data_1nxp_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 1nxp _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 2' ' ' LYS . . . . . 0.672 ' N ' ' O ' ' A' ' 188' ' ' HOH . 17.3 mmtt . . . . . 0 N--CA 1.5 2.065 0 N-CA-C 105.919 -1.882 . . . . 40.09 105.919 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -114.18 129.8 56.62 Favored 'General case' 0 CA--C 1.498 -1.051 0 O-C-N 123.179 0.3 . . . . 24.85 110.395 -174.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 27.3 mt -115.72 132.35 65.4 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.642 0 N-CA-C 109.323 -0.621 . . . . 31.54 109.323 -179.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 21.8 tp -101.86 122.81 44.69 Favored 'General case' 0 C--O 1.195 -1.786 0 N-CA-C 106.632 -1.618 . . . . 19.74 106.632 172.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 71.7 mt -105.97 115.12 47.0 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 O-C-N 126.35 2.281 . . . . 26.56 106.547 179.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 59.1 t -108.01 107.64 23.31 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.371 0 N-CA-C 106.256 -1.757 . . . . 21.72 106.256 -179.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -152.54 129.61 11.11 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 108.996 -0.742 . . . . 34.51 108.996 -176.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 17.2 p-10 -86.16 -7.12 58.8 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 114.426 1.269 . . . . 44.22 114.426 -178.317 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -99.22 119.46 37.92 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 108.132 -1.062 . . . . 49.85 108.132 171.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 13.6 tptt -62.97 -40.93 67.46 Favored Pre-proline 0 CA--C 1.552 1.029 0 N-CA-C 114.016 1.117 . . . . 44.77 114.016 179.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -57.33 -43.85 48.39 Favored 'Trans proline' 0 C--N 1.321 -0.917 0 C-N-CA 122.149 1.899 . . . . 35.89 115.911 175.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 6.6 mm -71.05 -42.61 76.51 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.396 0 O-C-N 124.27 0.981 . . . . 36.54 112.543 175.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 47.1 t -53.7 -43.77 69.23 Favored 'General case' 0 C--N 1.349 0.566 0 N-CA-C 109.487 -0.56 . . . . 28.34 109.487 175.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 87.9 m-20 -66.08 -38.35 88.06 Favored 'General case' 0 C--O 1.21 -0.996 0 O-C-N 123.482 0.489 . . . . 35.82 110.975 -174.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 15.3 mt -65.8 -43.78 93.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 117.699 0.227 . . . . 32.79 111.281 176.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 81.2 mt -69.4 -41.63 80.83 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.285 0 N-CA-C 108.661 -0.866 . . . . 24.99 108.661 -177.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -58.74 -47.12 85.73 Favored 'General case' 0 C--O 1.216 -0.682 0 N-CA-C 108.679 -0.859 . . . . 36.88 108.679 -179.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -57.38 -50.76 71.95 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 116.084 -0.507 . . . . 30.39 111.326 179.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -65.29 -43.94 89.56 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 113.512 0.93 . . . . 33.48 113.512 179.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 16.7 mmt -63.92 -37.84 88.88 Favored 'General case' 0 CA--C 1.553 1.079 0 N-CA-C 114.017 1.118 . . . . 33.49 114.017 175.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 23.7 m -61.55 -44.01 97.81 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 122.226 1.012 . . . . 24.95 110.996 176.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.2 mttm -60.69 -29.57 69.4 Favored 'General case' 0 C--O 1.215 -0.731 0 CA-C-N 114.413 -1.267 . . . . 36.49 112.087 -179.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -81.12 -8.27 59.73 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 116.91 2.189 . . . . 48.16 116.91 171.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 98.67 10.86 49.07 Favored Glycine 0 C--O 1.243 0.66 0 N-CA-C 116.728 1.451 . . . . 28.08 116.728 175.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -79.84 147.99 31.53 Favored 'General case' 0 C--O 1.21 -0.981 0 N-CA-C 110.023 -0.362 . . . . 29.69 110.023 172.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 87.5 tt0 -81.93 130.48 35.09 Favored 'General case' 0 N--CA 1.44 -0.928 0 O-C-N 123.626 0.579 . . . . 30.79 109.743 162.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 88.9 t -111.42 128.74 67.73 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.576 0 C-N-CA 123.261 0.624 . . . . 23.39 111.694 -176.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.8 m -114.87 147.01 18.58 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.767 0 N-CA-C 106.733 -1.58 . . . . 26.2 106.733 163.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 20.2 p -123.32 151.43 42.45 Favored 'General case' 0 N--CA 1.438 -1.042 0 CA-C-O 121.313 0.578 . . . . 26.75 110.215 -175.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -139.59 146.03 39.31 Favored 'General case' 0 CA--C 1.486 -1.51 0 N-CA-C 106.193 -1.78 . . . . 22.7 106.193 173.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -116.82 1.8 12.77 Favored 'General case' 0 C--O 1.256 1.421 0 N-CA-C 116.614 2.079 . . . . 32.33 116.614 -176.146 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 26.8 p30 -153.92 179.0 9.3 Favored 'General case' 0 C--O 1.246 0.92 0 N-CA-C 108.279 -1.008 . . . . 25.81 108.279 170.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -71.9 -32.75 63.35 Favored Glycine 0 CA--C 1.5 -0.884 0 N-CA-C 110.103 -1.199 . . . . 22.77 110.103 -171.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 33.5 ttp180 -64.71 -52.57 56.45 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 119.182 -1.007 . . . . 32.1 112.043 175.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 77.7 mt-10 -58.3 -35.7 72.23 Favored 'General case' 0 C--O 1.192 -1.956 0 C-N-CA 120.324 -0.55 . . . . 32.75 110.293 176.38 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.44 -48.8 79.54 Favored 'General case' 0 CA--C 1.492 -1.255 0 CA-C-N 119.59 1.086 . . . . 20.09 112.885 178.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 61.0 mt -66.98 -38.27 85.75 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-O 121.336 0.588 . . . . 26.15 112.249 178.751 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -61.7 -45.2 95.0 Favored 'General case' 0 C--O 1.196 -1.721 0 CA-C-N 116.049 -0.523 . . . . 23.44 111.148 178.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -71.12 -39.84 71.79 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.726 0.774 . . . . 33.54 109.532 -177.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -56.42 -47.8 78.29 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 115.637 -0.711 . . . . 29.02 110.284 175.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -68.02 -42.59 80.4 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.285 0.564 . . . . 25.71 112.478 -177.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -81.01 -36.94 29.96 Favored 'General case' 0 C--O 1.207 -1.136 0 N-CA-C 112.818 0.673 . . . . 22.95 112.818 -171.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 -99.38 -18.71 17.37 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 116.397 1.999 . . . . 33.1 116.397 -174.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 48.46 58.47 17.71 Favored Pre-proline 0 C--O 1.231 0.11 0 CA-C-O 121.633 0.73 . . . . 