data_6o6d_residue ############################ # Computer software used # ############################ 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 6o6d _Structure_validation_residue.Date_analyzed 2019-03-08 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 ' 5' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 . . . . . 0 C--O 1.281 2.716 0 CA-C-O 120.265 0.079 . . . . 90.900000000000006 110.868 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 97.7 t -107.97 132.36 55.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 CA-C-O 116.679 -1.629 . . . . 66.439999999999998 108.422 -176.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 11.2 mp -74.85 138.9 42.82 Favored 'General case' 0 C--O 1.256 1.422 0 CA-C-O 117.574 -1.203 . . . . 58.509999999999998 109.815 176.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 72.0 mt -131.38 146.48 52.29 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 126.027 2.079 . . . . 51.119999999999997 110.581 -176.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 54.04 -124.24 2.2 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 126.063 2.102 . . . . 41.840000000000003 107.054 158.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -70.54 -11.41 68.46 Favored Glycine 0 N--CA 1.483 1.775 0 CA-C-O 118.512 -1.16 . . . . 46.549999999999997 112.562 -166.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -82.38 -6.53 59.33 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 124.927 1.291 . . . . 53.890000000000001 110.825 -179.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 82.6 mt -97.99 105.47 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.431 0 N-CA-C 106.685 -1.598 . . . . 37.880000000000003 106.685 -177.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ASN . . . . . 0.624 ' ND2' ' O ' ' A' ' 101' ' ' HOH . 23.4 m120 -123.88 98.89 6.0 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 106.597 -1.631 . . . . 44.219999999999999 106.597 -173.705 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -142.57 144.76 33.03 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 107.521 -1.289 . . . . 40.460000000000001 107.521 173.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 52.2 mttt -64.61 -32.17 73.71 Favored 'General case' 0 N--CA 1.484 1.262 0 O-C-N 124.142 0.901 . . . . 76.980000000000004 110.021 175.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 69.4 mt-10 -139.41 134.54 32.54 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 115.831 -2.033 . . . . 63.289999999999999 107.888 -177.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 33.5 m -136.18 150.25 27.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 O-C-N 127.579 3.049 . . . . 32.689999999999998 107.855 167.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 53.3 ttm-85 -88.8 113.84 24.78 Favored 'General case' 0 C--O 1.254 1.334 0 N-CA-C 105.36 -2.089 . . . . 39.359999999999999 105.36 169.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 47.4 t -105.59 121.67 44.45 Favored 'General case' 0 C--O 1.267 1.985 0 O-C-N 124.476 1.11 . . . . 39.700000000000003 109.494 -171.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 62.0 t -127.03 151.09 33.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 N-CA-C 107.257 -1.386 . . . . 46.5 107.257 -176.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -96.44 -177.12 35.78 Favored Glycine 0 C--N 1.304 -1.247 0 N-CA-C 108.607 -1.797 . . . . 39.770000000000003 108.607 179.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 32.9 t0 -84.08 -7.93 59.25 Favored 'General case' 0 C--O 1.276 2.496 0 CA-C-O 118.234 -0.889 . . . . 59.469999999999999 111.316 -172.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -128.53 42.25 3.35 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 116.79 -1.576 . . . . 74.579999999999998 110.032 177.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 83.68 7.82 85.47 Favored Glycine 0 N--CA 1.476 1.304 0 O-C-N 125.231 1.582 . . . . 52.810000000000002 112.739 176.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 29.7 mp0 -66.22 132.13 47.71 Favored 'General case' 0 N--CA 1.498 1.956 0 CA-C-N 120.205 2.002 . . . . 51.909999999999997 109.233 -179.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 24.1 t -96.44 119.88 45.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 CA-C-O 116.991 -1.481 . . . . 51.100000000000001 107.009 177.1 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 95.0 m-85 -99.97 -16.07 18.07 Favored 'General case' 0 C--O 1.21 -0.992 0 CA-C-N 119.716 1.144 . . . . 41.509999999999998 111.299 169.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 91.96 -160.02 25.94 Favored Glycine 0 N--CA 1.477 1.428 0 C-N-CA 126.846 2.165 . . . . 34.439999999999998 110.251 179.