data_3bn0_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 3bn0 _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 ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.129 0 N-CA-C 108.746 -0.835 . . . . 30.390000000000001 108.746 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 92.8 t -74.39 123.06 29.03 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.368 0 N-CA-C 108.695 -0.854 . . . . 29.280000000000001 108.695 168.754 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ARG . . . . . 0.401 ' NE ' ' OE2' ' A' ' 64' ' ' GLU . 64.0 mtt180 -136.69 158.55 44.18 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 113.399 0.889 . . . . 40.109999999999999 113.399 179.217 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 67.3 mt -95.28 121.52 45.92 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 N-CA-C 106.884 -1.524 . . . . 25.710000000000001 106.884 174.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 -149.28 -178.85 6.63 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 112.326 0.491 . . . . 46.740000000000002 112.326 -178.008 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 15.4 mt -99.55 142.61 30.81 Favored 'General case' 0 CA--C 1.504 -0.8 0 CA-C-N 116.249 -0.432 . . . . 28.539999999999999 109.951 -177.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -127.93 137.77 52.4 Favored 'General case' 0 N--CA 1.438 -1.052 0 CA-C-N 116.12 -0.491 . . . . 32.659999999999997 109.967 174.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.97 146.29 53.71 Favored 'General case' 0 CA--C 1.509 -0.626 0 C-N-CA 123.263 0.625 . . . . 48.409999999999997 112.161 -176.811 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -163.22 150.06 12.53 Favored 'General case' 0 CA--C 1.562 1.409 0 N-CA-C 104.001 -2.592 . . . . 46.880000000000003 104.001 -170.332 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . 84.73 -149.65 24.64 Favored Glycine 0 N--CA 1.487 2.062 0 N-CA-C 118.465 2.146 . . . . 46.609999999999999 118.465 -177.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 8.8 mtm180 -139.32 158.88 43.38 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 116.498 2.036 . . . . 52.219999999999999 116.498 -162.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 76.9 tttt -45.96 132.73 9.15 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 115.635 -0.711 . . . . 55.189999999999998 111.555 167.592 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 11.6 m-70 73.55 -14.01 0.68 Allowed 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 124.061 0.945 . . . . 53.969999999999999 113.241 -178.267 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 77.2 m-70 -138.41 71.39 45.64 Favored Pre-proline 0 CA--C 1.555 1.171 0 CA-C-O 121.377 0.608 . . . . 47.759999999999998 110.539 169.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -71.19 147.31 53.51 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 117.785 -1.01 . . . . 37.579999999999998 110.279 178.514 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 32.4 mm -132.02 139.09 51.11 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.472 0 N-CA-C 107.7 -1.222 . . . . 30.940000000000001 107.7 174.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 58.3 m-85 -120.42 120.38 35.78 Favored 'General case' 0 N--CA 1.482 1.144 0 O-C-N 124.217 0.948 . . . . 32.369999999999997 112.759 -179.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 54.4 mtm180 -78.6 133.3 37.3 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 119.532 -0.867 . . . . 35.759999999999998 109.305 168.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 60.4 mt -85.28 116.94 29.49 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 N-CA-C 105.612 -1.996 . . . . 32.020000000000003 105.612 169.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 34.6 m -122.33 160.26 24.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 C-N-CA 120.41 -0.516 . . . . 30.170000000000002 111.336 -171.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 47.9 t -104.36 122.88 57.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 N-CA-C 106.162 -1.792 . . . . 33.170000000000002 106.162 164.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 23.0 ptm -146.19 158.86 43.9 Favored 'General case' 0 C--O 1.222 -0.388 0 N-CA-C 111.793 0.294 . . . . 40.829999999999998 111.793 -176.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -107.15 128.41 54.38 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 109.163 -0.68 . . . . 45.509999999999998 109.163 172.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.46 0 N-CA-C 118.239 2.681 . . . . 48.909999999999997 118.239 -165.591 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 20.7 tttm . . . . . 0 C--O 1.244 0.784 0 N-CA-C 112.189 0.44 . . . . 52.270000000000003 112.189 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 34.6 m-85 -144.85 155.18 43.34 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 125.861 1.664 . . . . 48.439999999999998 108.117 -167.453 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 82.4 mt -71.33 -37.69 66.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 122.334 0.254 . . . . 44.060000000000002 111.146 177.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -162.11 155.51 20.78 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 122.727 0.411 . . . . 45.729999999999997 110.394 -177.594 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ILE . . . . . . . . . . . . . 48.1 mt -113.67 129.26 69.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 N-CA-C 105.726 -1.953 . . . . 36.530000000000001 105.726 173.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 19.4 mt -98.85 -11.41 21.78 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 120.702 -0.399 . . . . 30.219999999999999 111.173 -177.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 153.51 -178.58 30.43 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 115.119 0.808 . . . . 30.670000000000002 115.119 -178.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 62.8 m -134.8 131.84 37.97 Favored 'General case' 0 C--O 1.252 1.226 0 CA-C-O 121.866 0.841 . . . . 33.740000000000002 109.659 -173.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -129.93 138.76 51.07 Favored 'General case' 0 N--CA 1.437 -1.082 0 CA-C-N 114.748 -1.114 . . . . 30.699999999999999 111.375 -167.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -114.5 110.89 46.91 Favored Pre-proline 0 C--O 1.205 -1.249 0 N-CA-C 105.715 -1.957 . . . . 31.23 105.715 -177.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -75.56 -24.8 11.63 Favored 'Trans proline' 0 C--O 1.249 1.047 0 C-N-CA 122.55 2.167 . . . . 35.770000000000003 115.1 -172.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 38.9 mmtt -74.91 -52.98 9.85 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 123.303 0.377 . . . . 48.200000000000003 110.582 178.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 9.3 mmt85 -83.78 -12.42 55.71 Favored 'General case' 0 CA--C 1.511 -0.557 0 C-N-CA 120.055 -0.658 . . . . 43.119999999999997 111.459 -179.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 62.2 mttt 59.93 47.16 10.25 Favored 'General case' 0 N--CA 1.445 -0.72 0 O-C-N 123.914 0.759 . . . . 46.770000000000003 113.02 -179.