1.274 2.352 0 N-CA-C 103.739 -2.689 . . . . 49.520000000000003 103.739 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 83.8 mt -110.77 145.42 38.14 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 113.407 -1.724 . . . . 25.449999999999999 106.778 176.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.0 m -124.87 153.39 31.88 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 N-CA-C 109.422 -0.585 . . . . 24.469999999999999 109.422 170.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 35.6 tp -101.75 131.72 47.88 Favored 'General case' 0 N--CA 1.446 -0.629 0 O-C-N 121.643 -0.66 . . . . 29.739999999999998 109.511 175.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -72.66 118.15 15.23 Favored 'General case' 0 C--O 1.248 1.01 0 N-CA-C 109.265 -0.643 . . . . 21.5 109.265 173.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 29.2 mt -81.94 -25.05 35.22 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 115.787 1.773 . . . . 31.260000000000002 115.787 175.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -138.14 159.01 43.16 Favored 'General case' 0 C--O 1.256 1.41 0 C-N-CA 125.582 1.553 . . . . 38.600000000000001 110.359 179.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 91.5 m-20 -65.14 146.1 55.42 Favored 'General case' 0 C--O 1.263 1.774 0 N-CA-C 108.369 -0.974 . . . . 37.75 108.369 166.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -141.86 125.45 16.81 Favored 'General case' 0 C--O 1.244 0.784 0 N-CA-C 108.937 -0.764 . . . . 23.129999999999999 108.937 169.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 31.4 tt0 -101.67 128.12 48.12 Favored 'General case' 0 C--O 1.201 -1.492 0 C-N-CA 119.817 -0.753 . . . . 53.229999999999997 109.613 177.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -57.92 138.55 55.69 Favored 'General case' 0 C--O 1.244 0.783 0 N-CA-C 113.033 0.753 . . . . 29.23 113.033 -176.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.9 mttm -125.07 5.98 7.91 Favored 'General case' 0 C--N 1.309 -1.156 0 O-C-N 125.727 1.892 . . . . 39.149999999999999 113.369 -176.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 6.6 p -155.18 166.26 16.53 Favored Pre-proline 0 C--O 1.248 1.014 0 N-CA-C 107.882 -1.155 . . . . 30.23 107.882 177.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_exo -60.89 -28.13 85.87 Favored 'Trans proline' 0 C--O 1.251 1.135 0 N-CA-C 115.293 1.228 . . . . 28.73 115.293 -175.519 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ARG . . . . . 0.588 ' NH2' ' O ' ' A' ' 136' ' ' HOH . 14.8 ptt180 -85.3 -5.36 59.32 Favored 'General case' 0 C--O 1.241 0.628 0 CA-C-O 117.194 -1.384 . . . . 46.299999999999997 111.646 -176.973 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 79.3 mt-10 -98.7 159.09 15.19 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-N 119.351 0.978 . . . . 25.600000000000001 113.333 -175.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 17.1 m -123.69 166.88 18.18 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.057 0 CA-C-O 121.729 0.776 . . . . 26.010000000000002 109.696 172.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 17.1 m -102.75 141.0 36.3 Favored 'General case' 0 N--CA 1.442 -0.827 0 O-C-N 121.164 -0.96 . . . . 23.050000000000001 109.464 -178.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 24.7 ptt? -137.14 161.23 36.7 Favored 'General case' 0 CA--C 1.499 -0.996 0 C-N-CA 119.496 -0.882 . . . . 21.859999999999999 109.518 175.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 63.6 mttt -115.26 147.49 40.32 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-N 114.824 -1.08 . . . . 53.68 109.155 176.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 48.5 tttp -52.71 132.59 36.39 Favored 'General case' 0 C--O 1.255 1.353 0 N-CA-C 108.182 -1.044 . . . . 45.310000000000002 108.182 177.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 95.98 -9.7 68.02 Favored Glycine 0 N--CA 1.476 1.351 0 C-N-CA 120.74 -0.743 . . . . 