data_3d75_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 3d75 _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 ' 3' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 . . . . . 0 N--CA 1.485 1.276 0 CA-C-O 121.202 0.525 . . . . 87.15 110.07 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 41.9 p-90 -54.6 -34.71 62.44 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 114.565 -1.198 . . . . 88.25 111.866 165.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.1 t -44.74 110.68 1.09 Allowed Pre-proline 0 N--CA 1.473 0.693 0 O-C-N 123.95 0.781 . . . . 85.74 112.379 -176.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 92.9 Cg_endo -75.85 151.96 36.36 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 O-C-N 122.391 0.68 . . . . 85.07 112.513 -176.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -59.97 -20.51 60.67 Favored 'Trans proline' 0 CA--C 1.535 0.553 0 C-N-CA 123.21 2.606 . . . . 85.42 115.458 -174.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -76.01 -13.35 60.23 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.32 0.388 . . . . 89.11 111.339 -177.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 39.6 t -76.78 -36.45 26.45 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.627 0 CA-C-N 116.676 -0.238 . . . . 85.1 110.543 176.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 70.6 m-85 -64.73 -35.22 80.35 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.838 0.681 . . . . 83.44 112.838 -174.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . 1.043 0.9 OUTLIER -73.91 -33.53 64.02 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 119.726 3.232 . . . . 83.1 119.726 165.105 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.41 -47.02 69.94 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.013 -0.994 . . . . 81.18 110.378 168.212 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' VAL . . . . . 0.407 ' CG1' ' CZ ' ' A' ' 56' ' ' PHE . 32.7 m -85.56 -11.09 11.39 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.499 0 N-CA-C 115.727 1.751 . . . . 77.71 115.727 -178.815 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -50.74 -51.31 51.29 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 114.578 1.325 . . . . 73.96 114.578 -163.441 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -67.56 -46.52 72.47 Favored 'General case' 0 CA--C 1.504 -0.807 0 CA-C-O 121.46 0.648 . . . . 72.46 111.857 -175.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -56.77 -39.77 74.64 Favored 'General case' 0 C--O 1.205 -1.25 0 CA-C-N 115.36 -0.836 . . . . 74.79 111.684 174.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 37.1 tttt -59.38 -51.18 71.0 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-N 118.434 0.561 . . . . 72.7 109.749 179.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.26 -43.7 92.45 Favored 'General case' 0 C--O 1.218 -0.563 0 O-C-N 124.139 0.899 . . . . 67.5 110.673 -175.787 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 47.4 ttp85 -68.55 -45.7 71.45 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 115.921 -0.581 . . . . 68.91 111.526 -178.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 68.0 m -61.9 -42.16 98.75 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 112.654 0.613 . . . . 69.49 112.654 177.625 -72.094 -62.979 -81.967 103.504 2.026 103.579 -93.625 -174.148 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 66.6 mtp -66.23 -41.36 90.14 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.247 -0.649 . . . . 69.73 109.247 179.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 8.5 t -62.47 -48.59 78.93 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 115.655 -0.702 . . . . 72.33 112.27 178.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -56.51 -30.86 63.51 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 114.07 1.137 . . . . 69.22 114.07 179.176 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.3 m-70 -115.89 -5.5 12.03 Favored 'General case' 0 C--O 1.218 -0.556 0 O-C-N 125.163 1.539 . . . . 73.97 114.114 -162.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 72.05 29.18 67.2 Favored Glycine 0 N--CA 1.418 -2.507 0 CA-C-N 115.366 -0.834 . . . . 68.95 113.38 -177.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 3.1 m -80.46 137.36 36.47 Favored 'General case' 0 C--O 1.243 0.73 0 C-N-CA 122.818 0.447 . . . . 67.62 111.439 -174.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 4.9 p -102.56 154.07 19.47 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 123.601 0.563 . . . . 66.0 110.973 171.052 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 63.7 tp60 -56.69 -40.37 75.49 Favored 'General case' 0 C--O 1.254 1.306 0 N-CA-C 112.173 0.434 . . . . 66.93 112.173 171.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -50.54 -39.87 50.22 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 124.044 0.84 . . . . 65.81 112.121 176.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -70.98 -38.45 72.73 Favored 'General case' 0 CA--C 1.509 -0.632 0 C-N-CA 120.735 -0.386 . . . . 66.41 111.169 -179.78 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ILE . . . . . . . . . . . . . 64.5 mt -64.79 -42.14 94.11 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.007 0 N-CA-C 108.459 -0.941 . . . . 67.84 108.459 178.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 81.3 m-20 -57.38 -42.86 82.96 Favored 'General case' 0 C--O 1.245 0.817 0 CA-C-N 115.841 -0.618 . . . . 70.58 111.466 177.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -62.6 -41.2 98.83 Favored 'General case' 0 CA--C 1.507 -0.71 0 N-CA-C 113.661 0.986 . . . . 77.74 113.661 179.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 75.9 t -64.33 -38.6 82.95 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 N-CA-C 106.926 -1.509 . . . . 68.19 106.926 -178.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -68.11 -33.45 74.53 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 115.816 -0.629 . . . . 67.94 112.504 179.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 23.8 pttt -88.56 15.97 7.26 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 114.386 1.254 . . . . 69.07 114.386 172.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 102.96 -17.52 52.27 Favored Glycine 0 C--N 1.338 0.689 0 N-CA-C 115.084 0.794 . . . . 69.79 115.084 169.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 64.3 m-20 -87.91 105.19 17.27 Favored 'General case' 0 CA--C 1.549 0.934 0 O-C-N 122.089 -0.653 . . . . 71.77 110.405 -172.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 7.1 tp -122.38 127.46 49.76 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 113.422 0.897 . . . . 71.37 113.422 174.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 34.9 m -114.43 165.28 9.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 123.649 0.78 . . . . 71.67 110.09 170.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -91.25 71.41 6.18 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 103.918 -2.623 . . . . 73.07 103.918 -175.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.9 mm-40 -115.15 124.68 29.88 Favored Pre-proline 0 N--CA 1.447 -0.577 0 N-CA-C 106.788 -1.56 . . . . 72.09 106.788 174.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -55.38 -35.4 91.72 Favored 'Trans proline' 0 C--N 1.368 1.582 0 C-N-CA 123.381 2.721 . . . . 69.87 114.436 -179.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 26.5 p -55.93 -29.33 59.95 Favored 'General case' 0 C--O 1.214 -0.789 0 C-N-CA 119.791 -0.764 . . . . 68.51 112.59 177.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 7.1 tp -102.52 -40.46 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 CA-C-N 118.878 0.763 . . . . 66.87 112.724 177.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 76.7 p -68.61 -37.65 79.95 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 112.487 0.551 . . . . 66.84 112.487 -178.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 89.5 m -75.86 -29.3 58.51 Favored 'General case' 0 CA--C 1.509 -0.63 0 N-CA-C 108.975 -0.75 . . . . 68.22 108.975 178.255 -64.77 -46.124 114.618 103.201 2.009 105.75 -152.208 -58.558 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 90.5 t80 -58.47 -47.89 82.55 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 112.675 0.62 . . . . 69.3 112.675 169.494 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 75.3 mtm -65.52 -42.75 91.66 Favored 'General case' 0 CA--C 1.557 1.232 0 O-C-N 121.078 -1.014 . . . . 68.78 111.599 179.774 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -57.27 -47.9 80.24 Favored 'General case' 0 C--O 1.254 1.294 0 O-C-N 121.552 -0.718 . . . . 71.46 110.281 174.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 49.0 t -52.79 -48.91 66.53 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-O 121.554 0.692 . . . . 