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 94.2 mt -97.82 119.16 45.48 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.361 0 N-CA-C 105.919 -1.882 . . . . 39.530000000000001 105.919 177.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 28.5 pt -141.17 171.05 12.9 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.309 0 N-CA-C 105.764 -1.939 . . . . 33.18 105.764 -176.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 51.7 p -68.14 157.67 34.83 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-N 118.384 0.538 . . . . 40.149999999999999 109.711 173.632 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 39.4 p -62.84 -33.81 76.02 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 117.938 -1.029 . . . . 38.420000000000002 108.429 174.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 24.9 mttt -61.9 -45.87 91.86 Favored 'General case' 0 C--O 1.258 1.507 0 CA-C-N 118.553 0.615 . . . . 83.269999999999996 109.471 178.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 20.0 tp10 -66.17 -41.75 89.89 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 108.118 -1.068 . . . . 50.829999999999998 108.118 179.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -63.75 -41.1 98.07 Favored 'General case' 0 C--O 1.254 1.292 0 CA-C-N 119.547 1.067 . . . . 33.630000000000003 108.846 -177.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 65.3 tp -64.64 -44.32 90.84 Favored 'General case' 0 N--CA 1.489 1.503 0 CA-C-O 118.194 -0.908 . . . . 42.479999999999997 109.341 178.223 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.8 ttpt -57.5 -42.69 83.23 Favored 'General case' 0 C--O 1.243 0.727 0 CA-C-N 119.935 1.243 . . . . 54.060000000000002 108.711 176.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 83.1 mt -66.24 -47.67 83.67 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 N-CA-C 107.697 -1.223 . . . . 36.710000000000001 107.697 -179.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.46 -46.34 86.8 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 119.296 0.953 . . . . 37.329999999999998 109.333 -177.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -62.95 -43.35 99.04 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 109.593 -0.521 . . . . 56.509999999999998 109.593 -176.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 36.2 m-80 -70.78 -22.54 62.36 Favored 'General case' 0 N--CA 1.483 1.225 0 CA-C-O 118.584 -0.722 . . . . 44.789999999999999 109.611 -177.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.3 mp -93.84 2.43 56.19 Favored 'General case' 0 N--CA 1.486 1.368 0 CA-C-O 118.065 -0.969 . . . . 52.079999999999998 111.473 177.08 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 73.07 23.58 77.47 Favored Glycine 0 N--CA 1.476 1.35 0 CA-C-N 120.185 1.357 . . . . 47.789999999999999 110.311 178.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 54.2 mt -120.84 175.44 6.04 Favored 'General case' 0 C--O 1.284 2.907 0 CA-C-N 118.814 1.307 . . . . 49.689999999999998 111.09 -174.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 44.6 m-20 -93.2 158.27 15.84 Favored 'General case' 0 C--O 1.265 1.892 0 CA-C-N 114.086 -1.415 . . . . 47.950000000000003 109.522 172.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 28.8 tp -103.39 121.52 42.95 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 125.498 1.749 . . . . 36.329999999999998 106.601 163.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 29.4 t -118.82 122.72 70.09 Favored 'Isoleucine or valine' 0 C--O 1.268 2.049 0 C-N-CA 124.672 1.189 . . . . 37.259999999999998 110.113 -174.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 64.5 tp -76.53 110.88 11.45 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 124.796 1.31 . . . . 40.229999999999997 108.448 177.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 28.9 mm -85.59 -45.23 17.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 N-CA-C 108.382 -0.97 . . . . 37.840000000000003 108.382 179.389 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 44.3 t -146.89 119.85 8.75 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.121 0.568 . . . . 38.57 112.277 -178.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ALA . . . . . 0.515 ' O ' ' NZ ' ' A' ' 54' ' ' LYS . . . -87.23 -22.01 25.48 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 117.298 -1.334 . . . . 43.509999999999998 109.283 169.928 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 63.3 m -69.19 -36.46 77.35 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-N 119.413 1.006 . . . . 51.689999999999998 110.083 179.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.83 150.98 22.48 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 124.403 1.065 . . . . 36.420000000000002 108.471 177.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' LYS . . . . . 