22.710000000000001 114.701 -179.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 -70.05 143.01 52.62 Favored 'General case' 0 CA--C 1.494 -1.209 0 CA-C-O 122.346 1.069 . . . . 24.100000000000001 108.409 178.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 36.3 mm -105.93 116.54 49.92 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 N-CA-C 107.741 -1.207 . . . . 24.18 107.741 173.38 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 36.4 mt -109.9 151.93 26.44 Favored 'General case' 0 CA--C 1.499 -0.999 0 CA-C-N 115.534 -0.757 . . . . 25.559999999999999 110.04 -171.331 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.6 m -87.3 127.92 35.18 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 107.934 -1.136 . . . . 22.719999999999999 107.934 174.166 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 56.5 tp -92.58 126.09 37.51 Favored 'General case' 0 CA--C 1.5 -0.944 0 O-C-N 124.868 1.355 . . . . 23.059999999999999 110.049 -178.401 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 90.4 mt -104.35 -36.85 7.45 Favored 'General case' 0 C--N 1.346 0.439 0 CA-C-O 118.565 -0.731 . . . . 27.370000000000001 111.212 -174.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 36.7 t-20 -156.61 117.37 3.69 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 106.186 -1.783 . . . . 23.149999999999999 106.186 -174.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 25.8 p -119.85 30.64 6.93 Favored 'General case' 0 CA--C 1.49 -1.348 0 CA-C-N 116.491 -0.322 . . . . 24.559999999999999 110.875 176.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 79.7 p -70.3 -29.5 66.25 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 117.718 -1.593 . . . . 23.09 114.425 177.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -82.53 139.87 33.63 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 119.036 0.835 . . . . 21.670000000000002 111.475 177.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.8 pttp -75.18 -18.93 60.06 Favored 'General case' 0 C--O 1.258 1.514 0 C-N-CA 117.62 -1.632 . . . . 47.850000000000001 112.85 -175.69 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -106.45 -31.04 8.73 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 114.988 1.477 . . . . 31.620000000000001 114.988 -172.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 96.4 m95 -133.04 122.87 24.8 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 106.934 -1.506 . . . . 24.370000000000001 106.934 -170.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 37.2 m0 -112.1 143.76 42.6 Favored 'General case' 0 C--O 1.249 1.041 0 O-C-N 120.259 -1.525 . . . . 25.850000000000001 109.928 -179.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 71.9 tttt -90.65 126.25 35.91 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 116.118 -0.492 . . . . 42.619999999999997 110.764 178.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.4 m -131.11 162.32 39.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.432 0 O-C-N 124.805 1.315 . . . . 21.109999999999999 109.336 -173.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -113.25 130.07 56.34 Favored 'General case' 0 C--N 1.349 0.551 0 N-CA-C 106.865 -1.532 . . . . 41.93 106.865 169.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 33.7 t -125.44 84.07 0.85 Allowed 'Isoleucine or valine' 0 CA--C 1.48 -1.739 1 N-CA-C 95.199 -5.852 . . . . 42.030000000000001 95.199 -178.061 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 44.96 94.13 0.01 OUTLIER 'General case' 0 C--O 1.24 0.559 0 O-C-N 125.432 1.707 . . . . 57.600000000000001 114.009 174.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.8 p30 52.59 11.9 0.22 Allowed 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 116.592 2.071 . . . . 62.07 116.592 179.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 75.2 mtp180 -120.71 144.15 48.38 Favored 'General case' 0 C--O 1.239 0.549 0 C-N-CA 118.939 -1.104 . . . . 42.530000000000001 108.518 154.