69.76 112.588 179.34 -174.148 -93.625 -81.967 103.579 2.026 103.504 -62.979 -72.094 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 12.1 tp -69.99 -42.64 72.82 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.203 -0.908 . . . . 68.21 112.906 -176.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 25.8 mt -56.17 -46.6 79.27 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-O 121.461 0.648 . . . . 66.77 112.228 171.259 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.5 tm-20 -58.62 -47.75 83.33 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 115.5 -0.773 . . . . 72.01 110.598 176.047 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.11 -26.8 40.61 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.628 0.603 . . . . 66.65 112.628 -175.524 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' PHE . . . . . 0.563 ' CD1' ' C6 ' ' A' ' 120' ' ' NBB . 16.7 m-85 -111.57 22.08 15.44 Favored 'General case' 0 CA--C 1.493 -1.217 0 N-CA-C 109.726 -0.472 . . . . 67.99 109.726 -176.505 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 2.3 m 53.48 36.28 22.8 Favored 'General case' 0 C--O 1.219 -0.53 0 N-CA-C 114.153 1.168 . . . . 68.22 114.153 175.179 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 42.4 mt -90.4 -20.8 22.39 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.904 -0.589 . . . . 66.37 111.371 -179.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 21.5 m -139.29 157.98 28.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.241 -0.89 . . . . 67.03 111.475 176.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASP . . . . . 0.631 ' OD2' ' ND2' ' A' ' 64' ' ' ASN . 45.4 p30 -93.36 -169.58 2.17 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.37 -0.832 . . . . 66.7 111.193 178.839 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -70.94 -17.3 62.68 Favored 'General case' 0 C--N 1.384 2.086 0 O-C-N 126.081 2.113 . . . . 69.79 111.217 -173.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLU . . . . . 0.404 ' OE2' ' O ' ' A' ' 161' ' ' HOH . 80.1 mt-10 -110.43 23.35 14.37 Favored 'General case' 0 CA--C 1.553 1.088 0 N-CA-C 114.878 1.436 . . . . 71.48 114.878 170.013 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . 59.59 34.0 22.2 Favored 'General case' 0 CA--C 1.495 -1.17 0 N-CA-C 112.104 0.409 . . . . 67.75 112.104 176.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ASN . . . . . 0.631 ' ND2' ' OD2' ' A' ' 60' ' ' ASP . 60.9 m-80 -82.69 131.36 35.21 Favored 'General case' 0 N--CA 1.437 -1.116 0 N-CA-C 107.863 -1.162 . . . . 68.72 107.863 164.248 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 5.0 t -82.38 126.09 39.94 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.491 0 CA-C-N 114.82 -1.082 . . . . 68.58 111.149 -173.283 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -82.18 93.06 6.99 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-O 122.125 0.964 . . . . 74.1 108.747 169.114 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -66.57 -29.37 69.42 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.284 -1.325 . . . . 77.52 112.894 -169.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -66.45 -52.1 49.92 Favored 'General case' 0 C--O 1.246 0.9 0 O-C-N 123.367 0.417 . . . . 73.92 111.427 176.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 96.9 mt -58.17 -46.95 88.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 109.813 -0.44 . . . . 73.75 109.813 174.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' MET . . . . . 0.519 ' CE ' ' O ' ' A' ' 170' ' ' HOH . 6.2 ttt -55.25 -49.21 72.62 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.304 -0.407 . . . . 71.2 111.27 178.771 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 52.1 mt -63.55 -37.46 87.41 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 112.995 0.739 . . . . 71.22 112.995 178.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -71.34 -9.75 68.66 Favored Glycine 0 N--CA 1.47 0.945 0 N-CA-C 115.831 1.093 . . . . 69.63 115.831 -179.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 6.5 mp -100.45 7.2 44.34 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 117.498 0.649 . . . . 69.65 111.525 176.902 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 44.8 mt -111.38 155.98 41.95 Favored Pre-proline 0 C--N 1.331 -0.223 0 CA-C-O 119.235 -0.412 . . . . 68.27 110.59 -178.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -69.24 140.37 44.47 Favored 'Trans proline' 0 C--N 1.354 0.858 0 O-C-N 123.022 1.011 . . . . 68.28 110.409 173.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 17.2 p-10 -56.21 -25.24 46.52 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 121.799 0.809 . . . . 69.8 112.453 -175.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 40.0 tt0 -49.25 -57.0 7.54 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 114.226 -1.352 . . . . 68.96 111.163 168.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.19 -29.66 57.73 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 114.939 1.459 . . . . 69.9 114.939 179.43 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 53.9 mt-30 -46.96 -41.43 16.15 Favored 'General case' 0 C--O 1.246 0.886 0 N-CA-C 113.352 0.871 . . . . 73.81 113.352 -168.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -56.82 -57.07 14.07 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.328 1.051 . . . . 67.37 110.813 174.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 44.1 ttt180 -67.48 -31.02 70.88 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.662 -0.699 . . . . 67.13 111.44 -176.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.76 -52.94 31.49 Favored 'General case' 0 N--CA 1.463 0.214 0 O-C-N 123.539 0.525 . . . . 66.24 110.207 176.146 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -50.17 -40.16 45.89 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 113.24 0.83 . . . . 68.1 113.24 175.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 32.1 t -60.98 -51.14 70.51 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.753 -0.832 . . . . 66.65 108.753 177.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -64.5 -36.49 77.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 113.013 0.746 . . . . 68.13 113.013 -177.912 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' MET . . . . . 0.853 ' CG ' ' O ' ' A' ' 170' ' ' HOH . 26.0 mtm -70.2 -32.6 70.58 Favored 'General case' 0 C--O 1.219 -0.533 0 CA-C-O 121.134 0.492 . . . . 67.55 109.997 177.362 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -50.0 -54.58 18.08 Favored Glycine 0 C--O 1.241 0.537 0 N-CA-C 110.085 -1.206 . . . . 68.1 110.085 173.328 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 10.8 tttt -65.75 -51.48 58.8 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.488 0.551 . . . . 68.06 112.488 179.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' CYS . . . . . . . . . . . . . 82.0 m -91.6 -4.16 55.61 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 117.3 2.333 . . . . 69.58 117.3 -164.385 -60.149 -71.43 -83.765 101.566 2.034 105.151 -88.826 -172.306 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 77.8 mt -112.47 147.48 37.14 Favored Pre-proline 0 C--N 1.326 -0.45 0 N-CA-C 109.425 -0.583 . . . . 70.5 109.425 175.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -72.31 161.21 92.93 Favored 'Cis proline' 0 CA--C 1.528 0.217 0 N-CA-C 116.134 1.552 . . . . 71.44 116.134 2.267 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 61.3 p -70.88 151.66 44.51 Favored 'General case' 0 C--O 1.244 0.809 0 CA-C-N 115.398 -0.819 . . . . 72.29 111.024 174.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' SER . . . . . 0.477 ' CB ' ' O ' ' A' ' 160' ' ' HOH . 4.4 p -149.28 152.91 36.72 Favored 'General case' 0 C--O 1.242 0.7 0 CA-C-N 114.027 -1.442 . . . . 73.32 107.121 175.55 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 159.87 175.0 30.36 Favored Glycine 0 C--O 1.22 -0.779 0 CA-C-N 115.496 -0.775 . . . . 72.11 111.626 -169.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 53.1 p -89.37 -14.81 34.76 Favored 'General case' 0 C--O 1.243 0.726 0 C-N-CA 124.628 1.171 . . . . 71.98 111.981 -174.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -169.21 178.89 4.18 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 105.714 -1.958 . . . . 74.79 105.714 -177.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -68.1 -36.96 80.63 Favored 'General case' 0 CA--C 1.497 -1.09 0 N-CA-C 112.33 0.493 . . . . 69.42 112.33 -172.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 71.3 m -64.34 -49.8 70.28 Favored 'General case' 0 C--O 1.24 0.589 0 O-C-N 123.635 0.584 . . . . 69.66 111.831 175.653 -58.558 -152.208 114.618 105.75 2.009 103.201 -46.124 -64.77 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 51.8 t30 -60.35 -33.39 72.35 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 114.575 1.324 . . . . 69.0 114.575 176.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 69.9 mttt -64.99 -40.43 94.