0.515 ' NZ ' ' O ' ' A' ' 51' ' ' ALA . 29.3 mmtm -130.52 112.9 16.64 Favored Pre-proline 0 N--CA 1.477 0.894 0 N-CA-C 106.519 -1.66 . . . . 68.709999999999994 106.519 179.148 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -75.13 164.98 87.1 Favored 'Cis proline' 0 C--O 1.248 1.012 0 C-N-CA 122.778 -1.759 . . . . 41.960000000000001 111.765 -3.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -58.61 144.81 97.13 Favored 'Trans proline' 0 C--O 1.205 -1.16 0 C-N-CA 121.989 1.792 . . . . 35.859999999999999 112.697 -179.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 81.3 t -96.32 124.7 49.17 Favored 'Isoleucine or valine' 0 C--O 1.246 0.886 0 CA-C-O 117.049 -1.453 . . . . 32.549999999999997 108.509 -176.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 91.5 m -123.51 149.27 45.4 Favored 'General case' 0 C--O 1.277 2.51 0 O-C-N 125.504 1.753 . . . . 35.340000000000003 109.091 174.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 23.6 mtpt -118.57 143.74 46.56 Favored 'General case' 0 C--O 1.248 1.012 0 N-CA-C 107.554 -1.276 . . . . 44.32 107.554 175.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 84.7 t -96.03 107.55 19.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 N-CA-C 104.583 -2.377 . . . . 39.899999999999999 104.583 171.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' MSE . . . . . . . . . . . . . 22.5 ptm -162.49 171.5 16.97 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.575 -0.898 . . . . 48.109999999999999 108.575 -174.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -77.55 115.04 16.99 Favored 'General case' 0 C--O 1.259 1.59 0 N-CA-C 106.457 -1.683 . . . . 73.459999999999994 106.457 174.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 47.1 t80 -58.55 -35.46 72.38 Favored 'General case' 0 C--O 1.255 1.387 0 O-C-N 124.725 1.266 . . . . 80.379999999999995 110.467 -178.696 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -58.38 -35.7 72.4 Favored 'General case' 0 N--CA 1.489 1.478 0 CA-C-O 118.413 -0.803 . . . . 85.969999999999999 109.458 177.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -71.13 -39.78 71.8 Favored 'General case' 0 N--CA 1.487 1.416 0 CA-C-O 118.358 -0.829 . . . . 76.599999999999994 109.736 178.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' PHE . . . . . 0.492 ' O ' ' ND2' ' A' ' 70' ' ' ASN . 85.9 t80 -58.46 -51.86 68.06 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.495 -0.928 . . . . 63.740000000000002 108.495 177.631 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.9 ttt85 -56.86 -42.11 79.18 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 126.534 1.933 . . . . 120.09999999999999 108.015 -174.257 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 17.1 m-85 -76.15 -38.4 56.75 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-O 116.935 -1.507 . . . . 103.14 110.578 -177.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -54.92 -47.95 73.73 Favored 'General case' 0 N--CA 1.495 1.818 0 CA-C-N 120.216 1.371 . . . . 91.950000000000003 108.813 172.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ASN . . . . . 0.492 ' ND2' ' O ' ' A' ' 66' ' ' PHE . 36.3 m-80 . . . . . 0 N--CA 1.489 1.486 0 C-N-CA 125.021 1.329 . . . . 98.609999999999999 108.89 177.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HOH . . . . . 0.624 ' O ' ' ND2' ' A' ' 13' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 . . . . . 0 C--O 1.281 2.716 0 CA-C-O 120.265 0.079 . . . . 90.9 110.868 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 6' ' ' VAL . . . . . 0.488 HG21 ' HE2' ' A' ' 66' ' ' PHE . 97.7 t -107.97 132.36 55.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 CA-C-O 116.679 -1.629 . . . . 66.44 108.422 -176.717 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 11.2 mp -74.85 138.9 42.82 Favored 'General case' 0 C--O 1.256 1.422 0 CA-C-O 117.574 -1.203 . . . . 58.51 109.815 176.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 72.0 mt -131.38 146.48 52.29 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 126.027 2.079 . . . . 51.12 110.581 -176.363 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 54.04 -124.24 2.2 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 126.063 2.102 . . . . 41.84 107.054 158.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -70.54 -11.41 68.46 Favored Glycine 0 N--CA 1.483 1.775 0 CA-C-O 118.512 -1.16 . . . . 46.55 112.562 -166.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -82.38 -6.53 59.33 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 124.927 1.291 . . . . 53.89 110.825 -179.682 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 82.6 mt -97.99 105.47 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.431 0 N-CA-C 106.685 -1.598 . . . . 37.88 106.685 -177.