44.04 111.528 178.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -64.18 154.32 71.48 Favored 'Trans proline' 0 C--N 1.309 -1.52 0 C-N-CA 121.174 1.249 . . . . 22.23 110.786 178.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.9 m-20 -79.7 -24.75 41.49 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 113.16 -1.836 . . . . 23.57 111.973 178.125 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 13.7 tt -154.99 150.95 11.24 Favored 'Isoleucine or valine' 0 C--O 1.254 1.335 0 CA-C-O 122.688 1.233 . . . . 25.26 109.223 176.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 80.5 mt -122.59 128.08 75.21 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.927 0 CA-C-O 118.039 -0.981 . . . . 21.5 110.058 177.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 97.0 mt -99.57 120.67 49.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 N-CA-C 104.675 -2.343 . . . . 24.69 104.675 169.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 64.7 tp -123.34 114.24 19.93 Favored 'General case' 0 CA--C 1.499 -1.019 0 CA-C-O 121.581 0.705 . . . . 27.36 110.026 -169.445 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ASP . . . . . 0.886 ' OD1' ' C ' ' A' ' 52' ' ' ASP . 0.3 OUTLIER -81.72 145.29 30.58 Favored 'General case' 0 C--N 1.306 -1.306 0 C-N-CA 112.662 -3.615 . . . . 49.23 110.3 168.832 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 6.8 mp -67.1 -25.86 66.42 Favored 'General case' 0 CA--C 1.567 1.621 0 N-CA-C 114.424 1.268 . . . . 51.74 114.424 -179.326 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 3.4 mmm -100.33 81.9 2.43 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 114.035 1.124 . . . . 66.79 114.035 -162.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' LEU . . . . . 0.782 ' C ' ' CD2' ' A' ' 55' ' ' LEU . 0.7 OUTLIER -144.86 118.48 5.58 Favored Pre-proline 0 CA--C 1.549 0.916 1 C-N-CA 109.174 -5.01 . . . . 67.96 114.201 134.501 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' PRO . . . . . . . . . . . . . 3.1 Cg_exo 19.4 166.03 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.603 2 O-C-N 138.424 9.118 . . . . 67.51 120.717 -116.194 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLU . . . . . 0.539 ' O ' ' CB ' ' A' ' 58' ' ' ILE . 88.8 tt0 -77.07 98.44 5.01 Favored 'General case' 0 C--O 1.245 0.82 0 CA-C-N 112.584 -2.098 . . . . 63.38 111.664 -163.227 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ILE . . . . . 0.539 ' CB ' ' O ' ' A' ' 57' ' ' GLU . 8.2 tt 133.7 -21.58 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 N-CA-C 113.286 0.847 . . . . 54.11 113.286 -170.318 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ASP . . . . . 0.614 ' CB ' ' O ' ' A' ' 186' ' ' HOH . 32.5 t0 -74.82 -38.22 62.11 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 113.666 0.987 . . . . 41.73 113.666 -174.94 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -58.95 -44.19 96.31 Favored Glycine 0 C--O 1.224 -0.506 0 C-N-CA 121.203 -0.522 . . . . 33.83 112.096 171.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 94.7 mt -62.52 -42.44 99.52 Favored 'General case' 0 CA--C 1.506 -0.733 0 O-C-N 122.239 -0.565 . . . . 31.27 110.196 179.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLU . . . . . 0.471 ' OE1' ' NZ ' ' A' ' 65' ' ' LYS . 26.1 tp10 -64.24 -40.88 96.92 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 114.106 1.15 . . . . 48.74 114.106 175.131 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' VAL . . . . . . . . . . . . . 42.8 t -58.34 -48.9 83.75 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.815 0 C-N-CA 118.732 -1.187 . . . . 27.09 110.088 176.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.5 -47.71 84.4 Favored 'General case' 0 C--O 1.21 -1.02 0 N-CA-C 109.672 -0.492 . . . . 25.77 109.672 -178.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' LYS . . . . . 0.471 ' NZ ' ' OE1' ' A' ' 62' ' ' GLU . 19.5 ttpp -51.26 -47.08 62.56 Favored 'General case' 0 C--O 1.244 0.814 0 N-CA-C 113.209 0.818 . . . . 46.08 113.209 173.199 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' THR . . . . . 0.443 ' CG2' ' O ' ' A' ' 62' ' ' GLU 0.385 0.3 OUTLIER -77.31 -35.44 54.89 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 116.487 -2.085 . . . . 33.24 112.898 -176.21 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 53.3 mt -55.02 -44.19 72.97 Favored 'Isoleucine or valine' 0 C--O 1.189 -2.12 0 CA-C-N 118.517 0.599 . . . . 30.27 111.899 171.236 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 61.6 mmt-85 -65.07 -16.21 63.21 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 115.056 1.502 . . . . 34.12 115.056 -178.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 16.9 mttm -58.71 -38.52 78.48 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 118.383 0.538 . . . . 47.13 111.287 169.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 22.3 p -114.74 -20.65 10.55 Favored 'General case' 0 C--O 1.209 -1.029 0 N-CA-C 116.599 2.074 . . . . 38.07 116.599 -172.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 29.1 t -141.94 145.85 35.0 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 121.415 -0.803 . . . . 30.45 111.517 -165.688 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 90.2 p -96.41 13.27 28.38 Favored 'General case' 0 CA--C 1.563 1.47 0 C-N-CA 125.125 1.37 . . . . 28.65 112.127 173.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 11.3 p -50.23 130.82 24.37 Favored Pre-proline 0 C--O 1.195 -1.797 0 O-C-N 121.152 -0.968 . . . . 25.38 109.91 178.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -57.27 135.6 71.25 Favored 'Trans proline' 0 C--O 1.243 0.769 0 C-N-CA 121.164 1.242 . . . . 23.87 113.511 177.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 67.9 mt -123.26 125.99 72.71 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.005 0 O-C-N 123.904 0.752 . . . . 21.77 110.596 175.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.7 tt -110.46 117.67 34.19 Favored 'General case' 0 CA--C 1.481 -1.7 0 N-CA-C 103.794 -2.669 . . . . 25.54 103.794 175.56 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 40.7 mtt -93.55 141.12 28.83 Favored 'General case' 0 N--CA 1.435 -1.201 0 N-CA-C 107.591 -1.263 . . . . 36.87 107.591 178.316 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.5 mt -125.18 134.91 52.21 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 126.742 2.017 . . . . 30.59 107.26 -178.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 15.8 t -166.72 141.01 4.04 Favored 'General case' 0 N--CA 1.432 -1.342 0 O-C-N 120.396 -1.44 . . . . 29.66 110.141 -175.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.31 -25.95 68.15 Favored 'General case' 0 C--O 1.247 0.922 0 N-CA-C 114.312 1.227 . . . . 29.67 114.312 164.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 24.3 mttm -72.28 126.73 30.53 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 120.995 -1.065 . . . . 46.08 109.005 177.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 47.4 p-10 -131.0 11.88 5.13 Favored 'General case' 0 CA--C 1.493 -1.246 0 CA-C-N 114.424 -1.262 . . . . 30.91 113.774 -166.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.3 p -75.55 165.22 25.42 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 123.93 0.769 . . . . 30.8 111.172 176.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -62.99 -46.27 88.49 Favored 'General case' 0 CA--C 1.502 -0.891 0 C-N-CA 124.453 1.101 . . . . 39.32 109.115 -178.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -53.5 -44.18 68.85 Favored 'General case' 0 C--O 1.208 -1.117 0 CA-C-N 115.517 -0.765 . . . . 39.85 110.731 178.