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.352 -0.386 . . . . 68.41 110.497 179.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 41.9 mm -76.13 -38.4 34.52 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.216 0 CA-C-N 116.28 -0.418 . . . . 68.64 109.938 -178.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 80.2 t80 -48.2 -55.31 10.75 Favored 'General case' 0 CA--C 1.563 1.447 0 C-N-CA 119.476 -0.89 . . . . 67.65 110.614 166.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -56.78 -36.78 70.24 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 112.641 0.608 . . . . 68.88 112.641 -178.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 22.0 tp -73.04 -48.83 32.66 Favored 'General case' 0 C--O 1.261 1.667 0 N-CA-C 109.064 -0.717 . . . . 67.15 109.064 -176.236 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.93 -42.17 71.94 Favored 'General case' 0 C--O 1.257 1.482 0 O-C-N 124.234 0.959 . . . . 66.47 111.201 178.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 19.4 tptt -67.46 -44.85 77.61 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 114.945 -1.025 . . . . 74.92 111.67 -177.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' CYS . . . . . . . . . . . . . 38.5 t -60.48 -45.73 92.69 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 114.895 -1.048 . . . . 67.94 110.587 176.534 -172.306 -88.826 -83.765 105.151 2.034 101.566 -71.43 -60.149 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' VAL . . . . . 0.431 ' O ' ' N ' ' A' ' 112' ' ' ALA . 60.1 t -66.9 -46.03 86.02 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.652 0 C-N-CA 120.739 -0.384 . . . . 67.88 110.39 179.429 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -59.01 -40.94 86.49 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 112.961 0.726 . . . . 69.12 112.961 -178.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.73 -41.7 91.93 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 109.529 -0.545 . . . . 73.18 109.529 177.635 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 40.7 m -86.09 -45.5 11.34 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 113.204 0.816 . . . . 74.72 113.204 -171.002 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' ALA . . . . . 0.431 ' N ' ' O ' ' A' ' 108' ' ' VAL . . . -135.43 99.88 11.67 Favored Pre-proline 0 C--O 1.241 0.626 0 C-N-CA 123.215 0.606 . . . . 75.12 110.361 177.872 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -59.1 -35.89 97.13 Favored 'Trans proline' 0 CA--C 1.537 0.655 1 C-N-CA 126.721 4.947 . . . . 76.28 115.929 170.591 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -64.95 -23.29 67.18 Favored 'General case' 0 CA--C 1.552 1.045 0 N-CA-C 114.721 1.378 . . . . 80.94 114.721 175.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 42.9 t -95.66 -38.09 8.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 N-CA-C 117.194 2.294 . . . . 75.25 117.194 -160.184 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' TRP . . . . . . . . . . . . . 52.7 t-105 -93.14 88.46 6.08 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 119.562 -0.855 . . . . 74.62 113.116 -173.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -102.25 150.78 22.96 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 108.063 -1.088 . . . . 73.1 108.063 178.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' VAL . . . . . . . . . . . . . 40.5 t -125.69 128.36 72.18 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.979 0 C-N-CA 119.81 -0.756 . . . . 68.69 111.134 176.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . . 96.4 mt . . . . . 0 C--O 1.243 0.713 0 O-C-N 123.505 0.503 . . . . 68.17 111.604 179.165 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' NBB . . . . . 0.563 ' C6 ' ' CD1' ' A' ' 56' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' HOH . . . . . 0.492 ' O ' ' CD2' ' A' ' 56' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' HOH . . . . . 0.477 ' O ' ' CB ' ' A' ' 93' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' HOH . . . . . 0.404 ' O ' ' OE2' ' A' ' 62' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' HOH . . . . . 0.853 ' O ' ' CG ' ' A' ' 86' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 . . . . . 0 N--CA 1.485 1.276 0 CA-C-O 121.202 0.525 . . . . 87.150000000000006 110.07 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 41.9 p-90 -54.6 -34.71 62.44 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 114.565 -1.198 . . . . 88.25 111.866 165.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.1 t -44.74 110.68 1.09 Allowed Pre-proline 0 N--CA 1.473 0.693 0 O-C-N 123.95 0.781 . . . . 85.739999999999995 112.379 -176.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' PRO . . . . . 0.469 ' HG2' HG23 ' A' ' 9' ' ' VAL . 92.9 Cg_endo -75.85 151.96 36.36 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 O-C-N 122.391 0.68 . . . . 85.069999999999993 112.513 -176.988 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -59.97 -20.51 60.67 Favored 'Trans proline' 0 CA--C 1.535 0.553 0 C-N-CA 123.21 2.606 . . . . 85.420000000000002 115.458 -174.062 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -76.01 -13.35 60.23 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.32 0.388 . . . . 89.109999999999999 111.339 -177.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' VAL . . . . . 0.469 HG23 ' HG2' ' A' ' 6' ' ' PRO . 39.6 t -76.78 -36.45 26.45 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.627 0 CA-C-N 116.676 -0.238 . . . . 85.099999999999994 110.543 176.194 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' PHE . . . . . 0.43 ' HA ' HG22 ' A' ' 13' ' ' VAL . 70.6 m-85 -64.73 -35.22 80.35 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.838 0.681 . . . . 83.439999999999998 112.838 -174.535 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . 1.043 0.9 OUTLIER -73.91 -33.53 64.02 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 119.726 3.232 . . . . 83.099999999999994 119.726 165.105 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.41 -47.02 69.94 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.013 -0.994 . . . . 81.180000000000007 110.378 168.212 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' VAL . . . . . 0.829 HG12 ' CZ ' ' A' ' 56' ' ' PHE . 32.7 m -85.56 -11.09 11.39 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.499 0 N-CA-C 115.727 1.751 . . . . 77.709999999999994 115.727 -178.815 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -50.74 -51.31 51.29 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 114.578 1.325 . . . . 73.959999999999994 114.578 -163.441 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -67.56 -46.52 72.47 Favored 'General case' 0 CA--C 1.504 -0.807 0 CA-C-O 121.46 0.648 . . . . 72.459999999999994 111.857 -175.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -56.77 -39.77 74.64 Favored 'General case' 0 C--O 1.205 -1.25 0 CA-C-N 115.36 -0.836 . . . . 74.790000000000006 111.684 174.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 37.1 tttt -59.38 -51.18 71.0 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-N 118.434 0.561 . . . . 72.700000000000003 109.749 179.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.26 -43.7 92.45 Favored 'General case' 0 C--O 1.218 -0.563 0 O-C-N 124.139 0.899 . . . . 67.5 110.673 -175.787 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 47.4 ttp85 -68.55 -45.7 71.45 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 115.921 -0.581 . . . . 68.909999999999997 111.526 -178.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 68.0 m -61.9 -42.16 98.75 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 112.654 0.613 . . . . 69.489999999999995 112.654 177.625 -72.094 -62.979 -81.967 103.504 2.026 103.579 -93.625 -174.148 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 66.6 mtp -66.23 -41.36 90.14 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.247 -0.649 . . . . 69.730000000000004 109.247 179.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 8.5 t -62.47 -48.59 78.93 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 115.655 -0.702 . . . . 72.329999999999998 112.27 178.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -56.51 -30.86 63.51 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 114.07 1.137 . . . . 69.219999999999999 114.07 179.176 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.3 m-70 -115.89 -5.5 12.03 Favored 'General case' 0 C--O 1.218 -0.556 0 O-C-N 125.163 1.539 . . . . 73.969999999999999 114.114 -162.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 72.05 29.18 67.2 Favored Glycine 0 N--CA 1.418 -2.507 0 CA-C-N 115.366 -0.834 . . . . 68.950000000000003 113.38 -177.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 3.1 m -80.46 137.36 36.47 Favored 'General case' 0 C--O 1.243 0.73 0 C-N-CA 122.818 0.447 . . . . 67.620000000000005 111.439 -174.