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -124.88 141.34 52.18 Favored 'General case' 0 C--O 1.253 1.239 0 N-CA-C 107.61 -1.256 . . . . 48.520000000000003 107.61 176.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 172.99 -168.58 41.65 Favored Glycine 0 C--O 1.207 -1.584 0 C-N-CA 117.972 -2.061 . . . . 22.850000000000001 108.41 177.298 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -101.69 141.04 35.15 Favored 'General case' 0 CA--C 1.499 -0.997 0 N-CA-C 114.636 1.347 . . . . 22.93 114.636 -172.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 27.6 m -129.9 162.33 54.25 Favored Pre-proline 0 C--N 1.319 -0.738 0 CA-C-N 114.654 -1.157 . . . . 19.390000000000001 108.49 169.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -66.96 128.19 18.28 Favored 'Trans proline' 0 C--O 1.246 0.912 0 CA-C-N 118.785 0.602 . . . . 20.170000000000002 112.021 178.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -56.15 -36.02 67.83 Favored 'General case' 0 C--O 1.245 0.857 0 O-C-N 121.362 -0.836 . . . . 20.559999999999999 113.176 178.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -63.18 -18.88 63.97 Favored 'General case' 0 CA--C 1.491 -1.303 0 N-CA-C 113.365 0.876 . . . . 25.530000000000001 113.365 179.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 6.2 m-30 -95.5 1.7 54.07 Favored 'General case' 0 C--O 1.244 0.814 0 CA-C-O 116.322 -1.799 . . . . 26.41 110.613 -172.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 21.8 m -125.5 160.08 32.16 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 127.026 2.704 . . . . 25.98 110.344 178.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 16.7 tttt -130.33 125.68 35.28 Favored 'General case' 0 N--CA 1.44 -0.953 0 N-CA-C 106.521 -1.659 . . . . 53.609999999999999 106.521 178.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -65.42 141.76 58.42 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 109.906 -0.405 . . . . 53.490000000000002 109.906 177.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 66.7 mt . . . . . 0 CA--C 1.545 0.768 0 N-CA-C 114.766 1.395 . . . . 42.109999999999999 114.766 178.791 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' HOH . . . . . 0.588 ' O ' ' NH2' ' A' ' 21' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 . . . . . 0 C--O 1.274 2.352 0 N-CA-C 103.739 -2.689 . . . . 49.520000000000003 103.739 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 83.8 mt -110.77 145.42 38.14 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 113.407 -1.724 . . . . 25.449999999999999 106.778 176.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.0 m -124.87 153.39 31.88 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 N-CA-C 109.422 -0.585 . . . . 24.469999999999999 109.422 170.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 35.6 tp -101.75 131.72 47.88 Favored 'General case' 0 N--CA 1.446 -0.629 0 O-C-N 121.643 -0.66 . . . . 29.739999999999998 109.511 175.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -72.66 118.15 15.23 Favored 'General case' 0 C--O 1.248 1.01 0 N-CA-C 109.265 -0.643 . . . . 21.5 109.265 173.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 29.2 mt -81.94 -25.05 35.22 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 115.787 1.773 . . . . 31.260000000000002 115.787 175.3 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -138.14 159.01 43.16 Favored 'General case' 0 C--O 1.256 1.41 0 C-N-CA 125.582 1.553 . . . . 38.600000000000001 110.359 179.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 91.5 m-20 -65.14 146.1 55.42 Favored 'General case' 0 C--O 1.263 1.774 0 N-CA-C 108.369 -0.974 . . . . 37.75 108.369 166.762 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -141.86 125.45 16.81 Favored 'General case' 0 C--O 1.244 0.784 0 N-CA-C 108.937 -0.764 . . . . 23.129999999999999 108.937 169.215 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLN . . . . . 0.772 ' HG2' ' O ' ' A' ' 123' ' ' HOH . 