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -68.51 -48.24 64.9 Favored 'General case' 0 CA--C 1.49 -1.329 0 N-CA-C 109.361 -0.607 . . . . 28.58 109.361 -171.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' LYS . . . . . 0.578 ' NZ ' ' O ' ' A' ' 170' ' ' HOH . 75.2 mttt -63.86 -47.96 78.62 Favored 'General case' 0 N--CA 1.489 1.518 0 CA-C-N 115.786 -0.643 . . . . 33.02 110.139 179.204 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 78.2 t -61.32 -45.52 98.44 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 CA-C-N 116.427 -0.351 . . . . 22.21 110.906 -179.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 2.0 tt -69.54 -38.13 76.11 Favored 'Isoleucine or valine' 0 C--O 1.19 -2.026 0 C-N-CA 118.182 -1.407 . . . . 36.11 112.285 -178.28 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -57.01 -46.37 91.48 Favored Glycine 0 C--O 1.224 -0.51 0 N-CA-C 111.374 -0.69 . . . . 24.78 111.374 175.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 35.3 mt -68.09 -42.09 80.88 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 113.116 0.784 . . . . 25.03 113.116 -179.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -63.26 -38.5 91.41 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 123.506 0.504 . . . . 32.41 111.861 178.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.6 -3.96 34.25 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 116.03 1.863 . . . . 40.29 116.03 173.873 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 129.96 -6.45 6.1 Favored Glycine 0 CA--C 1.492 -1.381 0 N-CA-C 116.886 1.514 . . . . 30.99 116.886 163.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.06 144.0 57.28 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 118.901 -1.12 . . . . 26.54 109.999 174.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -88.11 -20.7 25.32 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 114.595 -1.184 . . . . 27.92 112.857 176.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -158.23 162.02 37.81 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 106.437 -1.69 . . . . 22.57 106.437 -179.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -147.97 122.61 9.84 Favored 'General case' 0 N--CA 1.425 -1.694 0 N-CA-C 105.872 -1.899 . . . . 30.4 105.872 -177.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 65.2 t -126.27 137.55 57.42 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.1 0 N-CA-C 105.665 -1.976 . . . . 21.76 105.665 -171.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 46.4 p -92.33 151.65 20.18 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 113.469 0.915 . . . . 26.37 113.469 -177.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt -102.11 137.16 19.4 Favored Pre-proline 0 CA--C 1.5 -0.948 0 N-CA-C 106.115 -1.809 . . . . 40.67 106.115 177.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -80.24 149.45 79.53 Favored 'Cis proline' 0 C--N 1.348 0.539 0 O-C-N 124.166 1.614 . . . . 30.0 110.466 5.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 43.9 p90 -118.27 163.83 16.11 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 122.434 1.112 . . . . 32.78 108.244 -173.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -88.27 132.05 34.54 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 105.59 -2.004 . . . . 25.35 105.59 173.881 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -64.24 -39.98 95.08 Favored 'General case' 0 C--O 1.207 -1.154 0 N-CA-C 108.765 -0.828 . . . . 35.23 108.765 -179.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 61.3 mtt85 -65.42 -39.37 92.06 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 120.688 -0.405 . . . . 47.84 112.069 179.186 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 75.8 tt0 -66.77 -41.13 88.24 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 119.214 -0.994 . . . . 22.26 109.914 179.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.9 -44.79 91.28 Favored 'General case' 0 C--O 1.243 0.717 0 CA-C-O 122.322 1.058 . . . . 26.32 110.173 178.166 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' GLN . . . . . 0.412 ' CG ' ' O ' ' A' ' 168' ' ' HOH . 16.1 mt-30 -60.71 -43.97 97.16 Favored 'General case' 0 C--O 1.204 -1.32 0 C-N-CA 118.348 -1.341 . . . . 44.78 110.238 178.977 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -62.1 -41.19 97.96 Favored 'General case' 0 C--O 1.213 -0.846 0 C-N-CA 123.192 0.597 . . . . 21.09 109.394 -178.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 93.5 mtt-85 -69.82 -37.39 76.21 Favored 'General case' 0 N--CA 1.479 0.992 0 N-CA-C 113.373 0.879 . . . . 20.72 113.373 179.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 48.0 t -62.78 -45.54 98.59 Favored 'Isoleucine or valine' 0 C--O 1.248 1.012 0 O-C-N 121.564 -0.71 . . . . 21.69 109.659 174.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -58.18 -43.83 87.69 Favored 'General case' 0 C--O 1.21 -0.977 0 CA-C-O 122.464 1.126 . . . . 21.32 110.948 176.85 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.29 -41.76 89.31 Favored 'General case' 0 N--CA 1.477 0.896 0 O-C-N 121.046 -1.034 . . . . 24.88 109.903 -175.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 13.2 mt -62.11 -44.79 95.88 Favored 'General case' 0 C--O 1.258 1.544 0 N-CA-C 112.419 0.526 . . . . 32.66 112.419 176.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 67.4 mt -66.91 -36.96 83.44 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 121.027 -0.269 . . . . 28.17 111.615 -178.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 3.9 ttp180 -58.11 -34.91 70.73 Favored 'General case' 0 N--CA 1.483 1.196 0 CA-C-O 121.211 0.529 . . . . 45.74 112.394 177.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 9.4 tpp180 -100.79 19.51 17.01 Favored 'General case' 1 C--O 3.624 126.036 1 CA-C-O 47.337 -34.649 . . . . 43.16 113.612 -168.902 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 1.1 t . . . . . 0 N--CA 1.461 0.117 1 O-C-N 75.722 -29.361 . . . . 49.77 113.51 -168.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' PHS . . . . . 0.562 ' O1P' ' CB ' ' A' ' 55' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.404 ' O ' ' CD2' ' A' ' 55' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 0 . 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 0 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' HOH . . . . . 0.405 ' O ' ' CA ' ' A' ' 55' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.412 ' O ' ' CG ' ' A' ' 109' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' HOH . . . . . 0.578 ' O ' ' NZ ' ' A' ' 87' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 orig full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 180' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 181' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 183' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 184' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 186' ' ' HOH . . . . . 0.614 ' O ' ' CB ' ' A' ' 59' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 187' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 188' ' ' HOH . . . . . 0.672 ' O ' ' N ' ' A' ' 2' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 189' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 190' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 191' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 192' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' LYS . . . . . 0.672 ' N ' ' O ' ' A' ' 188' ' ' HOH . 17.3 mmtt . . . . . 0 N--CA 1.5 2.065 0 N-CA-C 105.919 -1.882 . . . . 40.090000000000003 105.919 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -114.18 129.8 56.62 Favored 'General case' 0 CA--C 1.498 -1.051 0 O-C-N 123.179 0.3 . . . . 