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 4.9 p -102.56 154.07 19.47 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 123.601 0.563 . . . . 66.0 110.973 171.052 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 63.7 tp60 -56.69 -40.37 75.49 Favored 'General case' 0 C--O 1.254 1.306 0 N-CA-C 112.173 0.434 . . . . 66.930000000000007 112.173 171.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -50.54 -39.87 50.22 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 124.044 0.84 . . . . 65.810000000000002 112.121 176.395 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -70.98 -38.45 72.73 Favored 'General case' 0 CA--C 1.509 -0.632 0 C-N-CA 120.735 -0.386 . . . . 66.409999999999997 111.169 -179.78 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ILE . . . . . 0.525 HG23 HG12 ' A' ' 118' ' ' VAL . 64.5 mt -64.79 -42.14 94.11 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.007 0 N-CA-C 108.459 -0.941 . . . . 67.840000000000003 108.459 178.158 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 81.3 m-20 -57.38 -42.86 82.96 Favored 'General case' 0 C--O 1.245 0.817 0 CA-C-N 115.841 -0.618 . . . . 70.579999999999998 111.466 177.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -62.6 -41.2 98.83 Favored 'General case' 0 CA--C 1.507 -0.71 0 N-CA-C 113.661 0.986 . . . . 77.739999999999995 113.661 179.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 75.9 t -64.33 -38.6 82.95 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 N-CA-C 106.926 -1.509 . . . . 68.189999999999998 106.926 -178.101 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -68.11 -33.45 74.53 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 115.816 -0.629 . . . . 67.939999999999998 112.504 179.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 23.8 pttt -88.56 15.97 7.26 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 114.386 1.254 . . . . 69.069999999999993 114.386 172.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 102.96 -17.52 52.27 Favored Glycine 0 C--N 1.338 0.689 0 N-CA-C 115.084 0.794 . . . . 69.790000000000006 115.084 169.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 64.3 m-20 -87.91 105.19 17.27 Favored 'General case' 0 CA--C 1.549 0.934 0 O-C-N 122.089 -0.653 . . . . 71.769999999999996 110.405 -172.116 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 7.1 tp -122.38 127.46 49.76 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 113.422 0.897 . . . . 71.370000000000005 113.422 174.143 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 34.9 m -114.43 165.28 9.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 123.649 0.78 . . . . 71.670000000000002 110.09 170.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -91.25 71.41 6.18 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 103.918 -2.623 . . . . 73.069999999999993 103.918 -175.229 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.9 mm-40 -115.15 124.68 29.88 Favored Pre-proline 0 N--CA 1.447 -0.577 0 N-CA-C 106.788 -1.56 . . . . 72.090000000000003 106.788 174.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -55.38 -35.4 91.72 Favored 'Trans proline' 0 C--N 1.368 1.582 0 C-N-CA 123.381 2.721 . . . . 69.870000000000005 114.436 -179.446 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 26.5 p -55.93 -29.33 59.95 Favored 'General case' 0 C--O 1.214 -0.789 0 C-N-CA 119.791 -0.764 . . . . 68.510000000000005 112.59 177.143 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 7.1 tp -102.52 -40.46 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 CA-C-N 118.878 0.763 . . . . 66.870000000000005 112.724 177.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 76.7 p -68.61 -37.65 79.95 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 112.487 0.551 . . . . 66.840000000000003 112.487 -178.219 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 89.5 m -75.86 -29.3 58.51 Favored 'General case' 0 CA--C 1.509 -0.63 0 N-CA-C 108.975 -0.75 . . . . 68.219999999999999 108.975 178.255 -64.77 -46.124 114.618 103.201 2.009 105.75 -152.208 -58.558 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 90.5 t80 -58.47 -47.89 82.55 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 112.675 0.62 . . . . 69.299999999999997 112.675 169.494 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 75.3 mtm -65.52 -42.75 91.66 Favored 'General case' 0 CA--C 1.557 1.232 0 O-C-N 121.078 -1.014 . . . . 68.780000000000001 111.599 179.774 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -57.27 -47.9 80.24 Favored 'General case' 0 C--O 1.254 1.294 0 O-C-N 121.552 -0.718 . . . . 71.459999999999994 110.281 174.219 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 49.0 t -52.79 -48.91 66.53 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-O 121.554 0.692 . . . . 69.760000000000005 112.588 179.34 -174.148 -93.625 -81.967 103.579 2.026 103.504 -62.979 -72.094 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 12.1 tp -69.99 -42.64 72.82 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.203 -0.908 . . . . 68.209999999999994 112.906 -176.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 25.8 mt -56.17 -46.6 79.27 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-O 121.461 0.648 . . . . 66.769999999999996 112.228 171.259 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.5 tm-20 -58.62 -47.75 83.33 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 115.5 -0.773 . . . . 72.010000000000005 110.598 176.047 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.11 -26.8 40.61 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.628 0.603 . . . . 66.650000000000006 112.628 -175.524 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' PHE . . . . . 1.002 ' HD1' ' H6 ' ' A' ' 120' ' ' NBB . 16.7 m-85 -111.57 22.08 15.44 Favored 'General case' 0 CA--C 1.493 -1.217 0 N-CA-C 109.726 -0.472 . . . . 67.989999999999995 109.726 -176.505 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 2.3 m 53.48 36.28 22.8 Favored 'General case' 0 C--O 1.219 -0.53 0 N-CA-C 114.153 1.168 . . . . 68.219999999999999 114.153 175.179 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 42.4 mt -90.4 -20.8 22.39 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.904 -0.589 . . . . 66.370000000000005 111.371 -179.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 21.5 m -139.29 157.98 28.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.241 -0.89 . . . . 67.030000000000001 111.475 176.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 45.4 p30 -93.36 -169.58 2.17 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.37 -0.832 . . . . 66.700000000000003 111.193 178.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -70.94 -17.3 62.68 Favored 'General case' 0 C--N 1.384 2.086 0 O-C-N 126.081 2.113 . . . . 69.790000000000006 111.217 -173.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLU . . . . . 0.404 ' OE2' ' O ' ' A' ' 161' ' ' HOH . 80.1 mt-10 -110.43 23.35 14.37 Favored 'General case' 0 CA--C 1.553 1.088 0 N-CA-C 114.878 1.436 . . . . 71.480000000000004 114.878 170.013 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . 59.59 34.0 22.2 Favored 'General case' 0 CA--C 1.495 -1.17 0 N-CA-C 112.104 0.409 . . . . 67.75 112.104 176.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 60.9 m-80 -82.69 131.36 35.21 Favored 'General case' 0 N--CA 1.437 -1.116 0 N-CA-C 107.863 -1.162 . . . . 68.719999999999999 107.863 164.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 5.0 t -82.38 126.09 39.94 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.491 0 CA-C-N 114.82 -1.082 . . . . 68.579999999999998 111.149 -173.283 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -82.18 93.06 6.99 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-O 122.125 0.964 . . . . 74.099999999999994 108.747 169.114 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLU . . . . . 0.428 ' HG3' ' SD ' ' A' ' 86' ' ' MET . 38.1 tt0 -66.57 -29.37 69.42 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.284 -1.325 . . . . 77.519999999999996 112.894 -169.249 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -66.45 -52.1 49.92 Favored 'General case' 0 C--O 1.246 0.9 0 O-C-N 123.367 0.417 . . . . 73.920000000000002 111.427 176.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 96.9 mt -58.17 -46.95 88.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 109.813 -0.44 . . . . 73.75 109.813 174.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' MET . . . . . 0.554 ' HE2' ' O ' ' A' ' 170' ' ' HOH . 6.2 ttt -55.25 -49.21 72.62 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.304 -0.407 . . . . 71.200000000000003 111.27 178.771 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 52.1 mt -63.55 -37.46 87.41 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 112.995 0.739 . . . . 