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 27.7 m -127.31 151.91 34.72 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.751 0 C-N-CA 119.368 -0.933 . . . . 33.039999999999999 110.372 178.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 15.4 mt -92.0 112.15 23.97 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 108.203 -1.036 . . . . 33.960000000000001 108.203 169.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 35.9 mt -62.35 -55.88 21.16 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.008 0 O-C-N 124.737 1.273 . . . . 35.079999999999998 109.507 174.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 30.2 m120 -127.36 146.11 50.57 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 108.514 -0.921 . . . . 43.909999999999997 108.514 173.36 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.9 p -142.43 143.33 26.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 N-CA-C 109.831 -0.433 . . . . 36.939999999999998 109.831 165.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 47.3 m-85 -122.36 86.42 48.07 Favored Pre-proline 0 N--CA 1.449 -0.483 0 N-CA-C 108.574 -0.898 . . . . 42.100000000000001 108.574 -179.56 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_exo -62.59 -26.24 75.78 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 122.464 2.109 . . . . 37.119999999999997 115.092 -169.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 21.5 pm0 -68.46 -37.8 80.52 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 110.102 -0.332 . . . . 36.740000000000002 110.102 177.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 65.5 mttm -66.39 -38.65 87.99 Favored 'General case' 0 CA--C 1.548 0.869 0 CA-C-N 115.187 -0.915 . . . . 42.68 113.358 173.674 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . 0.367 1.5 m -74.34 -31.27 28.11 Favored 'Isoleucine or valine' 0 C--O 1.242 0.661 0 N-CA-C 113.498 0.925 . . . . 33.850000000000001 113.498 179.366 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 70.9 tttt -63.36 -50.27 70.6 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 108.575 -0.898 . . . . 35.369999999999997 108.575 174.25 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 62.8 tt0 -51.94 -59.3 4.5 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.725 -0.671 . . . . 36.68 110.114 -177.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -70.8 -43.55 68.44 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 115.344 1.609 . . . . 34.740000000000002 115.344 -170.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 37.4 t -61.06 -40.18 84.8 Favored 'Isoleucine or valine' 0 C--O 1.245 0.866 0 N-CA-C 112.243 0.46 . . . . 30.440000000000001 112.243 177.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 42.1 mt -76.31 -17.48 59.42 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 120.395 -0.522 . . . . 33.32 111.512 -179.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 81.1 mttt -69.71 -4.73 20.96 Favored 'General case' 0 C--O 1.218 -0.6 0 N-CA-C 115.278 1.584 . . . . 35.130000000000003 115.278 167.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 82.42 10.45 83.5 Favored Glycine 0 C--O 1.222 -0.603 0 C-N-CA 120.772 -0.728 . . . . 31.129999999999999 113.67 178.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.3 t -66.45 143.89 15.19 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 N-CA-C 108.879 -0.786 . . . . 26.600000000000001 108.879 -179.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' GLU . . . . . 0.401 ' OE2' ' NE ' ' A' ' 4' ' ' ARG . 46.7 mt-10 -78.59 135.67 37.33 Favored 'General case' 0 C--O 1.204 -1.291 0 N-CA-C 110.215 -0.291 . . . . 35.539999999999999 110.215 -176.56 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 6.9 mp -103.37 135.4 45.06 Favored 'General case' 0 C--O 1.25 1.087 0 C-N-CA 124.032 0.933 . . . . 23.25 111.182 174.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 86.3 p -62.74 160.57 14.05 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 108.945 -0.761 . . . . 22.899999999999999 108.945 170.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 58.2 t60 -56.37 -46.8 79.9 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 120.471 -0.492 . . . . 34.560000000000002 112.233 -179.209 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 51.9 ttt180 -76.16 -33.92 59.36 Favored 'General case' 0 C--O 1.207 -1.132 0 C-N-CA 119.036 -1.066 . . . . 29.030000000000001 112.025 -173.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -61.33 -43.21 99.25 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 118.601 0.637 . . . . 24.5 110.096 173.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.12 -49.57 76.52 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 119.146 -0.455 . . . . 33.100000000000001 110.194 174.113 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -57.13 -47.86 80.08 Favored 'General case' 0 N--CA 1.497 1.921 0 N-CA-C 113.211 0.819 . . . . 29.02 113.211 -177.025 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 63.7 mt -57.74 -51.05 75.09 Favored 'Isoleucine or valine' 0 C--O 1.254 1.34 0 C-N-CA 123.505 0.722 . . . . 30.07 111.405 176.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 55.5 mt -72.76 -31.41 64.89 Favored 'General case' 0 C--O 1.219 -0.525 0 C-N-CA 120.433 -0.507 . . . . 32.210000000000001 111.522 -173.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 22.0 t-105 -72.92 -54.52 8.48 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 122.353 0.261 . . . . 41.109999999999999 111.057 177.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -62.23 -33.12 73.98 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 115.048 1.499 . . . . 38.759999999999998 115.048 -178.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 45.7 m-70 -85.78 13.23 7.55 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 112.168 0.433 . . . . 38.710000000000001 112.168 177.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 62.3 15.47 51.64 Favored Glycine 0 N--CA 1.464 0.531 0 N-CA-C 117.555 1.782 . . . . 40.219999999999999 117.555 178.775 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 19.4 mm -70.4 -39.63 76.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 CA-C-N 117.509 0.655 . . . . 40.149999999999999 110.854 179.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.9 mt -66.37 -42.8 87.48 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.697 0.284 . . . . 42.859999999999999 110.729 179.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 6.2 ttmt -57.15 -40.21 76.75 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.636 -0.711 . . . . 50.280000000000001 111.573 179.5 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -73.93 -24.88 59.73 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 114.194 1.183 . . . . 51.359999999999999 114.194 179.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 28.1 m -111.71 -26.54 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 N-CA-C 117.435 2.383 . . . . 46.079999999999998 117.435 -171.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 96.5 t -88.77 112.61 51.63 Favored Pre-proline 0 C--O 1.246 0.919 0 CA-C-N 118.315 0.507 . . . . 47.939999999999998 111.367 -178.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_exo -63.53 152.37 80.54 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 123.655 2.903 . . . . 50.899999999999999 113.677 175.