24.850000000000001 110.395 -174.436 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 27.3 mt -115.72 132.35 65.4 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.642 0 N-CA-C 109.323 -0.621 . . . . 31.539999999999999 109.323 -179.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 21.8 tp -101.86 122.81 44.69 Favored 'General case' 0 C--O 1.195 -1.786 0 N-CA-C 106.632 -1.618 . . . . 19.739999999999998 106.632 172.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 71.7 mt -105.97 115.12 47.0 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 O-C-N 126.35 2.281 . . . . 26.559999999999999 106.547 179.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 59.1 t -108.01 107.64 23.31 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.371 0 N-CA-C 106.256 -1.757 . . . . 21.719999999999999 106.256 -179.366 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -152.54 129.61 11.11 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 108.996 -0.742 . . . . 34.509999999999998 108.996 -176.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 17.2 p-10 -86.16 -7.12 58.8 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 114.426 1.269 . . . . 44.219999999999999 114.426 -178.317 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -99.22 119.46 37.92 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 108.132 -1.062 . . . . 49.850000000000001 108.132 171.214 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 13.6 tptt -62.97 -40.93 67.46 Favored Pre-proline 0 CA--C 1.552 1.029 0 N-CA-C 114.016 1.117 . . . . 44.770000000000003 114.016 179.968 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -57.33 -43.85 48.39 Favored 'Trans proline' 0 C--N 1.321 -0.917 0 C-N-CA 122.149 1.899 . . . . 35.890000000000001 115.911 175.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 6.6 mm -71.05 -42.61 76.51 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.396 0 O-C-N 124.27 0.981 . . . . 36.539999999999999 112.543 175.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 47.1 t -53.7 -43.77 69.23 Favored 'General case' 0 C--N 1.349 0.566 0 N-CA-C 109.487 -0.56 . . . . 28.34 109.487 175.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 87.9 m-20 -66.08 -38.35 88.06 Favored 'General case' 0 C--O 1.21 -0.996 0 O-C-N 123.482 0.489 . . . . 35.82 110.975 -174.976 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 15.3 mt -65.8 -43.78 93.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 117.699 0.227 . . . . 32.789999999999999 111.281 176.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 81.2 mt -69.4 -41.63 80.83 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.285 0 N-CA-C 108.661 -0.866 . . . . 24.989999999999998 108.661 -177.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -58.74 -47.12 85.73 Favored 'General case' 0 C--O 1.216 -0.682 0 N-CA-C 108.679 -0.859 . . . . 36.880000000000003 108.679 -179.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -57.38 -50.76 71.95 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 116.084 -0.507 . . . . 30.390000000000001 111.326 179.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -65.29 -43.94 89.56 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 113.512 0.93 . . . . 33.479999999999997 113.512 179.686 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 16.7 mmt -63.92 -37.84 88.88 Favored 'General case' 0 CA--C 1.553 1.079 0 N-CA-C 114.017 1.118 . . . . 33.490000000000002 114.017 175.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 23.7 m -61.55 -44.01 97.81 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 122.226 1.012 . . . . 24.949999999999999 110.996 176.232 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LYS . . . . . 0.569 ' HE2' ' O ' ' A' ' 192' ' ' HOH . 1.2 mttm -60.69 -29.57 69.4 Favored 'General case' 0 C--O 1.215 -0.731 0 CA-C-N 114.413 -1.267 . . . . 36.490000000000002 112.087 -179.051 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -81.12 -8.27 59.73 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 116.91 2.189 . . . . 48.159999999999997 116.91 171.619 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 98.67 10.86 49.07 Favored Glycine 0 C--O 1.243 0.66 0 N-CA-C 116.728 1.451 . . . . 28.079999999999998 116.728 175.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -79.84 147.99 31.53 Favored 'General case' 0 C--O 1.21 -0.981 0 N-CA-C 110.023 -0.362 . . . . 29.690000000000001 110.023 172.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 87.5 tt0 -81.93 130.48 35.09 Favored 'General case' 0 N--CA 1.44 -0.928 0 O-C-N 123.626 0.579 . . . . 30.789999999999999 109.743 162.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 88.9 t -111.42 128.74 67.73 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.576 0 C-N-CA 123.261 0.624 . . . . 23.390000000000001 111.694 -176.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.8 m -114.87 147.01 18.58 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.767 0 N-CA-C 106.733 -1.58 . . . . 26.199999999999999 106.733 163.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 20.2 p -123.32 151.43 42.45 Favored 'General case' 0 N--CA 1.438 -1.042 0 CA-C-O 121.313 0.578 . . . . 26.75 110.215 -175.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -139.59 146.03 39.31 Favored 'General case' 0 CA--C 1.486 -1.51 0 N-CA-C 106.193 -1.78 . . . . 22.699999999999999 106.193 173.809 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -116.82 1.8 12.77 Favored 'General case' 0 C--O 1.256 1.421 0 N-CA-C 116.614 2.079 . . . . 32.329999999999998 116.614 -176.146 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 26.8 p30 -153.92 179.0 9.3 Favored 'General case' 0 C--O 1.246 0.92 0 N-CA-C 108.279 -1.008 . . . . 25.809999999999999 108.279 170.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -71.9 -32.75 63.35 Favored Glycine 0 CA--C 1.5 -0.884 0 N-CA-C 110.103 -1.199 . . . . 22.77 110.103 -171.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 33.5 ttp180 -64.71 -52.57 56.45 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 119.182 -1.007 . . . . 32.100000000000001 112.043 175.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 77.7 mt-10 -58.3 -35.7 72.23 Favored 'General case' 0 C--O 1.192 -1.956 0 C-N-CA 120.324 -0.55 . . . . 32.75 110.293 176.38 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.44 -48.8 79.54 Favored 'General case' 0 CA--C 1.492 -1.255 0 CA-C-N 119.59 1.086 . . . . 20.09 112.885 178.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 61.0 mt -66.98 -38.27 85.75 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-O 121.336 0.588 . . . . 26.149999999999999 112.249 178.751 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -61.7 -45.2 95.0 Favored 'General case' 0 C--O 1.196 -1.721 0 CA-C-N 116.049 -0.523 . . . . 23.440000000000001 111.148 178.46 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 69.0 mm-40 -71.12 -39.84 71.79 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.726 0.774 . . . . 33.539999999999999 109.532 -177.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -56.42 -47.8 78.29 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 115.637 -0.711 . . . . 29.02 110.284 175.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -68.02 -42.59 80.4 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.285 0.564 . . . . 25.710000000000001 112.478 -177.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -81.01 -36.94 29.96 Favored 'General case' 0 C--O 1.207 -1.136 0 N-CA-C 112.818 0.673 . . . . 22.949999999999999 112.818 -171.976 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 -99.38 -18.71 17.37 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 116.397 1.999 . . . . 