31.4 tt0 -101.67 128.12 48.12 Favored 'General case' 0 C--O 1.201 -1.492 0 C-N-CA 119.817 -0.753 . . . . 53.229999999999997 109.613 177.202 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -57.92 138.55 55.69 Favored 'General case' 0 C--O 1.244 0.783 0 N-CA-C 113.033 0.753 . . . . 29.23 113.033 -176.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.9 mttm -125.07 5.98 7.91 Favored 'General case' 0 C--N 1.309 -1.156 0 O-C-N 125.727 1.892 . . . . 39.149999999999999 113.369 -176.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 6.6 p -155.18 166.26 16.53 Favored Pre-proline 0 C--O 1.248 1.014 0 N-CA-C 107.882 -1.155 . . . . 30.23 107.882 177.266 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_exo -60.89 -28.13 85.87 Favored 'Trans proline' 0 C--O 1.251 1.135 0 N-CA-C 115.293 1.228 . . . . 28.73 115.293 -175.519 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ARG . . . . . 0.473 ' NH2' ' O ' ' A' ' 136' ' ' HOH . 14.8 ptt180 -85.3 -5.36 59.32 Favored 'General case' 0 C--O 1.241 0.628 0 CA-C-O 117.194 -1.384 . . . . 46.299999999999997 111.646 -176.973 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 79.3 mt-10 -98.7 159.09 15.19 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-N 119.351 0.978 . . . . 25.600000000000001 113.333 -175.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 17.1 m -123.69 166.88 18.18 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.057 0 CA-C-O 121.729 0.776 . . . . 26.010000000000002 109.696 172.128 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 17.1 m -102.75 141.0 36.3 Favored 'General case' 0 N--CA 1.442 -0.827 0 O-C-N 121.164 -0.96 . . . . 23.050000000000001 109.464 -178.141 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 24.7 ptt? -137.14 161.23 36.7 Favored 'General case' 0 CA--C 1.499 -0.996 0 C-N-CA 119.496 -0.882 . . . . 21.859999999999999 109.518 175.791 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LYS . . . . . 0.477 ' HD2' ' O ' ' A' ' 126' ' ' HOH . 63.6 mttt -115.26 147.49 40.32 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-N 114.824 -1.08 . . . . 53.68 109.155 176.252 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 48.5 tttp -52.71 132.59 36.39 Favored 'General case' 0 C--O 1.255 1.353 0 N-CA-C 108.182 -1.044 . . . . 45.310000000000002 108.182 177.028 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 95.98 -9.7 68.02 Favored Glycine 0 N--CA 1.476 1.351 0 C-N-CA 120.74 -0.743 . . . . 22.710000000000001 114.701 -179.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 -70.05 143.01 52.62 Favored 'General case' 0 CA--C 1.494 -1.209 0 CA-C-O 122.346 1.069 . . . . 24.100000000000001 108.409 178.651 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 36.3 mm -105.93 116.54 49.92 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 N-CA-C 107.741 -1.207 . . . . 24.18 107.741 173.38 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LEU . . . . . 0.607 HD22 HG22 ' A' ' 46' ' ' VAL . 36.4 mt -109.9 151.93 26.44 Favored 'General case' 0 CA--C 1.499 -0.999 0 CA-C-N 115.534 -0.757 . . . . 25.559999999999999 110.04 -171.331 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.6 m -87.3 127.92 35.18 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 107.934 -1.136 . . . . 22.719999999999999 107.934 174.166 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 56.5 tp -92.58 126.09 37.51 Favored 'General case' 0 CA--C 1.5 -0.944 0 O-C-N 124.868 1.355 . . . . 23.059999999999999 110.049 -178.401 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 90.4 mt -104.35 -36.85 7.45 Favored 'General case' 0 C--N 1.346 0.439 0 CA-C-O 118.565 -0.731 . . . . 27.370000000000001 111.212 -174.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 36.7 t-20 -156.61 117.37 3.69 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 106.186 -1.783 . . . . 23.149999999999999 106.186 -174.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 25.8 p -119.85 30.64 6.93 Favored 'General case' 0 CA--C 1.49 -1.348 0 CA-C-N 116.491 -0.322 . . . . 