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . . . -62.8 145.3 55.25 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 108.074 -1.084 . . . . 52.210000000000001 108.074 166.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 102.09 -13.02 57.45 Favored Glycine 0 N--CA 1.464 0.54 0 N-CA-C 110.829 -0.908 . . . . 51.469999999999999 110.829 -171.273 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 30.0 m-85 -108.09 132.37 53.65 Favored 'General case' 0 CA--C 1.511 -0.557 0 N-CA-C 107.492 -1.299 . . . . 49.530000000000001 107.492 169.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -118.13 146.34 44.23 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 108.872 -0.788 . . . . 52.960000000000001 108.872 -178.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 47.0 ttp -87.84 128.88 35.34 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 109.135 -0.691 . . . . 44.159999999999997 109.135 173.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 66.0 mttt -115.93 142.46 46.75 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 121.362 0.601 . . . . 45.299999999999997 112.109 173.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 56.4 ttt180 -91.61 119.52 31.58 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.761 -0.654 . . . . 37.630000000000003 109.28 174.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 67.7 t -129.07 98.94 4.41 Favored 'Isoleucine or valine' 0 C--O 1.249 1.058 0 CA-C-O 121.763 0.792 . . . . 33.939999999999998 111.319 -176.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 57.05 -119.54 16.28 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-N 115.419 -0.81 . . . . 29.870000000000001 113.626 -173.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -81.74 -7.19 59.57 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.428 0.691 . . . . 25.059999999999999 112.208 178.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 75.0 m-85 -119.34 174.43 6.37 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 115.737 1.755 . . . . 33.670000000000002 115.737 -172.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 -128.71 144.91 51.27 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 107.727 -1.212 . . . . 35.409999999999997 107.727 173.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 6.1 t -136.93 144.87 31.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 123.783 0.833 . . . . 32.350000000000001 110.144 179.325 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -106.13 132.16 52.54 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 107.198 -1.408 . . . . 40.280000000000001 107.198 171.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 21.8 pt-20 -147.36 159.26 43.89 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.098 0.407 . . . . 49.630000000000003 112.098 177.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.66 134.13 56.78 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 113.89 1.071 . . . . 56.07 113.89 -178.829 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 28.3 mmt180 -51.01 -67.88 0.21 Allowed 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 109.416 -0.587 . . . . 65.579999999999998 109.416 176.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.494 0 C-N-CA 124.049 0.939 . . . . 59.210000000000001 108.813 168.943 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 200' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 256' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 257' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 258' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 259' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 260' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 261' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 262' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 264' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 265' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 266' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 267' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 268' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 269' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 270' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 271' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.129 0 N-CA-C 108.746 -0.835 . . . . 30.39 108.746 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 92.8 t -74.39 123.06 29.03 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.368 0 N-CA-C 108.695 -0.854 . . . . 29.28 108.695 168.754 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 64.0 mtt180 -136.69 158.55 44.18 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 113.399 0.889 . . . . 40.11 113.399 179.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 67.3 mt -95.28 121.52 45.92 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 N-CA-C 106.884 -1.524 . . . . 25.71 106.884 174.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ARG . . . . . 0.469 ' HD3' ' SD ' ' A' ' 23' ' ' MET . 9.1 ptm180 -149.28 -178.85 6.63 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 112.326 0.491 . . . . 46.74 112.326 -178.008 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 15.4 mt -99.55 142.61 30.81 Favored 'General case' 0 CA--C 1.504 -0.8 0 CA-C-N 116.249 -0.432 . . . . 28.54 109.951 -177.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -127.93 137.77 52.4 Favored 'General case' 0 N--CA 1.438 -1.052 0 CA-C-N 116.12 -0.491 . . . . 32.66 109.967 174.973 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LYS . . . . . 0.543 ' HE3' ' HE2' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -67.97 146.29 53.71 Favored 'General case' 0 CA--C 1.509 -0.626 0 C-N-CA 123.263 0.625 . . . . 48.41 112.161 -176.811 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -163.22 150.06 12.53 Favored 'General case' 0 CA--C 1.562 1.409 0 N-CA-C 104.001 -2.592 . . . . 46.88 104.001 -170.332 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLY . . . . . 0.567 ' HA2' ' O ' ' A' ' 219' ' ' HOH . . . 84.73 -149.65 24.64 Favored Glycine 0 N--CA 1.487 2.062 0 N-CA-C 118.465 2.146 . . . . 46.61 118.465 -177.63 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 8.8 mtm180 -139.32 158.88 43.38 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 116.498 2.036 . . . . 52.22 116.498 -162.588 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 76.9 tttt -45.96 132.73 9.15 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 115.635 -0.711 . . . . 55.19 111.555 167.592 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 11.6 m-70 73.55 -14.01 0.68 Allowed 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 124.061 0.945 . . . . 53.97 113.241 -178.267 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 77.2 m-70 -138.41 71.39 45.64 Favored Pre-proline 0 CA--C 1.555 1.171 0 CA-C-O 121.377 0.608 . . . . 47.76 110.539 169.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -71.19 147.31 53.51 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 117.785 -1.01 . . . . 37.58 110.279 178.514 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 32.4 mm -132.02 139.09 51.11 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.472 0 N-CA-C 107.7 -1.222 . . . . 30.94 107.7 174.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' TYR . . . . . 0.543 ' HE2' ' HE3' ' A' ' 9' ' ' LYS . 