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -123.88 98.89 6.0 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 106.597 -1.631 . . . . 44.22 106.597 -173.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -142.57 144.76 33.03 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 107.521 -1.289 . . . . 40.46 107.521 173.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 52.2 mttt -64.61 -32.17 73.71 Favored 'General case' 0 N--CA 1.484 1.262 0 O-C-N 124.142 0.901 . . . . 76.98 110.021 175.709 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 69.4 mt-10 -139.41 134.54 32.54 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 115.831 -2.033 . . . . 63.29 107.888 -177.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 33.5 m -136.18 150.25 27.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 O-C-N 127.579 3.049 . . . . 32.69 107.855 167.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 53.3 ttm-85 -88.8 113.84 24.78 Favored 'General case' 0 C--O 1.254 1.334 0 N-CA-C 105.36 -2.089 . . . . 39.36 105.36 169.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 47.4 t -105.59 121.67 44.45 Favored 'General case' 0 C--O 1.267 1.985 0 O-C-N 124.476 1.11 . . . . 39.7 109.494 -171.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 62.0 t -127.03 151.09 33.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 N-CA-C 107.257 -1.386 . . . . 46.5 107.257 -176.461 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -96.44 -177.12 35.78 Favored Glycine 0 C--N 1.304 -1.247 0 N-CA-C 108.607 -1.797 . . . . 39.77 108.607 179.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 32.9 t0 -84.08 -7.93 59.25 Favored 'General case' 0 C--O 1.276 2.496 0 CA-C-O 118.234 -0.889 . . . . 59.47 111.316 -172.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -128.53 42.25 3.35 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 116.79 -1.576 . . . . 74.58 110.032 177.57 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 83.68 7.82 85.47 Favored Glycine 0 N--CA 1.476 1.304 0 O-C-N 125.231 1.582 . . . . 52.81 112.739 176.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 29.7 mp0 -66.22 132.13 47.71 Favored 'General case' 0 N--CA 1.498 1.956 0 CA-C-N 120.205 2.002 . . . . 51.91 109.233 -179.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 24.1 t -96.44 119.88 45.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 CA-C-O 116.991 -1.481 . . . . 51.1 107.009 177.1 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 95.0 m-85 -99.97 -16.07 18.07 Favored 'General case' 0 C--O 1.21 -0.992 0 CA-C-N 119.716 1.144 . . . . 41.51 111.299 169.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 91.96 -160.02 25.94 Favored Glycine 0 N--CA 1.477 1.428 0 C-N-CA 126.846 2.165 . . . . 34.44 110.251 179.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 94.2 mt -97.82 119.16 45.48 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.361 0 N-CA-C 105.919 -1.882 . . . . 39.53 105.919 177.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 28.5 pt -141.17 171.05 12.9 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.309 0 N-CA-C 105.764 -1.939 . . . . 33.18 105.764 -176.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 51.7 p -68.14 157.67 34.83 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-N 118.384 0.538 . . . . 40.15 109.711 173.632 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 39.4 p -62.84 -33.81 76.02 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 117.938 -1.029 . . . . 38.42 108.429 174.451 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 24.9 mttt -61.9 -45.87 91.86 Favored 'General case' 0 C--O 1.258 1.507 0 CA-C-N 118.553 0.615 . . . . 83.27 109.471 178.299 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 20.0 tp10 -66.17 -41.75 89.89 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 108.118 -1.068 . . . . 50.83 108.118 179.299 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -63.75 -41.1 98.07 Favored 'General case' 0 C--O 1.254 1.292 0 CA-C-N 119.547 1.067 . . . . 33.63 108.846 -177.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 65.3 tp -64.64 -44.32 90.84 Favored 'General case' 0 N--CA 1.489 1.503 0 CA-C-O 118.194 -0.908 . . . . 42.48 109.341 178.223 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.8 ttpt -57.5 -42.69 83.23 Favored 'General case' 0 C--O 1.243 0.727 0 CA-C-N 119.935 1.243 . . . . 54.06 108.711 176.297 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 83.1 mt -66.24 -47.67 83.67 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 N-CA-C 107.697 -1.223 . . . . 36.71 107.697 -179.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.46 -46.34 86.8 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 119.296 0.953 . . . . 