24.559999999999999 110.875 176.856 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 79.7 p -70.3 -29.5 66.25 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 117.718 -1.593 . . . . 23.09 114.425 177.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -82.53 139.87 33.63 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 119.036 0.835 . . . . 21.670000000000002 111.475 177.31 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.8 pttp -75.18 -18.93 60.06 Favored 'General case' 0 C--O 1.258 1.514 0 C-N-CA 117.62 -1.632 . . . . 47.850000000000001 112.85 -175.69 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -106.45 -31.04 8.73 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 114.988 1.477 . . . . 31.620000000000001 114.988 -172.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 96.4 m95 -133.04 122.87 24.8 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 106.934 -1.506 . . . . 24.370000000000001 106.934 -170.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 37.2 m0 -112.1 143.76 42.6 Favored 'General case' 0 C--O 1.249 1.041 0 O-C-N 120.259 -1.525 . . . . 25.850000000000001 109.928 -179.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 71.9 tttt -90.65 126.25 35.91 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 116.118 -0.492 . . . . 42.619999999999997 110.764 178.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.4 m -131.11 162.32 39.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.432 0 O-C-N 124.805 1.315 . . . . 21.109999999999999 109.336 -173.701 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -113.25 130.07 56.34 Favored 'General case' 0 C--N 1.349 0.551 0 N-CA-C 106.865 -1.532 . . . . 41.93 106.865 169.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' VAL . . . . . 0.607 HG22 HD22 ' A' ' 31' ' ' LEU . 33.7 t -125.44 84.07 0.85 Allowed 'Isoleucine or valine' 0 CA--C 1.48 -1.739 1 N-CA-C 95.199 -5.852 . . . . 42.030000000000001 95.199 -178.061 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 44.96 94.13 0.01 OUTLIER 'General case' 0 C--O 1.24 0.559 0 O-C-N 125.432 1.707 . . . . 57.600000000000001 114.009 174.046 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.8 p30 52.59 11.9 0.22 Allowed 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 116.592 2.071 . . . . 62.07 116.592 179.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 75.2 mtp180 -120.71 144.15 48.38 Favored 'General case' 0 C--O 1.239 0.549 0 C-N-CA 118.939 -1.104 . . . . 42.530000000000001 108.518 154.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -124.88 141.34 52.18 Favored 'General case' 0 C--O 1.253 1.239 0 N-CA-C 107.61 -1.256 . . . . 48.520000000000003 107.61 176.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 172.99 -168.58 41.65 Favored Glycine 0 C--O 1.207 -1.584 0 C-N-CA 117.972 -2.061 . . . . 22.850000000000001 108.41 177.298 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -101.69 141.04 35.15 Favored 'General case' 0 CA--C 1.499 -0.997 0 N-CA-C 114.636 1.347 . . . . 22.93 114.636 -172.781 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 27.6 m -129.9 162.33 54.25 Favored Pre-proline 0 C--N 1.319 -0.738 0 CA-C-N 114.654 -1.157 . . . . 19.390000000000001 108.49 169.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -66.96 128.19 18.28 Favored 'Trans proline' 0 C--O 1.246 0.912 0 CA-C-N 118.785 0.602 . . . . 20.170000000000002 112.021 178.199 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -56.15 -36.02 67.83 Favored 'General case' 0 C--O 1.245 0.857 0 O-C-N 121.362 -0.836 . . . . 20.559999999999999 113.176 178.245 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -63.18 -18.88 63.97 Favored 'General case' 0 CA--C 1.491 -1.303 0 N-CA-C 113.365 0.876 . . . . 25.530000000000001 113.365 179.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 6.2 m-30 -95.5 1.7 54.07 Favored 'General case' 0 C--O 1.244 0.814 0 CA-C-O 116.322 -1.799 . . . . 