71.219999999999999 112.995 178.386 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -71.34 -9.75 68.66 Favored Glycine 0 N--CA 1.47 0.945 0 N-CA-C 115.831 1.093 . . . . 69.629999999999995 115.831 -179.078 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 6.5 mp -100.45 7.2 44.34 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 117.498 0.649 . . . . 69.650000000000006 111.525 176.902 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 44.8 mt -111.38 155.98 41.95 Favored Pre-proline 0 C--N 1.331 -0.223 0 CA-C-O 119.235 -0.412 . . . . 68.269999999999996 110.59 -178.243 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -69.24 140.37 44.47 Favored 'Trans proline' 0 C--N 1.354 0.858 0 O-C-N 123.022 1.011 . . . . 68.280000000000001 110.409 173.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 17.2 p-10 -56.21 -25.24 46.52 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 121.799 0.809 . . . . 69.799999999999997 112.453 -175.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 40.0 tt0 -49.25 -57.0 7.54 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 114.226 -1.352 . . . . 68.959999999999994 111.163 168.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.19 -29.66 57.73 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 114.939 1.459 . . . . 69.900000000000006 114.939 179.43 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 35.3 mt-30 -46.96 -41.43 16.15 Favored 'General case' 0 C--O 1.246 0.886 0 N-CA-C 113.352 0.871 . . . . 73.810000000000002 113.352 -168.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -56.82 -57.07 14.07 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.328 1.051 . . . . 67.370000000000005 110.813 174.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 44.1 ttt180 -67.48 -31.02 70.88 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.662 -0.699 . . . . 67.129999999999995 111.44 -176.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.76 -52.94 31.49 Favored 'General case' 0 N--CA 1.463 0.214 0 O-C-N 123.539 0.525 . . . . 66.239999999999995 110.207 176.146 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -50.17 -40.16 45.89 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 113.24 0.83 . . . . 68.099999999999994 113.24 175.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 32.1 t -60.98 -51.14 70.51 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.753 -0.832 . . . . 66.650000000000006 108.753 177.947 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' VAL . . . . . 0.495 HG11 HG13 ' A' ' 108' ' ' VAL . 1.0 OUTLIER -64.5 -36.49 77.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 113.013 0.746 . . . . 68.129999999999995 113.013 -177.912 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 86' ' ' MET . . . . . 0.897 ' HG2' ' O ' ' A' ' 170' ' ' HOH . 26.0 mtm -70.2 -32.6 70.58 Favored 'General case' 0 C--O 1.219 -0.533 0 CA-C-O 121.134 0.492 . . . . 67.549999999999997 109.997 177.362 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -50.0 -54.58 18.08 Favored Glycine 0 C--O 1.241 0.537 0 N-CA-C 110.085 -1.206 . . . . 68.099999999999994 110.085 173.328 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 10.8 tttt -65.75 -51.48 58.8 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.488 0.551 . . . . 68.060000000000002 112.488 179.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' CYS . . . . . . . . . . . . . 82.0 m -91.6 -4.16 55.61 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 117.3 2.333 . . . . 69.579999999999998 117.3 -164.385 -60.149 -71.43 -83.765 101.566 2.034 105.151 -88.826 -172.306 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LEU . . . . . 0.464 HD12 ' HB3' ' A' ' 86' ' ' MET . 77.8 mt -112.47 147.48 37.14 Favored Pre-proline 0 C--N 1.326 -0.45 0 N-CA-C 109.425 -0.583 . . . . 70.5 109.425 175.028 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -72.31 161.21 92.93 Favored 'Cis proline' 0 CA--C 1.528 0.217 0 N-CA-C 116.134 1.552 . . . . 71.439999999999998 116.134 2.267 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 61.3 p -70.88 151.66 44.51 Favored 'General case' 0 C--O 1.244 0.809 0 CA-C-N 115.398 -0.819 . . . . 72.290000000000006 111.024 174.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' SER . . . . . 0.604 ' HB2' ' O ' ' A' ' 160' ' ' HOH . 4.4 p -149.28 152.91 36.72 Favored 'General case' 0 C--O 1.242 0.7 0 CA-C-N 114.027 -1.442 . . . . 73.319999999999993 107.121 175.55 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 159.87 175.0 30.36 Favored Glycine 0 C--O 1.22 -0.779 0 CA-C-N 115.496 -0.775 . . . . 72.109999999999999 111.626 -169.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' SER . . . . . . . . . . . . . 53.1 p -89.37 -14.81 34.76 Favored 'General case' 0 C--O 1.243 0.726 0 C-N-CA 124.628 1.171 . . . . 71.980000000000004 111.981 -174.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -169.21 178.89 4.18 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 105.714 -1.958 . . . . 74.790000000000006 105.714 -177.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -68.1 -36.96 80.63 Favored 'General case' 0 CA--C 1.497 -1.09 0 N-CA-C 112.33 0.493 . . . . 69.420000000000002 112.33 -172.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 71.3 m -64.34 -49.8 70.28 Favored 'General case' 0 C--O 1.24 0.589 0 O-C-N 123.635 0.584 . . . . 69.659999999999997 111.831 175.653 -58.558 -152.208 114.618 105.75 2.009 103.201 -46.124 -64.77 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ASN . . . . . . . . . . . . . 12.1 t-20 -60.35 -33.39 72.35 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 114.575 1.324 . . . . 69.0 114.575 176.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 69.9 mttt -64.99 -40.43 94.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.352 -0.386 . . . . 68.409999999999997 110.497 179.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 41.9 mm -76.13 -38.4 34.52 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.216 0 CA-C-N 116.28 -0.418 . . . . 68.640000000000001 109.938 -178.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 80.2 t80 -48.2 -55.31 10.75 Favored 'General case' 0 CA--C 1.563 1.447 0 C-N-CA 119.476 -0.89 . . . . 67.650000000000006 110.614 166.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 97.0 m-20 -56.78 -36.78 70.24 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 112.641 0.608 . . . . 68.879999999999995 112.641 -178.251 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' LEU . . . . . 0.443 ' O ' HG23 ' A' ' 108' ' ' VAL . 22.0 tp -73.04 -48.83 32.66 Favored 'General case' 0 C--O 1.261 1.667 0 N-CA-C 109.064 -0.717 . . . . 67.150000000000006 109.064 -176.236 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.93 -42.17 71.94 Favored 'General case' 0 C--O 1.257 1.482 0 O-C-N 124.234 0.959 . . . . 66.469999999999999 111.201 178.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 19.4 tptt -67.46 -44.85 77.61 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 114.945 -1.025 . . . . 74.920000000000002 111.67 -177.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' CYS . . . . . . . . . . . . . 38.5 t -60.48 -45.73 92.69 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 114.895 -1.048 . . . . 67.939999999999998 110.587 176.534 -172.306 -88.826 -83.765 105.151 2.034 101.566 -71.43 -60.149 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' VAL . . . . . 0.495 HG13 HG11 ' A' ' 85' ' ' VAL . 60.1 t -66.9 -46.03 86.02 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.652 0 C-N-CA 120.739 -0.384 . . . . 67.879999999999995 110.39 179.429 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -59.01 -40.94 86.49 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 112.961 0.726 . . . . 69.120000000000005 112.961 -178.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.73 -41.7 91.93 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 109.529 -0.545 . . . . 73.180000000000007 109.529 177.635 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 40.7 m -86.09 -45.5 11.34 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 113.204 0.816 . . . . 74.719999999999999 113.204 -171.002 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' ALA . . . . . 0.406 ' HB3' HG21 ' A' ' 85' ' ' VAL . . . -135.43 99.88 11.67 Favored Pre-proline 0 C--O 1.241 0.626 0 C-N-CA 123.215 0.606 . . . . 75.120000000000005 110.361 177.872 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -59.1 -35.89 97.13 Favored 'Trans proline' 0 CA--C 1.537 0.655 1 C-N-CA 126.721 4.947 . . . . 76.280000000000001 115.929 170.591 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -64.95 -23.29 67.18 Favored 'General case' 0 CA--C 1.552 1.045 0 N-CA-C 114.721 1.378 . . . . 80.939999999999998 114.721 175.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 42.9 t -95.66 -38.09 8.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 N-CA-C 117.194 2.294 . . . . 75.25 117.194 -160.184 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' TRP . . . . . 