37.33 109.333 -177.117 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -62.95 -43.35 99.04 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 109.593 -0.521 . . . . 56.51 109.593 -176.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 36.2 m-80 -70.78 -22.54 62.36 Favored 'General case' 0 N--CA 1.483 1.225 0 CA-C-O 118.584 -0.722 . . . . 44.79 109.611 -177.219 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.3 mp -93.84 2.43 56.19 Favored 'General case' 0 N--CA 1.486 1.368 0 CA-C-O 118.065 -0.969 . . . . 52.08 111.473 177.08 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 73.07 23.58 77.47 Favored Glycine 0 N--CA 1.476 1.35 0 CA-C-N 120.185 1.357 . . . . 47.79 110.311 178.342 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 54.2 mt -120.84 175.44 6.04 Favored 'General case' 0 C--O 1.284 2.907 0 CA-C-N 118.814 1.307 . . . . 49.69 111.09 -174.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 44.6 m-20 -93.2 158.27 15.84 Favored 'General case' 0 C--O 1.265 1.892 0 CA-C-N 114.086 -1.415 . . . . 47.95 109.522 172.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 28.8 tp -103.39 121.52 42.95 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 125.498 1.749 . . . . 36.33 106.601 163.378 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 29.4 t -118.82 122.72 70.09 Favored 'Isoleucine or valine' 0 C--O 1.268 2.049 0 C-N-CA 124.672 1.189 . . . . 37.26 110.113 -174.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 64.5 tp -76.53 110.88 11.45 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 124.796 1.31 . . . . 40.23 108.448 177.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 28.9 mm -85.59 -45.23 17.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 N-CA-C 108.382 -0.97 . . . . 37.84 108.382 179.389 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 44.3 t -146.89 119.85 8.75 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.121 0.568 . . . . 38.57 112.277 -178.105 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ALA . . . . . 0.515 ' O ' ' NZ ' ' A' ' 54' ' ' LYS . . . -87.23 -22.01 25.48 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 117.298 -1.334 . . . . 43.51 109.283 169.928 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 63.3 m -69.19 -36.46 77.35 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-N 119.413 1.006 . . . . 51.69 110.083 179.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.83 150.98 22.48 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 124.403 1.065 . . . . 36.42 108.471 177.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' LYS . . . . . 0.515 ' NZ ' ' O ' ' A' ' 51' ' ' ALA . 29.3 mmtm -130.52 112.9 16.64 Favored Pre-proline 0 N--CA 1.477 0.894 0 N-CA-C 106.519 -1.66 . . . . 68.71 106.519 179.148 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -75.13 164.98 87.1 Favored 'Cis proline' 0 C--O 1.248 1.012 0 C-N-CA 122.778 -1.759 . . . . 41.96 111.765 -3.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -58.61 144.81 97.13 Favored 'Trans proline' 0 C--O 1.205 -1.16 0 C-N-CA 121.989 1.792 . . . . 35.86 112.697 -179.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 81.3 t -96.32 124.7 49.17 Favored 'Isoleucine or valine' 0 C--O 1.246 0.886 0 CA-C-O 117.049 -1.453 . . . . 32.55 108.509 -176.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 91.5 m -123.51 149.27 45.4 Favored 'General case' 0 C--O 1.277 2.51 0 O-C-N 125.504 1.753 . . . . 40.95 109.091 174.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 23.6 mtpt -118.57 143.74 46.56 Favored 'General case' 0 C--O 1.248 1.012 0 N-CA-C 107.554 -1.276 . . . . 44.32 107.554 175.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 84.7 t -96.03 107.55 19.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 N-CA-C 104.583 -2.377 . . . . 39.9 104.583 171.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' MSE . . . . . . . . . . . . . 22.5 ptm -162.49 171.5 16.97 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.575 -0.898 . . . . 48.11 108.575 -174.451 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -77.55 115.04 16.99 Favored 'General case' 0 C--O 1.259 1.59 0 N-CA-C 106.457 -1.683 . . . . 73.46 106.457 174.036 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 47.1 t80 -58.55 -35.46 72.38 Favored 'General case' 0 C--O 1.255 1.387 0 O-C-N 124.725 1.266 . . . . 80.38 110.467 -178.696 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -58.38 -35.7 72.4 Favored 'General case' 0 N--CA 1.489 1.478 0 CA-C-O 118.413 -0.803 . . . . 85.97 109.458 177.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -71.13 -39.78 71.8 Favored 'General case' 0 N--CA 1.487 1.416 0 CA-C-O 118.358 -0.829 . . . . 76.6 109.736 178.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' PHE . . . . . 0.488 ' HE2' HG21 ' A' ' 6' ' ' VAL . 