26.41 110.613 -172.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 21.8 m -125.5 160.08 32.16 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 127.026 2.704 . . . . 25.98 110.344 178.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 16.7 tttt -130.33 125.68 35.28 Favored 'General case' 0 N--CA 1.44 -0.953 0 N-CA-C 106.521 -1.659 . . . . 53.609999999999999 106.521 178.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -65.42 141.76 58.42 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 109.906 -0.405 . . . . 53.490000000000002 109.906 177.062 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 66.7 mt . . . . . 0 CA--C 1.545 0.768 0 N-CA-C 114.766 1.395 . . . . 42.109999999999999 114.766 178.791 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 123' ' ' HOH . . . . . 0.772 ' O ' ' HG2' ' A' ' 16' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 126' ' ' HOH . . . . . 0.477 ' O ' ' HD2' ' A' ' 26' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 136' ' ' HOH . . . . . 0.473 ' O ' ' NH2' ' A' ' 21' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 . . . . . 0 C--O 1.274 2.352 0 N-CA-C 103.739 -2.689 . . . . 49.520000000000003 103.739 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 83.8 mt -110.77 145.42 38.14 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 113.407 -1.724 . . . . 25.449999999999999 106.778 176.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 27.0 m -124.87 153.39 31.88 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.393 0 N-CA-C 109.422 -0.585 . . . . 24.469999999999999 109.422 170.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 35.6 tp -101.75 131.72 47.88 Favored 'General case' 0 N--CA 1.446 -0.629 0 O-C-N 121.643 -0.66 . . . . 29.739999999999998 109.511 175.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -72.66 118.15 15.23 Favored 'General case' 0 C--O 1.248 1.01 0 N-CA-C 109.265 -0.643 . . . . 21.5 109.265 173.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 29.2 mt -81.94 -25.05 35.22 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 115.787 1.773 . . . . 31.260000000000002 115.787 175.3 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 48.4 m-85 -138.14 159.01 43.16 Favored 'General case' 0 C--O 1.256 1.41 0 C-N-CA 125.582 1.553 . . . . 38.600000000000001 110.359 179.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 91.5 m-20 -65.14 146.1 55.42 Favored 'General case' 0 C--O 1.263 1.774 0 N-CA-C 108.369 -0.974 . . . . 37.75 108.369 166.762 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 84.4 t80 -141.86 125.45 16.81 Favored 'General case' 0 C--O 1.244 0.784 0 N-CA-C 108.937 -0.764 . . . . 23.129999999999999 108.937 169.215 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLN . . . . . 0.772 ' HG2' ' O ' ' A' ' 123' ' ' HOH . 31.4 tt0 -101.67 128.12 48.12 Favored 'General case' 0 C--O 1.201 -1.492 0 C-N-CA 119.817 -0.753 . . . . 53.229999999999997 109.613 177.202 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -57.92 138.55 55.69 Favored 'General case' 0 C--O 1.244 0.783 0 N-CA-C 113.033 0.753 . . . . 29.23 113.033 -176.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 8.9 mttm -125.07 5.98 7.91 Favored 'General case' 0 C--N 1.309 -1.156 0 O-C-N 125.727 1.892 . . . . 39.149999999999999 113.369 -176.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 6.6 p -155.18 166.26 16.53 Favored Pre-proline 0 C--O 1.248 1.014 0 N-CA-C 107.882 -1.155 . . . . 30.23 107.882 177.266 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 79.5 Cg_exo -60.89 -28.13 85.87 Favored 'Trans proline' 0 C--O 1.251 1.135 0 N-CA-C 115.293 1.228 . . . . 28.73 115.293 -175.519 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.473 ' NH2' ' O ' ' A' ' 136' ' ' HOH . 14.8 ptt180 -85.3 -5.36 59.32 Favored 'General case' 0 C--O 1.241 0.628 0 CA-C-O 117.194 -1.384 . . . . 46.299999999999997 111.646 -176.973 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 79.3 mt-10 -98.7 159.09 15.19 Favored 'General case' 0 N--CA 1.483 1.186 0 CA-C-N 119.351 0.978 . . . . 