0.404 ' CE3' H131 ' A' ' 120' ' ' NBB . 52.7 t-105 -93.14 88.46 6.08 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 119.562 -0.855 . . . . 74.620000000000005 113.116 -173.487 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 117' ' ' PHE . . . . . 0.403 ' HB3' ' O ' ' A' ' 162' ' ' HOH . 92.3 t80 -102.25 150.78 22.96 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 108.063 -1.088 . . . . 73.099999999999994 108.063 178.948 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 118' ' ' VAL . . . . . 0.525 HG12 HG23 ' A' ' 31' ' ' ILE . 40.5 t -125.69 128.36 72.18 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.979 0 C-N-CA 119.81 -0.756 . . . . 68.689999999999998 111.134 176.41 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ILE . . . . . 0.769 HG21 HG21 ' A' ' 13' ' ' VAL . 96.4 mt . . . . . 0 C--O 1.243 0.713 0 O-C-N 123.505 0.503 . . . . 68.170000000000002 111.604 179.165 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' NBB . . . . . 1.002 ' H6 ' ' HD1' ' A' ' 56' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 155' ' ' HOH . . . . . 0.514 ' O ' ' HD2' ' A' ' 56' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 160' ' ' HOH . . . . . 0.604 ' O ' ' HB2' ' A' ' 93' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 161' ' ' HOH . . . . . 0.404 ' O ' ' OE2' ' A' ' 62' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 162' ' ' HOH . . . . . 0.403 ' O ' ' HB3' ' A' ' 117' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 170' ' ' HOH . . . . . 0.897 ' O ' ' HG2' ' A' ' 86' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 173' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 174' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 . . . . . 0 N--CA 1.485 1.276 0 CA-C-O 121.202 0.525 . . . . 87.150000000000006 110.07 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' TRP . . . . . . . . . . . . . 41.9 p-90 -54.6 -34.71 62.44 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 114.565 -1.198 . . . . 88.25 111.866 165.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 9.1 t -44.74 110.68 1.09 Allowed Pre-proline 0 N--CA 1.473 0.693 0 O-C-N 123.95 0.781 . . . . 85.739999999999995 112.379 -176.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.469 ' HG2' HG23 ' A' ' 9' ' ' VAL . 92.9 Cg_endo -75.85 151.96 36.36 Favored 'Trans proline' 0 N--CA 1.455 -0.748 0 O-C-N 122.391 0.68 . . . . 85.069999999999993 112.513 -176.988 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 29.4 Cg_endo -59.97 -20.51 60.67 Favored 'Trans proline' 0 CA--C 1.535 0.553 0 C-N-CA 123.21 2.606 . . . . 85.420000000000002 115.458 -174.062 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -76.01 -13.35 60.23 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.32 0.388 . . . . 89.109999999999999 111.339 -177.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.469 HG23 ' HG2' ' A' ' 6' ' ' PRO . 39.6 t -76.78 -36.45 26.45 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.627 0 CA-C-N 116.676 -0.238 . . . . 85.099999999999994 110.543 176.194 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.43 ' HA ' HG22 ' A' ' 13' ' ' VAL . 70.6 m-85 -64.73 -35.22 80.35 Favored 'General case' 0 C--N 1.325 -0.475 0 N-CA-C 112.838 0.681 . . . . 83.439999999999998 112.838 -174.535 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . 1.043 0.9 OUTLIER -73.91 -33.53 64.02 Favored 'General case' 0 N--CA 1.468 0.449 0 N-CA-C 119.726 3.232 . . . . 83.099999999999994 119.726 165.105 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.41 -47.02 69.94 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 115.013 -0.994 . . . . 81.180000000000007 110.378 168.212 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.829 HG12 ' CZ ' ' A' ' 56' ' ' PHE . 32.7 m -85.56 -11.09 11.39 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.499 0 N-CA-C 115.727 1.751 . . . . 77.709999999999994 115.727 -178.815 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -50.74 -51.31 51.29 Favored 'General case' 0 C--N 1.321 -0.633 0 N-CA-C 114.578 1.325 . . . . 73.959999999999994 114.578 -163.441 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 16.6 tt0 -67.56 -46.52 72.47 Favored 'General case' 0 CA--C 1.504 -0.807 0 CA-C-O 121.46 0.648 . . . . 72.459999999999994 111.857 -175.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -56.77 -39.77 74.64 Favored 'General case' 0 C--O 1.205 -1.25 0 CA-C-N 115.36 -0.836 . . . . 74.790000000000006 111.684 174.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 37.1 tttt -59.38 -51.18 71.0 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-N 118.434 0.561 . . . . 72.700000000000003 109.749 179.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -59.26 -43.7 92.45 Favored 'General case' 0 C--O 1.218 -0.563 0 O-C-N 124.139 0.899 . . . . 67.5 110.673 -175.787 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 47.4 ttp85 -68.55 -45.7 71.45 Favored 'General case' 0 N--CA 1.475 0.82 0 CA-C-N 115.921 -0.581 . . . . 68.909999999999997 111.526 -178.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 68.0 m -61.9 -42.16 98.75 Favored 'General case' 0 C--N 1.32 -0.708 0 N-CA-C 112.654 0.613 . . . . 69.489999999999995 112.654 177.625 -72.094 -62.979 -81.967 103.504 2.026 103.579 -93.625 -174.148 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 66.6 mtp -66.23 -41.36 90.14 Favored 'General case' 0 N--CA 1.454 -0.235 0 N-CA-C 109.247 -0.649 . . . . 69.730000000000004 109.247 179.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' SER . . . . . . . . . . . . . 8.5 t -62.47 -48.59 78.93 Favored 'General case' 0 N--CA 1.439 -1.005 0 CA-C-N 115.655 -0.702 . . . . 72.329999999999998 112.27 178.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -56.51 -30.86 63.51 Favored 'General case' 0 N--CA 1.469 0.521 0 N-CA-C 114.07 1.137 . . . . 69.219999999999999 114.07 179.176 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 91.3 m-70 -115.89 -5.5 12.03 Favored 'General case' 0 C--O 1.218 -0.556 0 O-C-N 125.163 1.539 . . . . 73.969999999999999 114.114 -162.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 72.05 29.18 67.2 Favored Glycine 0 N--CA 1.418 -2.507 0 CA-C-N 115.366 -0.834 . . . . 68.950000000000003 113.38 -177.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 3.1 m -80.46 137.36 36.47 Favored 'General case' 0 C--O 1.243 0.73 0 C-N-CA 122.818 0.447 . . . . 67.620000000000005 111.439 -174.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' THR . . . . . . . . . . . . . 4.9 p -102.56 154.07 19.47 Favored 'General case' 0 N--CA 1.479 0.992 0 O-C-N 123.601 0.563 . . . . 66.0 110.973 171.052 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' GLN . . . . . . . . . . . . . 63.7 tp60 -56.69 -40.37 75.49 Favored 'General case' 0 C--O 1.254 1.306 0 N-CA-C 112.173 0.434 . . . . 66.930000000000007 112.173 171.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -50.54 -39.87 50.22 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 124.044 0.84 . . . . 65.810000000000002 112.121 176.395 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -70.98 -38.45 72.73 Favored 'General case' 0 CA--C 1.509 -0.632 0 C-N-CA 120.735 -0.386 . . . . 66.409999999999997 111.169 -179.78 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ILE . . . . . 0.525 HG23 HG12 ' A' ' 118' ' ' VAL . 64.5 mt -64.79 -42.14 94.11 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.007 0 N-CA-C 108.459 -0.941 . . . . 67.840000000000003 108.459 178.158 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ASP . . . . . . . . . . . . . 81.3 m-20 -57.38 -42.86 82.96 Favored 'General case' 0 C--O 1.245 0.817 0 CA-C-N 115.841 -0.618 . . . . 70.579999999999998 111.466 177.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -62.6 -41.2 98.83 Favored 'General case' 0 CA--C 1.507 -0.71 0 N-CA-C 113.661 0.986 . . . . 77.739999999999995 113.661 179.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 75.9 t -64.33 -38.6 82.95 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 N-CA-C 106.926 -1.509 . . . . 68.189999999999998 106.926 -178.101 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 91.5 m-20 -68.11 -33.45 74.53 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-N 115.816 -0.629 . . . . 67.939999999999998 112.504 179.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 23.8 pttt -88.56 15.97 7.26 Favored 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 114.386 1.254 . . . . 69.069999999999993 114.386 172.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' GLY . . . . . . . . . . . . . . . 102.96 -17.52 52.27 Favored Glycine 0 C--N 1.338 0.689 0 N-CA-C 115.084 0.794 . . . . 69.790000000000006 115.084 169.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 64.3 m-20 -87.91 105.19 17.27 Favored 'General case' 0 CA--C 1.549 0.934 0 O-C-N 122.089 -0.653 . . . . 71.769999999999996 110.405 -172.116 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LEU . . . . . . . . . . . . . 