58.3 m-85 -120.42 120.38 35.78 Favored 'General case' 0 N--CA 1.482 1.144 0 O-C-N 124.217 0.948 . . . . 32.37 112.759 -179.351 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ARG . . . . . 0.54 HH11 HG21 ' A' ' 36' ' ' ILE . 54.4 mtm180 -78.6 133.3 37.3 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 119.532 -0.867 . . . . 35.9 109.305 168.894 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 60.4 mt -85.28 116.94 29.49 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 N-CA-C 105.612 -1.996 . . . . 32.02 105.612 169.516 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 34.6 m -122.33 160.26 24.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 C-N-CA 120.41 -0.516 . . . . 30.17 111.336 -171.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 47.9 t -104.36 122.88 57.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 N-CA-C 106.162 -1.792 . . . . 33.17 106.162 164.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' MET . . . . . 0.469 ' SD ' ' HD3' ' A' ' 6' ' ' ARG . 23.0 ptm -146.19 158.86 43.9 Favored 'General case' 0 C--O 1.222 -0.388 0 N-CA-C 111.793 0.294 . . . . 41.92 111.793 -176.025 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -107.15 128.41 54.38 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 109.163 -0.68 . . . . 45.51 109.163 172.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.46 0 N-CA-C 118.239 2.681 . . . . 48.91 118.239 -165.591 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LYS . . . . . 0.507 ' HG2' ' N ' ' A' ' 33' ' ' TYR . 20.7 tttm . . . . . 0 C--O 1.244 0.784 0 N-CA-C 112.189 0.44 . . . . 52.27 112.189 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' TYR . . . . . 0.507 ' N ' ' HG2' ' A' ' 32' ' ' LYS . 34.6 m-85 -144.85 155.18 43.34 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 125.861 1.664 . . . . 48.44 108.117 -167.453 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 82.4 mt -71.33 -37.69 66.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 122.334 0.254 . . . . 44.06 111.146 177.359 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -162.11 155.51 20.78 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 122.727 0.411 . . . . 45.73 110.394 -177.594 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ILE . . . . . 0.54 HG21 HH11 ' A' ' 19' ' ' ARG . 48.1 mt -113.67 129.26 69.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 N-CA-C 105.726 -1.953 . . . . 36.53 105.726 173.618 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 19.4 mt -98.85 -11.41 21.78 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 120.702 -0.399 . . . . 30.22 111.173 -177.593 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 153.51 -178.58 30.43 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 115.119 0.808 . . . . 30.67 115.119 -178.379 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 62.8 m -134.8 131.84 37.97 Favored 'General case' 0 C--O 1.252 1.226 0 CA-C-O 121.866 0.841 . . . . 33.74 109.659 -173.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -129.93 138.76 51.07 Favored 'General case' 0 N--CA 1.437 -1.082 0 CA-C-N 114.748 -1.114 . . . . 30.7 111.375 -167.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -114.5 110.89 46.91 Favored Pre-proline 0 C--O 1.205 -1.249 0 N-CA-C 105.715 -1.957 . . . . 31.23 105.715 -177.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -75.56 -24.8 11.63 Favored 'Trans proline' 0 C--O 1.249 1.047 0 C-N-CA 122.55 2.167 . . . . 35.77 115.1 -172.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 38.9 mmtt -74.91 -52.98 9.85 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 123.303 0.377 . . . . 48.2 110.582 178.145 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 9.3 mmt85 -83.78 -12.42 55.71 Favored 'General case' 0 CA--C 1.511 -0.557 0 C-N-CA 120.055 -0.658 . . . . 43.12 111.459 -179.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 62.2 mttt 59.93 47.16 10.25 Favored 'General case' 0 N--CA 1.445 -0.72 0 O-C-N 123.914 0.759 . . . . 46.77 113.02 -179.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 27.7 m -127.31 151.91 34.72 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.751 0 C-N-CA 119.368 -0.933 . . . . 33.04 110.372 178.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 15.4 mt -92.0 112.15 23.97 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 108.203 -1.036 . . . . 33.96 108.203 169.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 35.9 mt -62.35 -55.88 21.16 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.008 0 O-C-N 124.737 1.273 . . . . 35.08 109.507 174.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 30.2 m120 -127.36 146.11 50.57 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 108.514 -0.921 . . . . 43.91 108.514 173.36 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.9 p -142.43 143.33 26.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 N-CA-C 109.831 -0.433 . . . . 36.94 109.831 165.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 47.3 m-85 -122.36 86.42 48.07 Favored Pre-proline 0 N--CA 1.449 -0.483 0 N-CA-C 108.574 -0.898 . . . . 42.1 108.574 -179.56 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_exo -62.59 -26.24 75.78 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 122.464 2.109 . . . . 37.12 115.092 -169.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 21.5 pm0 -68.46 -37.8 80.52 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 110.102 -0.332 . . . . 38.02 110.102 177.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 65.5 mttm -66.39 -38.65 87.99 Favored 'General case' 0 CA--C 1.548 0.869 0 CA-C-N 115.187 -0.915 . . . . 42.68 113.358 173.674 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . 0.367 1.5 m -74.34 -31.27 28.11 Favored 'Isoleucine or valine' 0 C--O 1.242 0.661 0 N-CA-C 113.498 0.925 . . . . 33.85 113.498 179.366 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 70.9 tttt -63.36 -50.27 70.6 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 108.575 -0.898 . . . . 35.37 108.575 174.25 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 62.8 tt0 -51.94 -59.3 4.5 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.725 -0.671 . . . . 36.68 110.114 -177.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -70.8 -43.55 68.44 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 115.344 1.609 . . . . 34.74 115.344 -170.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 37.4 t -61.06 -40.18 84.8 Favored 'Isoleucine or valine' 0 C--O 1.245 0.866 0 N-CA-C 112.243 0.46 . . . . 30.44 112.243 177.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 42.1 mt -76.31 -17.48 59.42 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 120.395 -0.522 . . . . 33.32 111.512 -179.179 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 81.1 mttt -69.71 -4.73 20.96 Favored 'General case' 0 C--O 1.218 -0.6 0 N-CA-C 115.278 1.584 . . . . 35.13 115.278 167.582 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 82.42 10.45 83.5 Favored Glycine 0 C--O 1.222 -0.603 0 C-N-CA 120.772 -0.728 . . . . 31.13 113.67 178.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.3 t -66.45 143.89 15.19 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 N-CA-C 108.879 -0.786 . . . . 26.6 108.879 -179.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -78.59 135.67 37.33 Favored 'General case' 0 C--O 1.204 -1.291 0 N-CA-C 110.215 -0.291 . . . . 