85.9 t80 -58.46 -51.86 68.06 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.495 -0.928 . . . . 63.74 108.495 177.631 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.9 ttt85 -56.86 -42.11 79.18 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 126.534 1.933 . . . . 120.1 108.015 -174.257 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 17.1 m-85 -76.15 -38.4 56.75 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-O 116.935 -1.507 . . . . 103.14 110.578 -177.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -54.92 -47.95 73.73 Favored 'General case' 0 N--CA 1.495 1.818 0 CA-C-N 120.216 1.371 . . . . 91.95 108.813 172.179 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ASN . . . . . 0.442 ' ND2' ' O ' ' A' ' 66' ' ' PHE . 36.3 m-80 . . . . . 0 N--CA 1.489 1.486 0 C-N-CA 125.021 1.329 . . . . 98.61 108.89 177.81 . . . . . . . . 1 1 . 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 0 . 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 0 . 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 nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 . . . . . 0 C--O 1.281 2.716 0 CA-C-O 120.265 0.079 . . . . 90.900000000000006 110.868 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.488 HG21 ' HE2' ' A' ' 66' ' ' PHE . 97.7 t -107.97 132.36 55.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 CA-C-O 116.679 -1.629 . . . . 66.439999999999998 108.422 -176.717 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 11.2 mp -74.85 138.9 42.82 Favored 'General case' 0 C--O 1.256 1.422 0 CA-C-O 117.574 -1.203 . . . . 58.509999999999998 109.815 176.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 72.0 mt -131.38 146.48 52.29 Favored 'General case' 0 N--CA 1.48 1.058 0 O-C-N 126.027 2.079 . . . . 51.119999999999997 110.581 -176.363 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 88.3 m-20 54.04 -124.24 2.2 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 126.063 2.102 . . . . 41.840000000000003 107.054 158.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -70.54 -11.41 68.46 Favored Glycine 0 N--CA 1.483 1.775 0 CA-C-O 118.512 -1.16 . . . . 46.549999999999997 112.562 -166.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 95.0 m-20 -82.38 -6.53 59.33 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 124.927 1.291 . . . . 53.890000000000001 110.825 -179.682 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 82.6 mt -97.99 105.47 17.29 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.431 0 N-CA-C 106.685 -1.598 . . . . 37.880000000000003 106.685 -177.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 23.4 m120 -123.88 98.89 6.0 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 106.597 -1.631 . . . . 44.219999999999999 106.597 -173.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -142.57 144.76 33.03 Favored 'General case' 0 N--CA 1.479 1.022 0 N-CA-C 107.521 -1.289 . . . . 40.460000000000001 107.521 173.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LYS . . . . . . . . . . . . . 52.2 mttt -64.61 -32.17 73.71 Favored 'General case' 0 N--CA 1.484 1.262 0 O-C-N 124.142 0.901 . . . . 76.980000000000004 110.021 175.709 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 69.4 mt-10 -139.41 134.54 32.54 Favored 'General case' 0 N--CA 1.469 0.497 0 CA-C-O 115.831 -2.033 . . . . 63.289999999999999 107.888 -177.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 33.5 m -136.18 150.25 27.85 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 O-C-N 127.579 3.049 . . . . 32.689999999999998 107.855 167.774 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ARG . . . . . . . . . . . . . 53.3 ttm-85 -88.8 113.84 24.78 Favored 'General case' 0 C--O 1.254 1.334 0 N-CA-C 105.36 -2.089 . . . . 39.359999999999999 105.36 169.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 47.4 t -105.59 121.67 44.45 Favored 'General case' 0 C--O 1.267 1.985 0 O-C-N 124.476 1.11 . . . . 39.700000000000003 109.494 -171.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 62.0 t -127.03 151.09 33.49 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 N-CA-C 107.257 -1.386 . . . . 46.5 107.257 -176.461 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' GLY . . . . . . . . . . . . . . . -96.44 -177.12 35.78 Favored Glycine 0 C--N 1.304 -1.247 0 N-CA-C 108.607 -1.797 . . . . 39.770000000000003 108.607 179.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ASP . . . . . . . . . . . . . 32.9 t0 -84.08 -7.93 59.25 Favored 'General case' 0 C--O 1.276 2.496 0 CA-C-O 118.234 -0.889 . . . . 59.469999999999999 111.316 -172.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -128.53 42.25 3.35 Favored 'General case' 0 N--CA 1.493 1.724 0 CA-C-O 116.79 -1.576 . . . . 