25.600000000000001 113.333 -175.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 17.1 m -123.69 166.88 18.18 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.057 0 CA-C-O 121.729 0.776 . . . . 26.010000000000002 109.696 172.128 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 17.1 m -102.75 141.0 36.3 Favored 'General case' 0 N--CA 1.442 -0.827 0 O-C-N 121.164 -0.96 . . . . 23.050000000000001 109.464 -178.141 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 24.7 ptt? -137.14 161.23 36.7 Favored 'General case' 0 CA--C 1.499 -0.996 0 C-N-CA 119.496 -0.882 . . . . 21.859999999999999 109.518 175.791 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LYS . . . . . 0.477 ' HD2' ' O ' ' A' ' 126' ' ' HOH . 63.6 mttt -115.26 147.49 40.32 Favored 'General case' 0 CA--C 1.51 -0.574 0 CA-C-N 114.824 -1.08 . . . . 53.68 109.155 176.252 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 48.5 tttp -52.71 132.59 36.39 Favored 'General case' 0 C--O 1.255 1.353 0 N-CA-C 108.182 -1.044 . . . . 45.310000000000002 108.182 177.028 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 95.98 -9.7 68.02 Favored Glycine 0 N--CA 1.476 1.351 0 C-N-CA 120.74 -0.743 . . . . 22.710000000000001 114.701 -179.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 75.7 m-20 -70.05 143.01 52.62 Favored 'General case' 0 CA--C 1.494 -1.209 0 CA-C-O 122.346 1.069 . . . . 24.100000000000001 108.409 178.651 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 36.3 mm -105.93 116.54 49.92 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.014 0 N-CA-C 107.741 -1.207 . . . . 24.18 107.741 173.38 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.607 HD22 HG22 ' A' ' 46' ' ' VAL . 36.4 mt -109.9 151.93 26.44 Favored 'General case' 0 CA--C 1.499 -0.999 0 CA-C-N 115.534 -0.757 . . . . 25.559999999999999 110.04 -171.331 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 29.6 m -87.3 127.92 35.18 Favored 'General case' 0 C--O 1.221 -0.423 0 N-CA-C 107.934 -1.136 . . . . 22.719999999999999 107.934 174.166 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 56.5 tp -92.58 126.09 37.51 Favored 'General case' 0 CA--C 1.5 -0.944 0 O-C-N 124.868 1.355 . . . . 23.059999999999999 110.049 -178.401 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 90.4 mt -104.35 -36.85 7.45 Favored 'General case' 0 C--N 1.346 0.439 0 CA-C-O 118.565 -0.731 . . . . 27.370000000000001 111.212 -174.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 36.7 t-20 -156.61 117.37 3.69 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 106.186 -1.783 . . . . 23.149999999999999 106.186 -174.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 25.8 p -119.85 30.64 6.93 Favored 'General case' 0 CA--C 1.49 -1.348 0 CA-C-N 116.491 -0.322 . . . . 24.559999999999999 110.875 176.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 79.7 p -70.3 -29.5 66.25 Favored 'General case' 0 N--CA 1.466 0.341 0 C-N-CA 117.718 -1.593 . . . . 23.09 114.425 177.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 21.7 t-20 -82.53 139.87 33.63 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-N 119.036 0.835 . . . . 21.670000000000002 111.475 177.31 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.8 pttp -75.18 -18.93 60.06 Favored 'General case' 0 C--O 1.258 1.514 0 C-N-CA 117.62 -1.632 . . . . 47.850000000000001 112.85 -175.69 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -106.45 -31.04 8.73 Favored 'General case' 0 C--O 1.238 0.468 0 N-CA-C 114.988 1.477 . . . . 31.620000000000001 114.988 -172.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 96.4 m95 -133.04 122.87 24.8 Favored 'General case' 0 N--CA 1.492 1.64 0 N-CA-C 106.934 -1.506 . . . . 24.370000000000001 106.934 -170.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 37.2 m0 -112.1 143.76 42.6 Favored 'General case' 0 C--O 1.249 1.041 0 O-C-N 120.259 -1.525 . . . . 