35.54 110.215 -176.56 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 6.9 mp -103.37 135.4 45.06 Favored 'General case' 0 C--O 1.25 1.087 0 C-N-CA 124.032 0.933 . . . . 23.25 111.182 174.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 86.3 p -62.74 160.57 14.05 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 108.945 -0.761 . . . . 22.9 108.945 170.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 58.2 t60 -56.37 -46.8 79.9 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 120.471 -0.492 . . . . 34.56 112.233 -179.209 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 51.9 ttt180 -76.16 -33.92 59.36 Favored 'General case' 0 C--O 1.207 -1.132 0 C-N-CA 119.036 -1.066 . . . . 29.03 112.025 -173.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -61.33 -43.21 99.25 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 118.601 0.637 . . . . 24.5 110.096 173.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.12 -49.57 76.52 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 119.146 -0.455 . . . . 33.1 110.194 174.113 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -57.13 -47.86 80.08 Favored 'General case' 0 N--CA 1.497 1.921 0 N-CA-C 113.211 0.819 . . . . 29.02 113.211 -177.025 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 63.7 mt -57.74 -51.05 75.09 Favored 'Isoleucine or valine' 0 C--O 1.254 1.34 0 C-N-CA 123.505 0.722 . . . . 30.07 111.405 176.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 55.5 mt -72.76 -31.41 64.89 Favored 'General case' 0 C--O 1.219 -0.525 0 C-N-CA 120.433 -0.507 . . . . 32.21 111.522 -173.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 22.0 t-105 -72.92 -54.52 8.48 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 122.353 0.261 . . . . 41.11 111.057 177.312 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -62.23 -33.12 73.98 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 115.048 1.499 . . . . 38.76 115.048 -178.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 45.7 m-70 -85.78 13.23 7.55 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 112.168 0.433 . . . . 38.71 112.168 177.51 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 62.3 15.47 51.64 Favored Glycine 0 N--CA 1.464 0.531 0 N-CA-C 117.555 1.782 . . . . 40.22 117.555 178.775 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 19.4 mm -70.4 -39.63 76.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 CA-C-N 117.509 0.655 . . . . 40.15 110.854 179.15 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.9 mt -66.37 -42.8 87.48 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.697 0.284 . . . . 42.86 110.729 179.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 6.2 ttmt -57.15 -40.21 76.75 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.636 -0.711 . . . . 50.28 111.573 179.5 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' GLU . . . . . 0.577 ' HG3' HG13 ' A' ' 82' ' ' VAL . 8.4 pt-20 -73.93 -24.88 59.73 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 114.194 1.183 . . . . 51.36 114.194 179.732 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' VAL . . . . . 0.577 HG13 ' HG3' ' A' ' 81' ' ' GLU . 28.1 m -111.71 -26.54 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 N-CA-C 117.435 2.383 . . . . 46.08 117.435 -171.743 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 96.5 t -88.77 112.61 51.63 Favored Pre-proline 0 C--O 1.246 0.919 0 CA-C-N 118.315 0.507 . . . . 47.94 111.367 -178.31 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' PRO . . . . . 0.419 ' HD3' ' O ' ' A' ' 82' ' ' VAL . 52.2 Cg_exo -63.53 152.37 80.54 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 123.655 2.903 . . . . 50.9 113.677 175.58 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . . . -62.8 145.3 55.25 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 108.074 -1.084 . . . . 52.21 108.074 166.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 102.09 -13.02 57.45 Favored Glycine 0 N--CA 1.464 0.54 0 N-CA-C 110.829 -0.908 . . . . 51.47 110.829 -171.273 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 30.0 m-85 -108.09 132.37 53.65 Favored 'General case' 0 CA--C 1.511 -0.557 0 N-CA-C 107.492 -1.299 . . . . 49.53 107.492 169.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -118.13 146.34 44.23 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 108.872 -0.788 . . . . 52.96 108.872 -178.791 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 47.0 ttp -87.84 128.88 35.34 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 109.135 -0.691 . . . . 44.16 109.135 173.367 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 66.0 mttt -115.93 142.46 46.75 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 121.362 0.601 . . . . 45.3 112.109 173.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 56.4 ttt180 -91.61 119.52 31.58 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.761 -0.654 . . . . 37.63 109.28 174.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 67.7 t -129.07 98.94 4.41 Favored 'Isoleucine or valine' 0 C--O 1.249 1.058 0 CA-C-O 121.763 0.792 . . . . 33.94 111.319 -176.561 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 57.05 -119.54 16.28 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-N 115.419 -0.81 . . . . 29.87 113.626 -173.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -81.74 -7.19 59.57 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.428 0.691 . . . . 25.06 112.208 178.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 75.0 m-85 -119.34 174.43 6.37 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 115.737 1.755 . . . . 33.67 115.737 -172.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 -128.71 144.91 51.27 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 107.727 -1.212 . . . . 35.41 107.727 173.582 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 6.1 t -136.93 144.87 31.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 123.783 0.833 . . . . 32.35 110.144 179.325 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -106.13 132.16 52.54 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 107.198 -1.408 . . . . 40.28 107.198 171.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 21.8 pt-20 -147.36 159.26 43.89 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.098 0.407 . . . . 49.63 112.098 177.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' LYS . . . . . 0.533 ' HG3' ' O ' ' A' ' 256' ' ' HOH . 0.1 OUTLIER -60.66 134.13 56.78 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 113.89 1.071 . . . . 56.07 113.89 -178.829 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 28.3 mmt180 -51.01 -67.88 0.21 Allowed 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 109.416 -0.587 . . . . 65.58 109.416 176.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.494 0 C-N-CA 124.049 0.939 . . . . 59.21 108.813 168.943 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 200' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 219' ' ' HOH . . . . . 0.567 ' O ' ' HA2' ' A' ' 11' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 256' ' ' HOH . . . . . 