33.100000000000001 116.397 -174.108 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 91.2 mt-30 48.46 58.47 17.71 Favored Pre-proline 0 C--O 1.231 0.11 0 CA-C-O 121.633 0.73 . . . . 44.039999999999999 111.528 178.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -64.18 154.32 71.48 Favored 'Trans proline' 0 C--N 1.309 -1.52 0 C-N-CA 121.174 1.249 . . . . 22.23 110.786 178.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.9 m-20 -79.7 -24.75 41.49 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 113.16 -1.836 . . . . 23.57 111.973 178.125 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 13.7 tt -154.99 150.95 11.24 Favored 'Isoleucine or valine' 0 C--O 1.254 1.335 0 CA-C-O 122.688 1.233 . . . . 25.260000000000002 109.223 176.199 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 80.5 mt -122.59 128.08 75.21 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.927 0 CA-C-O 118.039 -0.981 . . . . 21.5 110.058 177.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 97.0 mt -99.57 120.67 49.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 N-CA-C 104.675 -2.343 . . . . 24.690000000000001 104.675 169.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 64.7 tp -123.34 114.24 19.93 Favored 'General case' 0 CA--C 1.499 -1.019 0 CA-C-O 121.581 0.705 . . . . 27.359999999999999 110.026 -169.445 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ASP . . . . . 0.886 ' C ' ' OD1' ' A' ' 52' ' ' ASP . 0.3 OUTLIER -81.72 145.29 30.58 Favored 'General case' 0 C--N 1.306 -1.306 0 C-N-CA 112.662 -3.615 . . . . 49.229999999999997 110.3 168.832 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 53' ' ' LEU . . . . . 0.645 HD21 ' O ' ' A' ' 126' ' ' HOH . 6.8 mp -67.1 -25.86 66.42 Favored 'General case' 0 CA--C 1.567 1.621 0 N-CA-C 114.424 1.268 . . . . 51.740000000000002 114.424 -179.326 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 3.4 mmm -100.33 81.9 2.43 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 114.035 1.124 . . . . 66.790000000000006 114.035 -162.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' LEU . . . . . 1.023 ' C ' HD23 ' A' ' 55' ' ' LEU . 0.7 OUTLIER -144.86 118.48 5.58 Favored Pre-proline 0 CA--C 1.549 0.916 1 C-N-CA 109.174 -5.01 . . . . 67.959999999999994 114.201 134.501 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 56' ' ' PRO . . . . . 0.602 ' HD2' ' CD2' ' A' ' 55' ' ' LEU . 3.1 Cg_exo 19.4 166.03 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.603 2 O-C-N 138.424 9.118 . . . . 67.510000000000005 120.717 -116.194 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLU . . . . . 0.682 ' O ' ' HB ' ' A' ' 58' ' ' ILE . 88.8 tt0 -77.07 98.44 5.01 Favored 'General case' 0 C--O 1.245 0.82 0 CA-C-N 112.584 -2.098 . . . . 63.380000000000003 111.664 -163.227 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ILE . . . . . 0.682 ' HB ' ' O ' ' A' ' 57' ' ' GLU . 8.2 tt 133.7 -21.58 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 N-CA-C 113.286 0.847 . . . . 54.109999999999999 113.286 -170.318 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ASP . . . . . 0.614 ' CB ' ' O ' ' A' ' 186' ' ' HOH . 32.5 t0 -74.82 -38.22 62.11 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 113.666 0.987 . . . . 41.729999999999997 113.666 -174.94 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -58.95 -44.19 96.31 Favored Glycine 0 C--O 1.224 -0.506 0 C-N-CA 121.203 -0.522 . . . . 33.829999999999998 112.096 171.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 94.7 mt -62.52 -42.44 99.52 Favored 'General case' 0 CA--C 1.506 -0.733 0 O-C-N 122.239 -0.565 . . . . 31.27 110.196 179.588 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLU . . . . . 0.583 ' O ' HG23 ' A' ' 66' ' ' THR . 26.1 tp10 -64.24 -40.88 96.92 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 114.106 1.15 . . . . 48.740000000000002 114.106 175.131 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 59' ' ' ASP . 42.8 t -58.34 -48.9 83.75 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.815 0 C-N-CA 118.732 -1.187 . . . . 27.09 110.088 176.671 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.5 -47.71 84.4 Favored 'General case' 0 C--O 1.21 -1.02 0 N-CA-C 109.672 -0.492 . . . . 25.77 109.672 -178.156 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' LYS . . . . . 0.428 ' NZ ' ' OE1' ' A' ' 62' ' ' GLU . 19.5 ttpp -51.26 -47.08 62.56 Favored 'General case' 0 C--O 1.244 0.814 0 N-CA-C 113.209 0.818 . . . . 46.079999999999998 113.209 173.199 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' THR . . . . . 0.583 HG23 ' O ' ' A' ' 62' ' ' GLU 0.385 0.3 OUTLIER -77.31 -35.44 54.89 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 116.487 -2.085 . . . . 33.240000000000002 112.898 -176.21 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 53.3 mt -55.02 -44.19 72.97 Favored 'Isoleucine or valine' 0 C--O 1.189 -2.12 0 CA-C-N 118.517 0.599 . . . . 30.27 111.899 171.236 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 61.6 mmt-85 -65.07 -16.21 63.21 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 115.056 1.502 . . . . 34.119999999999997 115.056 -178.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 16.9 mttm -58.71 -38.52 78.48 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 118.383 0.538 . . . . 47.130000000000003 111.287 169.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 22.3 p -114.74 -20.65 10.55 Favored 'General case' 0 C--O 1.209 -1.029 0 N-CA-C 116.599 2.074 . . . . 38.07 116.599 -172.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 29.1 t -141.94 145.85 35.0 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 121.415 -0.803 . . . . 30.449999999999999 111.517 -165.688 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 90.2 p -96.41 13.27 28.38 Favored 'General case' 0 CA--C 1.563 1.47 0 C-N-CA 125.125 1.37 . . . . 28.649999999999999 112.127 173.143 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 11.3 p -50.23 130.82 24.37 Favored Pre-proline 0 C--O 1.195 -1.797 0 O-C-N 121.152 -0.968 . . . . 25.379999999999999 109.91 178.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -57.27 135.6 71.25 Favored 'Trans proline' 0 C--O 1.243 0.769 0 C-N-CA 121.164 1.242 . . . . 23.870000000000001 113.511 177.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 67.9 mt -123.26 125.99 72.71 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.005 0 O-C-N 123.904 0.752 . . . . 21.77 110.596 175.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.7 tt -110.46 117.67 34.19 Favored 'General case' 0 CA--C 1.481 -1.7 0 N-CA-C 103.794 -2.669 . . . . 25.539999999999999 103.794 175.56 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' MET . . . . . 0.631 ' SD ' HD11 ' A' ' 53' ' ' LEU . 40.7 mtt -93.55 141.12 28.83 Favored 'General case' 0 N--CA 1.435 -1.201 0 N-CA-C 107.591 -1.263 . . . . 36.869999999999997 107.591 178.316 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.5 mt -125.18 134.91 52.21 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 126.742 2.017 . . . . 30.59 107.26 -178.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 15.8 t -166.72 141.01 4.04 Favored 'General case' 0 N--CA 1.432 -1.342 0 O-C-N 120.396 -1.44 . . . . 29.66 110.141 -175.286 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.31 -25.95 68.15 Favored 'General case' 0 C--O 1.247 0.922 0 N-CA-C 114.312 1.227 . . . . 29.670000000000002 114.312 164.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' LYS . . . . . 0.435 ' HD2' ' O ' ' A' ' 139' ' ' HOH . 24.3 mttm -72.28 126.73 30.53 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 120.995 -1.065 . . . . 