7.1 tp -122.38 127.46 49.76 Favored 'General case' 0 N--CA 1.481 1.091 0 N-CA-C 113.422 0.897 . . . . 71.370000000000005 113.422 174.143 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 34.9 m -114.43 165.28 9.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.832 0 C-N-CA 123.649 0.78 . . . . 71.670000000000002 110.09 170.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 63.1 t30 -91.25 71.41 6.18 Favored 'General case' 0 N--CA 1.445 -0.705 0 N-CA-C 103.918 -2.623 . . . . 73.069999999999993 103.918 -175.229 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 45.9 mm-40 -115.15 124.68 29.88 Favored Pre-proline 0 N--CA 1.447 -0.577 0 N-CA-C 106.788 -1.56 . . . . 72.090000000000003 106.788 174.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_exo -55.38 -35.4 91.72 Favored 'Trans proline' 0 C--N 1.368 1.582 0 C-N-CA 123.381 2.721 . . . . 69.870000000000005 114.436 -179.446 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 26.5 p -55.93 -29.33 59.95 Favored 'General case' 0 C--O 1.214 -0.789 0 C-N-CA 119.791 -0.764 . . . . 68.510000000000005 112.59 177.143 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 7.1 tp -102.52 -40.46 7.02 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.419 0 CA-C-N 118.878 0.763 . . . . 66.870000000000005 112.724 177.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 76.7 p -68.61 -37.65 79.95 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 112.487 0.551 . . . . 66.840000000000003 112.487 -178.219 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' CYS . . . . . . . . . . . . . 89.5 m -75.86 -29.3 58.51 Favored 'General case' 0 CA--C 1.509 -0.63 0 N-CA-C 108.975 -0.75 . . . . 68.219999999999999 108.975 178.255 -64.77 -46.124 114.618 103.201 2.009 105.75 -152.208 -58.558 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' TYR . . . . . . . . . . . . . 90.5 t80 -58.47 -47.89 82.55 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 112.675 0.62 . . . . 69.299999999999997 112.675 169.494 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 75.3 mtm -65.52 -42.75 91.66 Favored 'General case' 0 CA--C 1.557 1.232 0 O-C-N 121.078 -1.014 . . . . 68.780000000000001 111.599 179.774 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' TYR . . . . . . . . . . . . . 89.8 t80 -57.27 -47.9 80.24 Favored 'General case' 0 C--O 1.254 1.294 0 O-C-N 121.552 -0.718 . . . . 71.459999999999994 110.281 174.219 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 49.0 t -52.79 -48.91 66.53 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-O 121.554 0.692 . . . . 69.760000000000005 112.588 179.34 -174.148 -93.625 -81.967 103.579 2.026 103.504 -62.979 -72.094 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 12.1 tp -69.99 -42.64 72.82 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.203 -0.908 . . . . 68.209999999999994 112.906 -176.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 25.8 mt -56.17 -46.6 79.27 Favored 'General case' 0 CA--C 1.549 0.942 0 CA-C-O 121.461 0.648 . . . . 66.769999999999996 112.228 171.259 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 11.5 tm-20 -58.62 -47.75 83.33 Favored 'General case' 0 C--O 1.22 -0.468 0 CA-C-N 115.5 -0.773 . . . . 72.010000000000005 110.598 176.047 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.11 -26.8 40.61 Favored 'General case' 0 CA--C 1.538 0.518 0 N-CA-C 112.628 0.603 . . . . 66.650000000000006 112.628 -175.524 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' PHE . . . . . 1.002 ' HD1' ' H6 ' ' A' ' 120' ' ' NBB . 16.7 m-85 -111.57 22.08 15.44 Favored 'General case' 0 CA--C 1.493 -1.217 0 N-CA-C 109.726 -0.472 . . . . 67.989999999999995 109.726 -176.505 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 2.3 m 53.48 36.28 22.8 Favored 'General case' 0 C--O 1.219 -0.53 0 N-CA-C 114.153 1.168 . . . . 68.219999999999999 114.153 175.179 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' LEU . . . . . . . . . . . . . 42.4 mt -90.4 -20.8 22.39 Favored 'General case' 0 N--CA 1.467 0.402 0 CA-C-N 115.904 -0.589 . . . . 66.370000000000005 111.371 -179.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 21.5 m -139.29 157.98 28.26 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 115.241 -0.89 . . . . 67.030000000000001 111.475 176.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 45.4 p30 -93.36 -169.58 2.17 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 115.37 -0.832 . . . . 66.700000000000003 111.193 178.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 10.9 p-10 -70.94 -17.3 62.68 Favored 'General case' 0 C--N 1.384 2.086 0 O-C-N 126.081 2.113 . . . . 69.790000000000006 111.217 -173.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.404 ' OE2' ' O ' ' A' ' 161' ' ' HOH . 80.1 mt-10 -110.43 23.35 14.37 Favored 'General case' 0 CA--C 1.553 1.088 0 N-CA-C 114.878 1.436 . . . . 71.480000000000004 114.878 170.013 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . 59.59 34.0 22.2 Favored 'General case' 0 CA--C 1.495 -1.17 0 N-CA-C 112.104 0.409 . . . . 67.75 112.104 176.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 60.9 m-80 -82.69 131.36 35.21 Favored 'General case' 0 N--CA 1.437 -1.116 0 N-CA-C 107.863 -1.162 . . . . 68.719999999999999 107.863 164.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 5.0 t -82.38 126.09 39.94 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.491 0 CA-C-N 114.82 -1.082 . . . . 68.579999999999998 111.149 -173.283 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ASP . . . . . . . . . . . . . 40.5 t0 -82.18 93.06 6.99 Favored 'General case' 0 CA--C 1.543 0.675 0 CA-C-O 122.125 0.964 . . . . 74.099999999999994 108.747 169.114 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLU . . . . . 0.428 ' HG3' ' SD ' ' A' ' 86' ' ' MET . 38.1 tt0 -66.57 -29.37 69.42 Favored 'General case' 0 C--N 1.319 -0.743 0 CA-C-N 114.284 -1.325 . . . . 77.519999999999996 112.894 -169.249 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 63.2 m-20 -66.45 -52.1 49.92 Favored 'General case' 0 C--O 1.246 0.9 0 O-C-N 123.367 0.417 . . . . 73.920000000000002 111.427 176.151 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ILE . . . . . . . . . . . . . 96.9 mt -58.17 -46.95 88.39 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.433 0 N-CA-C 109.813 -0.44 . . . . 73.75 109.813 174.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' MET . . . . . 0.554 ' HE2' ' O ' ' A' ' 170' ' ' HOH . 6.2 ttt -55.25 -49.21 72.62 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.304 -0.407 . . . . 71.200000000000003 111.27 178.771 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 52.1 mt -63.55 -37.46 87.41 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 112.995 0.739 . . . . 71.219999999999999 112.995 178.386 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . -71.34 -9.75 68.66 Favored Glycine 0 N--CA 1.47 0.945 0 N-CA-C 115.831 1.093 . . . . 69.629999999999995 115.831 -179.078 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' LEU . . . . . . . . . . . . . 6.5 mp -100.45 7.2 44.34 Favored 'General case' 0 CA--C 1.54 0.559 0 CA-C-N 117.498 0.649 . . . . 69.650000000000006 111.525 176.902 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 44.8 mt -111.38 155.98 41.95 Favored Pre-proline 0 C--N 1.331 -0.223 0 CA-C-O 119.235 -0.412 . . . . 68.269999999999996 110.59 -178.243 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_exo -69.24 140.37 44.47 Favored 'Trans proline' 0 C--N 1.354 0.858 0 O-C-N 123.022 1.011 . . . . 68.280000000000001 110.409 173.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ASP . . . . . . . . . . . . . 17.2 p-10 -56.21 -25.24 46.52 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 121.799 0.809 . . . . 69.799999999999997 112.453 -175.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' GLN . . . . . . . . . . . . . 40.0 tt0 -49.25 -57.0 7.54 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 114.226 -1.352 . . . . 68.959999999999994 111.163 168.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.19 -29.66 57.73 Favored 'General case' 0 N--CA 1.469 0.494 0 N-CA-C 114.939 1.459 . . . . 69.900000000000006 114.939 179.43 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' GLN . . . . . . . . . . . . . 53.9 mt-30 -46.96 -41.43 16.15 Favored 'General case' 0 C--O 1.246 0.886 0 N-CA-C 113.352 0.871 . . . . 73.810000000000002 113.352 -168.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 3.6 tt0 -56.82 -57.07 14.07 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.328 1.051 . . . . 67.370000000000005 110.813 174.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ARG . . . . . . . . . . . . . 44.1 ttt180 -67.48 -31.02 70.88 Favored 'General case' 0 C--N 1.326 -0.427 0 CA-C-N 115.662 -0.699 . . . . 67.129999999999995 111.44 -176.