0.533 ' O ' ' HG3' ' A' ' 100' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 257' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 258' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 259' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 260' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 261' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 262' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 264' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 265' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 266' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 267' ' ' HOH . . . . . 0.453 ' O ' ' HE1' ' A' ' 23' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 268' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 269' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 270' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 271' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.129 0 N-CA-C 108.746 -0.835 . . . . 30.39 108.746 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 92.8 t -74.39 123.06 29.03 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.368 0 N-CA-C 108.695 -0.854 . . . . 29.28 108.695 168.754 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ARG . . . . . . . . . . . . . 64.0 mtt180 -136.69 158.55 44.18 Favored 'General case' 0 N--CA 1.477 0.887 0 N-CA-C 113.399 0.889 . . . . 40.11 113.399 179.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 67.3 mt -95.28 121.52 45.92 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.015 0 N-CA-C 106.884 -1.524 . . . . 25.71 106.884 174.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ARG . . . . . 0.469 ' HD3' ' SD ' ' A' ' 23' ' ' MET . 9.1 ptm180 -149.28 -178.85 6.63 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 112.326 0.491 . . . . 46.74 112.326 -178.008 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 15.4 mt -99.55 142.61 30.81 Favored 'General case' 0 CA--C 1.504 -0.8 0 CA-C-N 116.249 -0.432 . . . . 28.54 109.951 -177.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ALA . . . . . . . . . . . . . . . -127.93 137.77 52.4 Favored 'General case' 0 N--CA 1.438 -1.052 0 CA-C-N 116.12 -0.491 . . . . 32.66 109.967 174.973 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LYS . . . . . 0.543 ' HE3' ' HE2' ' A' ' 18' ' ' TYR . 0.1 OUTLIER -67.97 146.29 53.71 Favored 'General case' 0 CA--C 1.509 -0.626 0 C-N-CA 123.263 0.625 . . . . 48.41 112.161 -176.811 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 3.4 t80 -163.22 150.06 12.53 Favored 'General case' 0 CA--C 1.562 1.409 0 N-CA-C 104.001 -2.592 . . . . 46.88 104.001 -170.332 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLY . . . . . 0.567 ' HA2' ' O ' ' A' ' 219' ' ' HOH . . . 84.73 -149.65 24.64 Favored Glycine 0 N--CA 1.487 2.062 0 N-CA-C 118.465 2.146 . . . . 46.61 118.465 -177.63 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 8.8 mtm180 -139.32 158.88 43.38 Favored 'General case' 0 N--CA 1.489 1.512 0 N-CA-C 116.498 2.036 . . . . 52.22 116.498 -162.588 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 76.9 tttt -45.96 132.73 9.15 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 115.635 -0.711 . . . . 55.19 111.555 167.592 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 11.6 m-70 73.55 -14.01 0.68 Allowed 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 124.061 0.945 . . . . 53.97 113.241 -178.267 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' HIS . . . . . . . . . . . . . 77.2 m-70 -138.41 71.39 45.64 Favored Pre-proline 0 CA--C 1.555 1.171 0 CA-C-O 121.377 0.608 . . . . 47.76 110.539 169.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' PRO . . . . . . . . . . . . . 41.9 Cg_endo -71.19 147.31 53.51 Favored 'Trans proline' 0 C--N 1.352 0.712 0 C-N-CA 117.785 -1.01 . . . . 37.58 110.279 178.514 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 32.4 mm -132.02 139.09 51.11 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.472 0 N-CA-C 107.7 -1.222 . . . . 30.94 107.7 174.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.543 ' HE2' ' HE3' ' A' ' 9' ' ' LYS . 58.3 m-85 -120.42 120.38 35.78 Favored 'General case' 0 N--CA 1.482 1.144 0 O-C-N 124.217 0.948 . . . . 32.37 112.759 -179.351 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.54 HH11 HG21 ' A' ' 36' ' ' ILE . 54.4 mtm180 -78.6 133.3 37.3 Favored 'General case' 0 C--N 1.326 -0.431 0 C-N-CA 119.532 -0.867 . . . . 35.9 109.305 168.894 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 60.4 mt -85.28 116.94 29.49 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 N-CA-C 105.612 -1.996 . . . . 32.02 105.612 169.516 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 34.6 m -122.33 160.26 24.63 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.43 0 C-N-CA 120.41 -0.516 . . . . 30.17 111.336 -171.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 47.9 t -104.36 122.88 57.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.014 0 N-CA-C 106.162 -1.792 . . . . 33.17 106.162 164.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' MET . . . . . 0.469 ' SD ' ' HD3' ' A' ' 6' ' ' ARG . 23.0 ptm -146.19 158.86 43.9 Favored 'General case' 0 C--O 1.222 -0.388 0 N-CA-C 111.793 0.294 . . . . 41.92 111.793 -176.025 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -107.15 128.41 54.38 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 109.163 -0.68 . . . . 45.51 109.163 172.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 0.46 0 N-CA-C 118.239 2.681 . . . . 48.91 118.239 -165.591 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.507 ' HG2' ' N ' ' A' ' 33' ' ' TYR . 20.7 tttm . . . . . 0 C--O 1.244 0.784 0 N-CA-C 112.189 0.44 . . . . 52.27 112.189 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.507 ' N ' ' HG2' ' A' ' 32' ' ' LYS . 34.6 m-85 -144.85 155.18 43.34 Favored 'General case' 0 N--CA 1.45 -0.453 0 C-N-CA 125.861 1.664 . . . . 48.44 108.117 -167.453 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ILE . . . . . . . . . . . . . 82.4 mt -71.33 -37.69 66.41 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 122.334 0.254 . . . . 44.06 111.146 177.359 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -162.11 155.51 20.78 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 122.727 0.411 . . . . 45.73 110.394 -177.594 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ILE . . . . . 0.54 HG21 HH11 ' A' ' 19' ' ' ARG . 48.1 mt -113.67 129.26 69.82 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.878 0 N-CA-C 105.726 -1.953 . . . . 36.53 105.726 173.618 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 19.4 mt -98.85 -11.41 21.78 Favored 'General case' 0 N--CA 1.447 -0.584 0 C-N-CA 120.702 -0.399 . . . . 30.22 111.173 -177.593 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 153.51 -178.58 30.43 Favored Glycine 0 N--CA 1.494 2.535 0 N-CA-C 115.119 0.808 . . . . 30.67 115.119 -178.379 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 62.8 m -134.8 131.84 37.97 Favored 'General case' 0 C--O 1.252 1.226 0 CA-C-O 121.866 0.841 . . . . 33.74 109.659 -173.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' TYR . . . . . . . . . . . . . 87.9 t80 -129.93 138.76 51.07 Favored 'General case' 0 N--CA 1.437 -1.082 0 CA-C-N 114.748 -1.114 . . . . 30.7 111.375 -167.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.0 t0 -114.5 110.89 46.91 Favored Pre-proline 0 C--O 1.205 -1.249 0 N-CA-C 105.715 -1.957 . . . . 