25.850000000000001 109.928 -179.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 71.9 tttt -90.65 126.25 35.91 Favored 'General case' 0 C--N 1.316 -0.855 0 CA-C-N 116.118 -0.492 . . . . 42.619999999999997 110.764 178.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 35.4 m -131.11 162.32 39.44 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.432 0 O-C-N 124.805 1.315 . . . . 21.109999999999999 109.336 -173.701 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.2 tt0 -113.25 130.07 56.34 Favored 'General case' 0 C--N 1.349 0.551 0 N-CA-C 106.865 -1.532 . . . . 41.93 106.865 169.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' VAL . . . . . 0.607 HG22 HD22 ' A' ' 31' ' ' LEU . 33.7 t -125.44 84.07 0.85 Allowed 'Isoleucine or valine' 0 CA--C 1.48 -1.739 1 N-CA-C 95.199 -5.852 . . . . 42.030000000000001 95.199 -178.061 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 29.0 t-20 44.96 94.13 0.01 OUTLIER 'General case' 0 C--O 1.24 0.559 0 O-C-N 125.432 1.707 . . . . 57.600000000000001 114.009 174.046 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 2.8 p30 52.59 11.9 0.22 Allowed 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 116.592 2.071 . . . . 62.07 116.592 179.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 75.2 mtp180 -120.71 144.15 48.38 Favored 'General case' 0 C--O 1.239 0.549 0 C-N-CA 118.939 -1.104 . . . . 42.530000000000001 108.518 154.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -124.88 141.34 52.18 Favored 'General case' 0 C--O 1.253 1.239 0 N-CA-C 107.61 -1.256 . . . . 48.520000000000003 107.61 176.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 172.99 -168.58 41.65 Favored Glycine 0 C--O 1.207 -1.584 0 C-N-CA 117.972 -2.061 . . . . 22.850000000000001 108.41 177.298 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 92.0 m-85 -101.69 141.04 35.15 Favored 'General case' 0 CA--C 1.499 -0.997 0 N-CA-C 114.636 1.347 . . . . 22.93 114.636 -172.781 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 27.6 m -129.9 162.33 54.25 Favored Pre-proline 0 C--N 1.319 -0.738 0 CA-C-N 114.654 -1.157 . . . . 19.390000000000001 108.49 169.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -66.96 128.19 18.28 Favored 'Trans proline' 0 C--O 1.246 0.912 0 CA-C-N 118.785 0.602 . . . . 20.170000000000002 112.021 178.199 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -56.15 -36.02 67.83 Favored 'General case' 0 C--O 1.245 0.857 0 O-C-N 121.362 -0.836 . . . . 20.559999999999999 113.176 178.245 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -63.18 -18.88 63.97 Favored 'General case' 0 CA--C 1.491 -1.303 0 N-CA-C 113.365 0.876 . . . . 25.530000000000001 113.365 179.807 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 6.2 m-30 -95.5 1.7 54.07 Favored 'General case' 0 C--O 1.244 0.814 0 CA-C-O 116.322 -1.799 . . . . 26.41 110.613 -172.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 21.8 m -125.5 160.08 32.16 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.863 0 O-C-N 127.026 2.704 . . . . 25.98 110.344 178.306 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 16.7 tttt -130.33 125.68 35.28 Favored 'General case' 0 N--CA 1.44 -0.953 0 N-CA-C 106.521 -1.659 . . . . 53.609999999999999 106.521 178.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 1.6 mtpt -65.42 141.76 58.42 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 109.906 -0.405 . . . . 53.490000000000002 109.906 177.062 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 66.7 mt . . . . . 0 CA--C 1.545 0.768 0 N-CA-C 114.766 1.395 . . . . 42.109999999999999 114.766 178.791 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' HOH . . . . . 0.772 ' O ' ' HG2' ' A' ' 16' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' HOH . . . . . 0.477 ' O ' ' HD2' ' A' ' 26' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' HOH . . . . . 0.473 ' O ' ' NH2' ' A' ' 21' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_