46.079999999999998 109.005 177.617 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 47.4 p-10 -131.0 11.88 5.13 Favored 'General case' 0 CA--C 1.493 -1.246 0 CA-C-N 114.424 -1.262 . . . . 30.91 113.774 -166.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.3 p -75.55 165.22 25.42 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 123.93 0.769 . . . . 30.800000000000001 111.172 176.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -62.99 -46.27 88.49 Favored 'General case' 0 CA--C 1.502 -0.891 0 C-N-CA 124.453 1.101 . . . . 39.32 109.115 -178.415 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -53.5 -44.18 68.85 Favored 'General case' 0 C--O 1.208 -1.117 0 CA-C-N 115.517 -0.765 . . . . 39.850000000000001 110.731 178.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -68.51 -48.24 64.9 Favored 'General case' 0 CA--C 1.49 -1.329 0 N-CA-C 109.361 -0.607 . . . . 28.579999999999998 109.361 -171.036 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' LYS . . . . . 0.578 ' NZ ' ' O ' ' A' ' 170' ' ' HOH . 75.2 mttt -63.86 -47.96 78.62 Favored 'General case' 0 N--CA 1.489 1.518 0 CA-C-N 115.786 -0.643 . . . . 33.020000000000003 110.139 179.204 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 78.2 t -61.32 -45.52 98.44 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 CA-C-N 116.427 -0.351 . . . . 22.210000000000001 110.906 -179.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 2.0 tt -69.54 -38.13 76.11 Favored 'Isoleucine or valine' 0 C--O 1.19 -2.026 0 C-N-CA 118.182 -1.407 . . . . 36.109999999999999 112.285 -178.28 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -57.01 -46.37 91.48 Favored Glycine 0 C--O 1.224 -0.51 0 N-CA-C 111.374 -0.69 . . . . 24.780000000000001 111.374 175.521 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 35.3 mt -68.09 -42.09 80.88 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 113.116 0.784 . . . . 25.030000000000001 113.116 -179.098 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -63.26 -38.5 91.41 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 123.506 0.504 . . . . 32.409999999999997 111.861 178.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.6 -3.96 34.25 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 116.03 1.863 . . . . 40.289999999999999 116.03 173.873 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 129.96 -6.45 6.1 Favored Glycine 0 CA--C 1.492 -1.381 0 N-CA-C 116.886 1.514 . . . . 30.989999999999998 116.886 163.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.06 144.0 57.28 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 118.901 -1.12 . . . . 26.539999999999999 109.999 174.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -88.11 -20.7 25.32 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 114.595 -1.184 . . . . 27.920000000000002 112.857 176.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -158.23 162.02 37.81 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 106.437 -1.69 . . . . 22.57 106.437 -179.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -147.97 122.61 9.84 Favored 'General case' 0 N--CA 1.425 -1.694 0 N-CA-C 105.872 -1.899 . . . . 30.399999999999999 105.872 -177.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 65.2 t -126.27 137.55 57.42 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.1 0 N-CA-C 105.665 -1.976 . . . . 21.760000000000002 105.665 -171.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 46.4 p -92.33 151.65 20.18 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 113.469 0.915 . . . . 26.370000000000001 113.469 -177.422 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt -102.11 137.16 19.4 Favored Pre-proline 0 CA--C 1.5 -0.948 0 N-CA-C 106.115 -1.809 . . . . 40.670000000000002 106.115 177.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -80.24 149.45 79.53 Favored 'Cis proline' 0 C--N 1.348 0.539 0 O-C-N 124.166 1.614 . . . . 30.0 110.466 5.899 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 43.9 p90 -118.27 163.83 16.11 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 122.434 1.112 . . . . 32.780000000000001 108.244 -173.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -88.27 132.05 34.54 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 105.59 -2.004 . . . . 25.350000000000001 105.59 173.881 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 93.0 m-20 -64.24 -39.98 95.08 Favored 'General case' 0 C--O 1.207 -1.154 0 N-CA-C 108.765 -0.828 . . . . 35.229999999999997 108.765 -179.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 61.3 mtt85 -65.42 -39.37 92.06 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 120.688 -0.405 . . . . 47.840000000000003 112.069 179.186 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 75.8 tt0 -66.77 -41.13 88.24 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 119.214 -0.994 . . . . 22.260000000000002 109.914 179.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.9 -44.79 91.28 Favored 'General case' 0 C--O 1.243 0.717 0 CA-C-O 122.322 1.058 . . . . 26.32 110.173 178.166 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 109' ' ' GLN . . . . . 0.437 ' HG2' ' O ' ' A' ' 168' ' ' HOH . 16.1 mt-30 -60.71 -43.97 97.16 Favored 'General case' 0 C--O 1.204 -1.32 0 C-N-CA 118.348 -1.341 . . . . 44.780000000000001 110.238 178.977 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -62.1 -41.19 97.96 Favored 'General case' 0 C--O 1.213 -0.846 0 C-N-CA 123.192 0.597 . . . . 21.09 109.394 -178.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 93.5 mtt-85 -69.82 -37.39 76.21 Favored 'General case' 0 N--CA 1.479 0.992 0 N-CA-C 113.373 0.879 . . . . 20.719999999999999 113.373 179.762 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 48.0 t -62.78 -45.54 98.59 Favored 'Isoleucine or valine' 0 C--O 1.248 1.012 0 O-C-N 121.564 -0.71 . . . . 21.690000000000001 109.659 174.594 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -58.18 -43.83 87.69 Favored 'General case' 0 C--O 1.21 -0.977 0 CA-C-O 122.464 1.126 . . . . 21.32 110.948 176.85 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.29 -41.76 89.31 Favored 'General case' 0 N--CA 1.477 0.896 0 O-C-N 121.046 -1.034 . . . . 24.879999999999999 109.903 -175.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' LEU . . . . . 0.407 HD23 ' HA ' ' A' ' 115' ' ' LEU . 13.2 mt -62.11 -44.79 95.88 Favored 'General case' 0 C--O 1.258 1.544 0 N-CA-C 112.419 0.526 . . . . 32.659999999999997 112.419 176.231 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 67.4 mt -66.91 -36.96 83.44 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 121.027 -0.269 . . . . 28.170000000000002 111.615 -178.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 3.9 ttp180 -58.11 -34.91 70.73 Favored 'General case' 0 N--CA 1.483 1.196 0 CA-C-O 121.211 0.529 . . . . 45.740000000000002 112.394 177.383 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 9.4 tpp180 -100.79 19.51 17.01 Favored 'General case' 1 C--O 3.624 126.036 1 CA-C-O 47.337 -34.649 . . . . 43.159999999999997 113.612 -168.902 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 1.1 t . . . . . 0 N--CA 1.461 0.117 1 O-C-N 75.722 -29.361 . . . . 49.770000000000003 113.51 -168.129 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' PHS . . . . . 0.943 ' O1P' ' HB3' ' A' ' 55' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.878 ' O ' HD22 ' A' ' 55' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' HOH . . . . . 0.645 ' O ' HD21 ' A' ' 53' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 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 . . . . . 0.53 ' O ' HD23 ' A' ' 53' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.579 ' O ' ' HA ' ' A' ' 2' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 0 . 