74.579999999999998 110.032 177.57 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 83.68 7.82 85.47 Favored Glycine 0 N--CA 1.476 1.304 0 O-C-N 125.231 1.582 . . . . 52.810000000000002 112.739 176.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 29.7 mp0 -66.22 132.13 47.71 Favored 'General case' 0 N--CA 1.498 1.956 0 CA-C-N 120.205 2.002 . . . . 51.909999999999997 109.233 -179.537 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' VAL . . . . . . . . . . . . . 24.1 t -96.44 119.88 45.07 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.643 0 CA-C-O 116.991 -1.481 . . . . 51.100000000000001 107.009 177.1 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' TYR . . . . . . . . . . . . . 95.0 m-85 -99.97 -16.07 18.07 Favored 'General case' 0 C--O 1.21 -0.992 0 CA-C-N 119.716 1.144 . . . . 41.509999999999998 111.299 169.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 91.96 -160.02 25.94 Favored Glycine 0 N--CA 1.477 1.428 0 C-N-CA 126.846 2.165 . . . . 34.439999999999998 110.251 179.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ILE . . . . . . . . . . . . . 94.2 mt -97.82 119.16 45.48 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.361 0 N-CA-C 105.919 -1.882 . . . . 39.530000000000001 105.919 177.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 28.5 pt -141.17 171.05 12.9 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.309 0 N-CA-C 105.764 -1.939 . . . . 33.18 105.764 -176.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 51.7 p -68.14 157.67 34.83 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-N 118.384 0.538 . . . . 40.149999999999999 109.711 173.632 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 39.4 p -62.84 -33.81 76.02 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-O 117.938 -1.029 . . . . 38.420000000000002 108.429 174.451 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LYS . . . . . . . . . . . . . 24.9 mttt -61.9 -45.87 91.86 Favored 'General case' 0 C--O 1.258 1.507 0 CA-C-N 118.553 0.615 . . . . 83.269999999999996 109.471 178.299 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 20.0 tp10 -66.17 -41.75 89.89 Favored 'General case' 0 C--N 1.314 -0.941 0 N-CA-C 108.118 -1.068 . . . . 50.829999999999998 108.118 179.299 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -63.75 -41.1 98.07 Favored 'General case' 0 C--O 1.254 1.292 0 CA-C-N 119.547 1.067 . . . . 33.630000000000003 108.846 -177.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 65.3 tp -64.64 -44.32 90.84 Favored 'General case' 0 N--CA 1.489 1.503 0 CA-C-O 118.194 -0.908 . . . . 42.479999999999997 109.341 178.223 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 33.8 ttpt -57.5 -42.69 83.23 Favored 'General case' 0 C--O 1.243 0.727 0 CA-C-N 119.935 1.243 . . . . 54.060000000000002 108.711 176.297 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 83.1 mt -66.24 -47.67 83.67 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.422 0 N-CA-C 107.697 -1.223 . . . . 36.710000000000001 107.697 -179.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -58.46 -46.34 86.8 Favored 'General case' 0 N--CA 1.482 1.162 0 CA-C-N 119.296 0.953 . . . . 37.329999999999998 109.333 -177.117 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -62.95 -43.35 99.04 Favored 'General case' 0 N--CA 1.492 1.646 0 N-CA-C 109.593 -0.521 . . . . 56.509999999999998 109.593 -176.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 36.2 m-80 -70.78 -22.54 62.36 Favored 'General case' 0 N--CA 1.483 1.225 0 CA-C-O 118.584 -0.722 . . . . 44.789999999999999 109.611 -177.219 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 5.3 mp -93.84 2.43 56.19 Favored 'General case' 0 N--CA 1.486 1.368 0 CA-C-O 118.065 -0.969 . . . . 52.079999999999998 111.473 177.08 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 73.07 23.58 77.47 Favored Glycine 0 N--CA 1.476 1.35 0 CA-C-N 120.185 1.357 . . . . 47.789999999999999 110.311 178.342 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 54.2 mt -120.84 175.44 6.04 Favored 'General case' 0 C--O 1.284 2.907 0 CA-C-N 118.814 1.307 . . . . 49.689999999999998 111.09 -174.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 44.6 m-20 -93.2 158.27 15.84 Favored 'General case' 0 C--O 1.265 1.892 0 CA-C-N 114.086 -1.415 . . . . 47.950000000000003 109.522 172.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 28.8 tp -103.39 121.52 42.95 Favored 'General case' 0 N--CA 1.47 0.562 0 O-C-N 125.498 1.749 . . . . 36.329999999999998 106.601 163.378 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 29.4 t -118.82 122.72 70.09 Favored 'Isoleucine or valine' 0 C--O 1.268 2.049 0 C-N-CA 124.672 1.189 . . . . 37.259999999999998 110.113 -174.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LEU . . . . . . . . . . . . . 64.5 tp -76.53 110.88 11.45 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 124.796 1.31 . . . . 