31.23 105.715 -177.172 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' PRO . . . . . . . . . . . . . 65.6 Cg_endo -75.56 -24.8 11.63 Favored 'Trans proline' 0 C--O 1.249 1.047 0 C-N-CA 122.55 2.167 . . . . 35.77 115.1 -172.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 38.9 mmtt -74.91 -52.98 9.85 Favored 'General case' 0 C--N 1.325 -0.467 0 O-C-N 123.303 0.377 . . . . 48.2 110.582 178.145 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ARG . . . . . . . . . . . . . 9.3 mmt85 -83.78 -12.42 55.71 Favored 'General case' 0 CA--C 1.511 -0.557 0 C-N-CA 120.055 -0.658 . . . . 43.12 111.459 -179.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' LYS . . . . . . . . . . . . . 62.2 mttt 59.93 47.16 10.25 Favored 'General case' 0 N--CA 1.445 -0.72 0 O-C-N 123.914 0.759 . . . . 46.77 113.02 -179.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 27.7 m -127.31 151.91 34.72 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.751 0 C-N-CA 119.368 -0.933 . . . . 33.04 110.372 178.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 15.4 mt -92.0 112.15 23.97 Favored 'General case' 0 CA--C 1.503 -0.837 0 N-CA-C 108.203 -1.036 . . . . 33.96 108.203 169.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 35.9 mt -62.35 -55.88 21.16 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.008 0 O-C-N 124.737 1.273 . . . . 35.08 109.507 174.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ASN . . . . . . . . . . . . . 30.2 m120 -127.36 146.11 50.57 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 108.514 -0.921 . . . . 43.91 108.514 173.36 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.9 p -142.43 143.33 26.14 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 N-CA-C 109.831 -0.433 . . . . 36.94 109.831 165.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 47.3 m-85 -122.36 86.42 48.07 Favored Pre-proline 0 N--CA 1.449 -0.483 0 N-CA-C 108.574 -0.898 . . . . 42.1 108.574 -179.56 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_exo -62.59 -26.24 75.78 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 122.464 2.109 . . . . 37.12 115.092 -169.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 21.5 pm0 -68.46 -37.8 80.52 Favored 'General case' 0 N--CA 1.473 0.717 0 N-CA-C 110.102 -0.332 . . . . 38.02 110.102 177.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 65.5 mttm -66.39 -38.65 87.99 Favored 'General case' 0 CA--C 1.548 0.869 0 CA-C-N 115.187 -0.915 . . . . 42.68 113.358 173.674 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . 0.367 1.5 m -74.34 -31.27 28.11 Favored 'Isoleucine or valine' 0 C--O 1.242 0.661 0 N-CA-C 113.498 0.925 . . . . 33.85 113.498 179.366 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 70.9 tttt -63.36 -50.27 70.6 Favored 'General case' 0 N--CA 1.463 0.211 0 N-CA-C 108.575 -0.898 . . . . 35.37 108.575 174.25 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLU . . . . . . . . . . . . . 62.8 tt0 -51.94 -59.3 4.5 Favored 'General case' 0 N--CA 1.446 -0.637 0 CA-C-N 115.725 -0.671 . . . . 36.68 110.114 -177.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' TRP . . . . . . . . . . . . . 98.0 m95 -70.8 -43.55 68.44 Favored 'General case' 0 CA--C 1.517 -0.309 0 N-CA-C 115.344 1.609 . . . . 34.74 115.344 -170.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 37.4 t -61.06 -40.18 84.8 Favored 'Isoleucine or valine' 0 C--O 1.245 0.866 0 N-CA-C 112.243 0.46 . . . . 30.44 112.243 177.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 42.1 mt -76.31 -17.48 59.42 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 120.395 -0.522 . . . . 33.32 111.512 -179.179 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 81.1 mttt -69.71 -4.73 20.96 Favored 'General case' 0 C--O 1.218 -0.6 0 N-CA-C 115.278 1.584 . . . . 35.13 115.278 167.582 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLY . . . . . . . . . . . . . . . 82.42 10.45 83.5 Favored Glycine 0 C--O 1.222 -0.603 0 C-N-CA 120.772 -0.728 . . . . 31.13 113.67 178.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 14.3 t -66.45 143.89 15.19 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 N-CA-C 108.879 -0.786 . . . . 26.6 108.879 -179.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -78.59 135.67 37.33 Favored 'General case' 0 C--O 1.204 -1.291 0 N-CA-C 110.215 -0.291 . . . . 35.54 110.215 -176.56 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' LEU . . . . . . . . . . . . . 6.9 mp -103.37 135.4 45.06 Favored 'General case' 0 C--O 1.25 1.087 0 C-N-CA 124.032 0.933 . . . . 23.25 111.182 174.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 86.3 p -62.74 160.57 14.05 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 108.945 -0.761 . . . . 22.9 108.945 170.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 58.2 t60 -56.37 -46.8 79.9 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 120.471 -0.492 . . . . 34.56 112.233 -179.209 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 51.9 ttt180 -76.16 -33.92 59.36 Favored 'General case' 0 C--O 1.207 -1.132 0 C-N-CA 119.036 -1.066 . . . . 29.03 112.025 -173.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -61.33 -43.21 99.25 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 118.601 0.637 . . . . 24.5 110.096 173.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.12 -49.57 76.52 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 119.146 -0.455 . . . . 33.1 110.194 174.113 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -57.13 -47.86 80.08 Favored 'General case' 0 N--CA 1.497 1.921 0 N-CA-C 113.211 0.819 . . . . 29.02 113.211 -177.025 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ILE . . . . . . . . . . . . . 63.7 mt -57.74 -51.05 75.09 Favored 'Isoleucine or valine' 0 C--O 1.254 1.34 0 C-N-CA 123.505 0.722 . . . . 30.07 111.405 176.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 55.5 mt -72.76 -31.41 64.89 Favored 'General case' 0 C--O 1.219 -0.525 0 C-N-CA 120.433 -0.507 . . . . 32.21 111.522 -173.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' TRP . . . . . . . . . . . . . 22.0 t-105 -72.92 -54.52 8.48 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 122.353 0.261 . . . . 41.11 111.057 177.312 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 96.3 m-20 -62.23 -33.12 73.98 Favored 'General case' 0 CA--C 1.513 -0.477 0 N-CA-C 115.048 1.499 . . . . 38.76 115.048 -178.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 45.7 m-70 -85.78 13.23 7.55 Favored 'General case' 0 N--CA 1.451 -0.379 0 N-CA-C 112.168 0.433 . . . . 38.71 112.168 177.51 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' GLY . . . . . . . . . . . . . . . 62.3 15.47 51.64 Favored Glycine 0 N--CA 1.464 0.531 0 N-CA-C 117.555 1.782 . . . . 40.22 117.555 178.775 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ILE . . . . . . . . . . . . . 19.4 mm -70.4 -39.63 76.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.542 0 CA-C-N 117.509 0.655 . . . . 40.15 110.854 179.15 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 95.9 mt -66.37 -42.8 87.48 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-O 120.697 0.284 . . . . 42.86 110.729 179.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 6.2 ttmt -57.15 -40.21 76.75 Favored 'General case' 0 N--CA 1.468 0.47 0 CA-C-N 115.636 -0.711 . . . . 