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -67.76 -52.94 31.49 Favored 'General case' 0 N--CA 1.463 0.214 0 O-C-N 123.539 0.525 . . . . 66.239999999999995 110.207 176.146 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLN . . . . . . . . . . . . . 3.4 mt-30 -50.17 -40.16 45.89 Favored 'General case' 0 CA--C 1.515 -0.381 0 N-CA-C 113.24 0.83 . . . . 68.099999999999994 113.24 175.202 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' SER . . . . . . . . . . . . . 32.1 t -60.98 -51.14 70.51 Favored 'General case' 0 C--N 1.324 -0.507 0 N-CA-C 108.753 -0.832 . . . . 66.650000000000006 108.753 177.947 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' VAL . . . . . 0.495 HG11 HG13 ' A' ' 108' ' ' VAL . 1.0 OUTLIER -64.5 -36.49 77.48 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 N-CA-C 113.013 0.746 . . . . 68.129999999999995 113.013 -177.912 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' MET . . . . . 0.897 ' HG2' ' O ' ' A' ' 170' ' ' HOH . 26.0 mtm -70.2 -32.6 70.58 Favored 'General case' 0 C--O 1.219 -0.533 0 CA-C-O 121.134 0.492 . . . . 67.549999999999997 109.997 177.362 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -50.0 -54.58 18.08 Favored Glycine 0 C--O 1.241 0.537 0 N-CA-C 110.085 -1.206 . . . . 68.099999999999994 110.085 173.328 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' LYS . . . . . . . . . . . . . 10.8 tttt -65.75 -51.48 58.8 Favored 'General case' 0 C--N 1.331 -0.222 0 N-CA-C 112.488 0.551 . . . . 68.060000000000002 112.488 179.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' CYS . . . . . . . . . . . . . 82.0 m -91.6 -4.16 55.61 Favored 'General case' 0 N--CA 1.482 1.161 0 N-CA-C 117.3 2.333 . . . . 69.579999999999998 117.3 -164.385 -60.149 -71.43 -83.765 101.566 2.034 105.151 -88.826 -172.306 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.464 HD12 ' HB3' ' A' ' 86' ' ' MET . 77.8 mt -112.47 147.48 37.14 Favored Pre-proline 0 C--N 1.326 -0.45 0 N-CA-C 109.425 -0.583 . . . . 70.5 109.425 175.028 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_endo -72.31 161.21 92.93 Favored 'Cis proline' 0 CA--C 1.528 0.217 0 N-CA-C 116.134 1.552 . . . . 71.439999999999998 116.134 2.267 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' THR . . . . . . . . . . . . . 61.3 p -70.88 151.66 44.51 Favored 'General case' 0 C--O 1.244 0.809 0 CA-C-N 115.398 -0.819 . . . . 72.290000000000006 111.024 174.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' SER . . . . . 0.604 ' HB2' ' O ' ' A' ' 160' ' ' HOH . 4.4 p -149.28 152.91 36.72 Favored 'General case' 0 C--O 1.242 0.7 0 CA-C-N 114.027 -1.442 . . . . 73.319999999999993 107.121 175.55 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 159.87 175.0 30.36 Favored Glycine 0 C--O 1.22 -0.779 0 CA-C-N 115.496 -0.775 . . . . 72.109999999999999 111.626 -169.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' SER . . . . . 0.612 ' H ' HD22 ' A' ' 99' ' ' ASN . 53.1 p -89.37 -14.81 34.76 Favored 'General case' 0 C--O 1.243 0.726 0 C-N-CA 124.628 1.171 . . . . 71.980000000000004 111.981 -174.306 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 2.4 p30 -169.21 178.89 4.18 Favored 'General case' 0 C--N 1.322 -0.626 0 N-CA-C 105.714 -1.958 . . . . 74.790000000000006 105.714 -177.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 86.7 m-20 -68.1 -36.96 80.63 Favored 'General case' 0 CA--C 1.497 -1.09 0 N-CA-C 112.33 0.493 . . . . 69.420000000000002 112.33 -172.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' CYS . . . . . . . . . . . . . 71.3 m -64.34 -49.8 70.28 Favored 'General case' 0 C--O 1.24 0.589 0 O-C-N 123.635 0.584 . . . . 69.659999999999997 111.831 175.653 -58.558 -152.208 114.618 105.75 2.009 103.201 -46.124 -64.77 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ASN . . . . . 0.612 HD22 ' H ' ' A' ' 95' ' ' SER . 51.8 t30 -60.35 -33.39 72.35 Favored 'General case' 0 C--N 1.324 -0.508 0 N-CA-C 114.575 1.324 . . . . 69.0 114.575 176.857 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 69.9 mttt -64.99 -40.43 94.95 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.352 -0.386 . . . . 68.409999999999997 110.497 179.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 41.9 mm -76.13 -38.4 34.52 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.216 0 CA-C-N 116.28 -0.418 . . . . 68.640000000000001 109.938 -178.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' TYR . . . . . . . . . . . . . 80.2 t80 -48.2 -55.31 10.75 Favored 'General case' 0 CA--C 1.563 1.447 0 C-N-CA 119.476 -0.89 . . . . 67.650000000000006 110.614 166.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -56.78 -36.78 70.24 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 112.641 0.608 . . . . 68.879999999999995 112.641 -178.251 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.443 ' O ' HG23 ' A' ' 108' ' ' VAL . 22.0 tp -73.04 -48.83 32.66 Favored 'General case' 0 C--O 1.261 1.667 0 N-CA-C 109.064 -0.717 . . . . 67.150000000000006 109.064 -176.236 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -54.93 -42.17 71.94 Favored 'General case' 0 C--O 1.257 1.482 0 O-C-N 124.234 0.959 . . . . 66.469999999999999 111.201 178.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' LYS . . . . . . . . . . . . . 19.4 tptt -67.46 -44.85 77.61 Favored 'General case' 0 CA--C 1.547 0.836 0 CA-C-N 114.945 -1.025 . . . . 74.920000000000002 111.67 -177.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' CYS . . . . . . . . . . . . . 38.5 t -60.48 -45.73 92.69 Favored 'General case' 0 N--CA 1.441 -0.91 0 CA-C-N 114.895 -1.048 . . . . 67.939999999999998 110.587 176.534 -172.306 -88.826 -83.765 105.151 2.034 101.566 -71.43 -60.149 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' VAL . . . . . 0.495 HG13 HG11 ' A' ' 85' ' ' VAL . 60.1 t -66.9 -46.03 86.02 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.652 0 C-N-CA 120.739 -0.384 . . . . 67.879999999999995 110.39 179.429 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -59.01 -40.94 86.49 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 112.961 0.726 . . . . 69.120000000000005 112.961 -178.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -65.73 -41.7 91.93 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 109.529 -0.545 . . . . 73.180000000000007 109.529 177.635 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' SER . . . . . . . . . . . . . 40.7 m -86.09 -45.5 11.34 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 113.204 0.816 . . . . 74.719999999999999 113.204 -171.002 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' ALA . . . . . 0.406 ' HB3' HG21 ' A' ' 85' ' ' VAL . . . -135.43 99.88 11.67 Favored Pre-proline 0 C--O 1.241 0.626 0 C-N-CA 123.215 0.606 . . . . 75.120000000000005 110.361 177.872 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_exo -59.1 -35.89 97.13 Favored 'Trans proline' 0 CA--C 1.537 0.655 1 C-N-CA 126.721 4.947 . . . . 76.280000000000001 115.929 170.591 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -64.95 -23.29 67.18 Favored 'General case' 0 CA--C 1.552 1.045 0 N-CA-C 114.721 1.378 . . . . 80.939999999999998 114.721 175.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . . 42.9 t -95.66 -38.09 8.22 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.923 0 N-CA-C 117.194 2.294 . . . . 75.25 117.194 -160.184 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' TRP . . . . . 0.404 ' CE3' H131 ' A' ' 120' ' ' NBB . 52.7 t-105 -93.14 88.46 6.08 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 119.562 -0.855 . . . . 74.620000000000005 113.116 -173.487 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' PHE . . . . . 0.403 ' HB3' ' O ' ' A' ' 162' ' ' HOH . 92.3 t80 -102.25 150.78 22.96 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 108.063 -1.088 . . . . 73.099999999999994 108.063 178.948 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' VAL . . . . . 0.525 HG12 HG23 ' A' ' 31' ' ' ILE . 40.5 t -125.69 128.36 72.18 Favored 'Isoleucine or valine' 0 N--CA 1.439 -0.979 0 C-N-CA 119.81 -0.756 . . . . 68.689999999999998 111.134 176.41 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.769 HG21 HG21 ' A' ' 13' ' ' VAL . 96.4 mt . . . . . 0 C--O 1.243 0.713 0 O-C-N 123.505 0.503 . . . . 68.170000000000002 111.604 179.165 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' NBB . . . . . 1.002 ' H6 ' ' HD1' ' A' ' 56' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' HOH . . . . . 0.514 ' O ' ' HD2' ' A' ' 56' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' HOH . . . . . 0.604 ' O ' ' HB2' ' A' ' 93' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' HOH . . . . . 0.404 ' O ' ' OE2' ' A' ' 62' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' HOH . . . . . 0.403 ' O ' ' HB3' ' A' ' 117' ' ' PHE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' HOH . . . . . 0.897 ' O ' ' HG2' ' A' ' 86' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_