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 0 . 1 . 001 ecloud build full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 163' ' ' HOH . . . . . 0.856 ' O ' ' HA ' ' A' ' 55' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.437 ' O ' ' HG2' ' A' ' 109' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 170' ' ' HOH . . . . . 0.578 ' O ' ' NZ ' ' A' ' 87' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 build full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 179' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 180' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 181' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 183' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 184' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 186' ' ' HOH . . . . . 0.614 ' O ' ' CB ' ' A' ' 59' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 187' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 188' ' ' HOH . . . . . 0.672 ' O ' ' N ' ' A' ' 2' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 189' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 190' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 191' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 192' ' ' HOH . . . . . 0.569 ' O ' ' HE2' ' A' ' 23' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' LYS . . . . . 0.672 ' N ' ' O ' ' A' ' 188' ' ' HOH . 17.3 mmtt . . . . . 0 N--CA 1.5 2.065 0 N-CA-C 105.919 -1.882 . . . . 40.090000000000003 105.919 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 39.1 ttmt -114.18 129.8 56.62 Favored 'General case' 0 CA--C 1.498 -1.051 0 O-C-N 123.179 0.3 . . . . 24.850000000000001 110.395 -174.436 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ILE . . . . . . . . . . . . . 27.3 mt -115.72 132.35 65.4 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.642 0 N-CA-C 109.323 -0.621 . . . . 31.539999999999999 109.323 -179.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' LEU . . . . . . . . . . . . . 21.8 tp -101.86 122.81 44.69 Favored 'General case' 0 C--O 1.195 -1.786 0 N-CA-C 106.632 -1.618 . . . . 19.739999999999998 106.632 172.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ILE . . . . . . . . . . . . . 71.7 mt -105.97 115.12 47.0 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 O-C-N 126.35 2.281 . . . . 26.559999999999999 106.547 179.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 59.1 t -108.01 107.64 23.31 Favored 'Isoleucine or valine' 0 CA--C 1.489 -1.371 0 N-CA-C 106.256 -1.757 . . . . 21.719999999999999 106.256 -179.366 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -152.54 129.61 11.11 Favored 'General case' 0 C--N 1.309 -1.167 0 N-CA-C 108.996 -0.742 . . . . 34.509999999999998 108.996 -176.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 17.2 p-10 -86.16 -7.12 58.8 Favored 'General case' 0 C--N 1.321 -0.661 0 N-CA-C 114.426 1.269 . . . . 44.219999999999999 114.426 -178.317 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -99.22 119.46 37.92 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 108.132 -1.062 . . . . 49.850000000000001 108.132 171.214 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 13.6 tptt -62.97 -40.93 67.46 Favored Pre-proline 0 CA--C 1.552 1.029 0 N-CA-C 114.016 1.117 . . . . 44.770000000000003 114.016 179.968 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 82.0 Cg_exo -57.33 -43.85 48.39 Favored 'Trans proline' 0 C--N 1.321 -0.917 0 C-N-CA 122.149 1.899 . . . . 35.890000000000001 115.911 175.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 6.6 mm -71.05 -42.61 76.51 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.396 0 O-C-N 124.27 0.981 . . . . 36.539999999999999 112.543 175.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 47.1 t -53.7 -43.77 69.23 Favored 'General case' 0 C--N 1.349 0.566 0 N-CA-C 109.487 -0.56 . . . . 28.34 109.487 175.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 87.9 m-20 -66.08 -38.35 88.06 Favored 'General case' 0 C--O 1.21 -0.996 0 O-C-N 123.482 0.489 . . . . 35.82 110.975 -174.976 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 15.3 mt -65.8 -43.78 93.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 117.699 0.227 . . . . 32.789999999999999 111.281 176.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 81.2 mt -69.4 -41.63 80.83 Favored 'Isoleucine or valine' 0 N--CA 1.433 -1.285 0 N-CA-C 108.661 -0.866 . . . . 24.989999999999998 108.661 -177.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -58.74 -47.12 85.73 Favored 'General case' 0 C--O 1.216 -0.682 0 N-CA-C 108.679 -0.859 . . . . 36.880000000000003 108.679 -179.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' PHE . . . . . . . . . . . . . 48.2 t80 -57.38 -50.76 71.95 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-N 116.084 -0.507 . . . . 30.390000000000001 111.326 179.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 26.5 m120 -65.29 -43.94 89.56 Favored 'General case' 0 N--CA 1.441 -0.917 0 N-CA-C 113.512 0.93 . . . . 33.479999999999997 113.512 179.686 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' MET . . . . . . . . . . . . . 16.7 mmt -63.92 -37.84 88.88 Favored 'General case' 0 CA--C 1.553 1.079 0 N-CA-C 114.017 1.118 . . . . 33.490000000000002 114.017 175.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 23.7 m -61.55 -44.01 97.81 Favored 'General case' 0 C--N 1.319 -0.734 0 CA-C-O 122.226 1.012 . . . . 24.949999999999999 110.996 176.232 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.569 ' HE2' ' O ' ' A' ' 192' ' ' HOH . 1.2 mttm -60.69 -29.57 69.4 Favored 'General case' 0 C--O 1.215 -0.731 0 CA-C-N 114.413 -1.267 . . . . 36.490000000000002 112.087 -179.051 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.0 mm-40 -81.12 -8.27 59.73 Favored 'General case' 0 N--CA 1.472 0.63 0 N-CA-C 116.91 2.189 . . . . 48.159999999999997 116.91 171.619 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . 98.67 10.86 49.07 Favored Glycine 0 C--O 1.243 0.66 0 N-CA-C 116.728 1.451 . . . . 28.079999999999998 116.728 175.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' TYR . . . . . . . . . . . . . 72.8 m-85 -79.84 147.99 31.53 Favored 'General case' 0 C--O 1.21 -0.981 0 N-CA-C 110.023 -0.362 . . . . 29.690000000000001 110.023 172.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 87.5 tt0 -81.93 130.48 35.09 Favored 'General case' 0 N--CA 1.44 -0.928 0 O-C-N 123.626 0.579 . . . . 30.789999999999999 109.743 162.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 88.9 t -111.42 128.74 67.73 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.576 0 C-N-CA 123.261 0.624 . . . . 23.390000000000001 111.694 -176.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 34.8 m -114.87 147.01 18.58 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.767 0 N-CA-C 106.733 -1.58 . . . . 26.199999999999999 106.733 163.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 20.2 p -123.32 151.43 42.45 Favored 'General case' 0 N--CA 1.438 -1.042 0 CA-C-O 121.313 0.578 . . . . 26.75 110.215 -175.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -139.59 146.03 39.31 Favored 'General case' 0 CA--C 1.486 -1.51 0 N-CA-C 106.193 -1.78 . . . . 22.699999999999999 106.193 173.809 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -116.82 1.8 12.77 Favored 'General case' 0 C--O 1.256 1.421 0 N-CA-C 116.614 2.079 . . . . 32.329999999999998 116.614 -176.146 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ASN . . . . . . . . . . . . . 26.8 p30 -153.92 179.0 9.3 Favored 'General case' 0 C--O 1.246 0.92 0 N-CA-C 108.279 -1.008 . . . . 25.809999999999999 108.279 170.