40.229999999999997 108.448 177.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 28.9 mm -85.59 -45.23 17.19 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.711 0 N-CA-C 108.382 -0.97 . . . . 37.840000000000003 108.382 179.389 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 44.3 t -146.89 119.85 8.75 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.121 0.568 . . . . 38.57 112.277 -178.105 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ALA . . . . . 0.515 ' O ' ' NZ ' ' A' ' 54' ' ' LYS . . . -87.23 -22.01 25.48 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-O 117.298 -1.334 . . . . 43.509999999999998 109.283 169.928 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 63.3 m -69.19 -36.46 77.35 Favored 'General case' 0 N--CA 1.487 1.377 0 CA-C-N 119.413 1.006 . . . . 51.689999999999998 110.083 179.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -58.83 150.98 22.48 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 124.403 1.065 . . . . 36.420000000000002 108.471 177.537 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.515 ' NZ ' ' O ' ' A' ' 51' ' ' ALA . 29.3 mmtm -130.52 112.9 16.64 Favored Pre-proline 0 N--CA 1.477 0.894 0 N-CA-C 106.519 -1.66 . . . . 68.709999999999994 106.519 179.148 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -75.13 164.98 87.1 Favored 'Cis proline' 0 C--O 1.248 1.012 0 C-N-CA 122.778 -1.759 . . . . 41.960000000000001 111.765 -3.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -58.61 144.81 97.13 Favored 'Trans proline' 0 C--O 1.205 -1.16 0 C-N-CA 121.989 1.792 . . . . 35.859999999999999 112.697 -179.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 81.3 t -96.32 124.7 49.17 Favored 'Isoleucine or valine' 0 C--O 1.246 0.886 0 CA-C-O 117.049 -1.453 . . . . 32.549999999999997 108.509 -176.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' CYS . . . . . . . . . . . . . 91.5 m -123.51 149.27 45.4 Favored 'General case' 0 C--O 1.277 2.51 0 O-C-N 125.504 1.753 . . . . 40.950000000000003 109.091 174.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 23.6 mtpt -118.57 143.74 46.56 Favored 'General case' 0 C--O 1.248 1.012 0 N-CA-C 107.554 -1.276 . . . . 44.32 107.554 175.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' VAL . . . . . . . . . . . . . 84.7 t -96.03 107.55 19.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.638 0 N-CA-C 104.583 -2.377 . . . . 39.899999999999999 104.583 171.664 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' MSE . . . . . . . . . . . . . 22.5 ptm -162.49 171.5 16.97 Favored 'General case' 0 C--N 1.323 -0.575 0 N-CA-C 108.575 -0.898 . . . . 48.109999999999999 108.575 -174.451 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 35.1 t0 -77.55 115.04 16.99 Favored 'General case' 0 C--O 1.259 1.59 0 N-CA-C 106.457 -1.683 . . . . 73.459999999999994 106.457 174.036 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' TYR . . . . . . . . . . . . . 47.1 t80 -58.55 -35.46 72.38 Favored 'General case' 0 C--O 1.255 1.387 0 O-C-N 124.725 1.266 . . . . 80.379999999999995 110.467 -178.696 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 84.8 m-20 -58.38 -35.7 72.4 Favored 'General case' 0 N--CA 1.489 1.478 0 CA-C-O 118.413 -0.803 . . . . 85.969999999999999 109.458 177.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -71.13 -39.78 71.8 Favored 'General case' 0 N--CA 1.487 1.416 0 CA-C-O 118.358 -0.829 . . . . 76.599999999999994 109.736 178.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' PHE . . . . . 0.488 ' HE2' HG21 ' A' ' 6' ' ' VAL . 85.9 t80 -58.46 -51.86 68.06 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.495 -0.928 . . . . 63.740000000000002 108.495 177.631 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 2.9 ttt85 -56.86 -42.11 79.18 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 126.534 1.933 . . . . 120.09999999999999 108.015 -174.257 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' TYR . . . . . . . . . . . . . 17.1 m-85 -76.15 -38.4 56.75 Favored 'General case' 0 N--CA 1.489 1.477 0 CA-C-O 116.935 -1.507 . . . . 103.14 110.578 -177.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' GLN . . . . . . . . . . . . . 52.9 mt-30 -54.92 -47.95 73.73 Favored 'General case' 0 N--CA 1.495 1.818 0 CA-C-N 120.216 1.371 . . . . 91.950000000000003 108.813 172.179 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ASN . . . . . 0.442 ' ND2' ' O ' ' A' ' 66' ' ' PHE . 36.3 m-80 . . . . . 0 N--CA 1.489 1.486 0 C-N-CA 125.021 1.329 . . . . 98.609999999999999 108.89 177.81 . . . . . . . . 1 1 . 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 0 . 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 0 . 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 stop_ save_