50.28 111.573 179.5 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' GLU . . . . . 0.577 ' HG3' HG13 ' A' ' 82' ' ' VAL . 8.4 pt-20 -73.93 -24.88 59.73 Favored 'General case' 0 N--CA 1.468 0.441 0 N-CA-C 114.194 1.183 . . . . 51.36 114.194 179.732 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' VAL . . . . . 0.577 HG13 ' HG3' ' A' ' 81' ' ' GLU . 28.1 m -111.71 -26.54 3.08 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.921 0 N-CA-C 117.435 2.383 . . . . 46.08 117.435 -171.743 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' VAL . . . . . . . . . . . . . 96.5 t -88.77 112.61 51.63 Favored Pre-proline 0 C--O 1.246 0.919 0 CA-C-N 118.315 0.507 . . . . 47.94 111.367 -178.31 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' PRO . . . . . 0.419 ' HD3' ' O ' ' A' ' 82' ' ' VAL . 52.2 Cg_exo -63.53 152.37 80.54 Favored 'Trans proline' 0 C--N 1.353 0.769 0 C-N-CA 123.655 2.903 . . . . 50.9 113.677 175.58 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . . . -62.8 145.3 55.25 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 108.074 -1.084 . . . . 52.21 108.074 166.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' GLY . . . . . . . . . . . . . . . 102.09 -13.02 57.45 Favored Glycine 0 N--CA 1.464 0.54 0 N-CA-C 110.829 -0.908 . . . . 51.47 110.829 -171.273 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' TYR . . . . . . . . . . . . . 30.0 m-85 -108.09 132.37 53.65 Favored 'General case' 0 CA--C 1.511 -0.557 0 N-CA-C 107.492 -1.299 . . . . 49.53 107.492 169.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -118.13 146.34 44.23 Favored 'General case' 0 C--N 1.33 -0.275 0 N-CA-C 108.872 -0.788 . . . . 52.96 108.872 -178.791 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' MET . . . . . . . . . . . . . 47.0 ttp -87.84 128.88 35.34 Favored 'General case' 0 CA--C 1.515 -0.374 0 N-CA-C 109.135 -0.691 . . . . 44.16 109.135 173.367 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 66.0 mttt -115.93 142.46 46.75 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-O 121.362 0.601 . . . . 45.3 112.109 173.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ARG . . . . . . . . . . . . . 56.4 ttt180 -91.61 119.52 31.58 Favored 'General case' 0 N--CA 1.446 -0.631 0 CA-C-N 115.761 -0.654 . . . . 37.63 109.28 174.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 67.7 t -129.07 98.94 4.41 Favored 'Isoleucine or valine' 0 C--O 1.249 1.058 0 CA-C-O 121.763 0.792 . . . . 33.94 111.319 -176.561 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' GLY . . . . . . . . . . . . . . . 57.05 -119.54 16.28 Favored Glycine 0 CA--C 1.529 0.944 0 CA-C-N 115.419 -0.81 . . . . 29.87 113.626 -173.402 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -81.74 -7.19 59.57 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 123.428 0.691 . . . . 25.06 112.208 178.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 75.0 m-85 -119.34 174.43 6.37 Favored 'General case' 0 N--CA 1.474 0.755 0 N-CA-C 115.737 1.755 . . . . 33.67 115.737 -172.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' TYR . . . . . . . . . . . . . 90.6 m-85 -128.71 144.91 51.27 Favored 'General case' 0 C--O 1.238 0.464 0 N-CA-C 107.727 -1.212 . . . . 35.41 107.727 173.582 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' VAL . . . . . . . . . . . . . 6.1 t -136.93 144.87 31.07 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 C-N-CA 123.783 0.833 . . . . 32.35 110.144 179.325 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' PHE . . . . . . . . . . . . . 44.8 m-85 -106.13 132.16 52.54 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 107.198 -1.408 . . . . 40.28 107.198 171.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' GLU . . . . . . . . . . . . . 21.8 pt-20 -147.36 159.26 43.89 Favored 'General case' 0 N--CA 1.469 0.523 0 N-CA-C 112.098 0.407 . . . . 49.63 112.098 177.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' LYS . . . . . 0.533 ' HG3' ' O ' ' A' ' 256' ' ' HOH . 0.1 OUTLIER -60.66 134.13 56.78 Favored 'General case' 0 N--CA 1.478 0.938 0 N-CA-C 113.89 1.071 . . . . 56.07 113.89 -178.829 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ARG . . . . . . . . . . . . . 28.3 mmt180 -51.01 -67.88 0.21 Allowed 'General case' 0 N--CA 1.475 0.792 0 N-CA-C 109.416 -0.587 . . . . 65.58 109.416 176.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.494 0 C-N-CA 124.049 0.939 . . . . 59.21 108.813 168.943 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 200' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' HOH . . . . . 0.567 ' O ' ' HA2' ' A' ' 11' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 225' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 226' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 228' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 229' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 231' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 232' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 234' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 235' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 236' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 237' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 238' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 239' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 240' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 241' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 242' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 243' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 244' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 245' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 246' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 247' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 248' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 249' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 250' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 251' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 252' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 253' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 254' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 255' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 256' ' ' HOH . . . . . 0.533 ' O ' ' HG3' ' A' ' 100' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 257' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 258' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 259' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 260' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 261' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 262' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 263' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 264' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 265' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 266' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 267' ' ' HOH . . . . . 0.453 ' O ' ' HE1' ' A' ' 23' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 268' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 269' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 270' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 271' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_