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -71.9 -32.75 63.35 Favored Glycine 0 CA--C 1.5 -0.884 0 N-CA-C 110.103 -1.199 . . . . 22.77 110.103 -171.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 33.5 ttp180 -64.71 -52.57 56.45 Favored 'General case' 0 CA--C 1.516 -0.34 0 C-N-CA 119.182 -1.007 . . . . 32.100000000000001 112.043 175.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 77.7 mt-10 -58.3 -35.7 72.23 Favored 'General case' 0 C--O 1.192 -1.956 0 C-N-CA 120.324 -0.55 . . . . 32.75 110.293 176.38 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' ALA . . . . . . . . . . . . . . . -58.44 -48.8 79.54 Favored 'General case' 0 CA--C 1.492 -1.255 0 CA-C-N 119.59 1.086 . . . . 20.09 112.885 178.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 61.0 mt -66.98 -38.27 85.75 Favored 'General case' 0 N--CA 1.475 0.785 0 CA-C-O 121.336 0.588 . . . . 26.149999999999999 112.249 178.751 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 96.7 mt-10 -61.7 -45.2 95.0 Favored 'General case' 0 C--O 1.196 -1.721 0 CA-C-N 116.049 -0.523 . . . . 23.440000000000001 111.148 178.46 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 11.1 mm100 -71.12 -39.84 71.79 Favored 'General case' 0 C--N 1.318 -0.782 0 CA-C-O 121.726 0.774 . . . . 33.539999999999999 109.532 -177.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 14.7 t80 -56.42 -47.8 78.29 Favored 'General case' 0 CA--C 1.517 -0.296 0 CA-C-N 115.637 -0.711 . . . . 29.02 110.284 175.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 28.0 mt-10 -68.02 -42.59 80.4 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-O 121.285 0.564 . . . . 25.710000000000001 112.478 -177.981 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ALA . . . . . . . . . . . . . . . -81.01 -36.94 29.96 Favored 'General case' 0 C--O 1.207 -1.136 0 N-CA-C 112.818 0.673 . . . . 22.949999999999999 112.818 -171.976 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 63.4 mm-40 -99.38 -18.71 17.37 Favored 'General case' 0 C--N 1.326 -0.414 0 N-CA-C 116.397 1.999 . . . . 33.100000000000001 116.397 -174.108 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 48.46 58.47 17.71 Favored Pre-proline 0 C--O 1.231 0.11 0 CA-C-O 121.633 0.73 . . . . 44.039999999999999 111.528 178.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 85.9 Cg_endo -64.18 154.32 71.48 Favored 'Trans proline' 0 C--N 1.309 -1.52 0 C-N-CA 121.174 1.249 . . . . 22.23 110.786 178.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 34.9 m-20 -79.7 -24.75 41.49 Favored 'General case' 0 C--N 1.319 -0.722 0 CA-C-N 113.16 -1.836 . . . . 23.57 111.973 178.125 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 13.7 tt -154.99 150.95 11.24 Favored 'Isoleucine or valine' 0 C--O 1.254 1.335 0 CA-C-O 122.688 1.233 . . . . 25.260000000000002 109.223 176.199 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ILE . . . . . . . . . . . . . 80.5 mt -122.59 128.08 75.21 Favored 'Isoleucine or valine' 0 C--O 1.211 -0.927 0 CA-C-O 118.039 -0.981 . . . . 21.5 110.058 177.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 97.0 mt -99.57 120.67 49.26 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 N-CA-C 104.675 -2.343 . . . . 24.690000000000001 104.675 169.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 64.7 tp -123.34 114.24 19.93 Favored 'General case' 0 CA--C 1.499 -1.019 0 CA-C-O 121.581 0.705 . . . . 27.359999999999999 110.026 -169.445 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.886 ' C ' ' OD1' ' A' ' 52' ' ' ASP . 0.3 OUTLIER -81.72 145.29 30.58 Favored 'General case' 0 C--N 1.306 -1.306 0 C-N-CA 112.662 -3.615 . . . . 49.229999999999997 110.3 168.832 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.645 HD21 ' O ' ' A' ' 126' ' ' HOH . 6.8 mp -67.1 -25.86 66.42 Favored 'General case' 0 CA--C 1.567 1.621 0 N-CA-C 114.424 1.268 . . . . 51.740000000000002 114.424 -179.326 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' MET . . . . . . . . . . . . . 3.4 mmm -100.33 81.9 2.43 Favored 'General case' 0 N--CA 1.446 -0.629 0 N-CA-C 114.035 1.124 . . . . 66.790000000000006 114.035 -162.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' LEU . . . . . 1.023 ' C ' HD23 ' A' ' 55' ' ' LEU . 0.7 OUTLIER -144.86 118.48 5.58 Favored Pre-proline 0 CA--C 1.549 0.916 1 C-N-CA 109.174 -5.01 . . . . 67.959999999999994 114.201 134.501 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.602 ' HD2' ' CD2' ' A' ' 55' ' ' LEU . 3.1 Cg_exo 19.4 166.03 0.0 OUTLIER 'Trans proline' 0 N--CA 1.458 -0.603 2 O-C-N 138.424 9.118 . . . . 67.510000000000005 120.717 -116.194 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLU . . . . . 0.682 ' O ' ' HB ' ' A' ' 58' ' ' ILE . 88.8 tt0 -77.07 98.44 5.01 Favored 'General case' 0 C--O 1.245 0.82 0 CA-C-N 112.584 -2.098 . . . . 63.380000000000003 111.664 -163.227 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.682 ' HB ' ' O ' ' A' ' 57' ' ' GLU . 8.2 tt 133.7 -21.58 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.492 1.663 0 N-CA-C 113.286 0.847 . . . . 54.109999999999999 113.286 -170.318 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ASP . . . . . 0.614 ' CB ' ' O ' ' A' ' 186' ' ' HOH . 32.5 t0 -74.82 -38.22 62.11 Favored 'General case' 0 C--N 1.326 -0.452 0 N-CA-C 113.666 0.987 . . . . 41.729999999999997 113.666 -174.94 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -58.95 -44.19 96.31 Favored Glycine 0 C--O 1.224 -0.506 0 C-N-CA 121.203 -0.522 . . . . 33.829999999999998 112.096 171.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 94.7 mt -62.52 -42.44 99.52 Favored 'General case' 0 CA--C 1.506 -0.733 0 O-C-N 122.239 -0.565 . . . . 31.27 110.196 179.588 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.583 ' O ' HG23 ' A' ' 66' ' ' THR . 26.1 tp10 -64.24 -40.88 96.92 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 114.106 1.15 . . . . 48.740000000000002 114.106 175.131 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 59' ' ' ASP . 42.8 t -58.34 -48.9 83.75 Favored 'Isoleucine or valine' 0 C--O 1.195 -1.815 0 C-N-CA 118.732 -1.187 . . . . 27.09 110.088 176.671 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -61.5 -47.71 84.4 Favored 'General case' 0 C--O 1.21 -1.02 0 N-CA-C 109.672 -0.492 . . . . 25.77 109.672 -178.156 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.428 ' NZ ' ' OE1' ' A' ' 62' ' ' GLU . 19.5 ttpp -51.26 -47.08 62.56 Favored 'General case' 0 C--O 1.244 0.814 0 N-CA-C 113.209 0.818 . . . . 46.079999999999998 113.209 173.199 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' THR . . . . . 0.583 HG23 ' O ' ' A' ' 62' ' ' GLU 0.385 0.3 OUTLIER -77.31 -35.44 54.89 Favored 'General case' 0 C--N 1.321 -0.652 0 C-N-CA 116.487 -2.085 . . . . 33.240000000000002 112.898 -176.21 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ILE . . . . . . . . . . . . . 53.3 mt -55.02 -44.19 72.97 Favored 'Isoleucine or valine' 0 C--O 1.189 -2.12 0 CA-C-N 118.517 0.599 . . . . 30.27 111.899 171.236 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ARG . . . . . . . . . . . . . 61.6 mmt-85 -65.07 -16.21 63.21 Favored 'General case' 0 N--CA 1.478 0.93 0 N-CA-C 115.056 1.502 . . . . 34.119999999999997 115.056 -178.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 16.9 mttm -58.71 -38.52 78.48 Favored 'General case' 0 N--CA 1.469 0.477 0 CA-C-N 118.383 0.538 . . . . 47.130000000000003 111.287 169.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 22.3 p -114.74 -20.65 10.55 Favored 'General case' 0 C--O 1.209 -1.029 0 N-CA-C 116.599 2.074 . . . . 38.07 116.599 -172.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' SER . . . . . . . . . . . . . 29.1 t -141.94 145.85 35.0 Favored 'General case' 0 N--CA 1.468 0.444 0 O-C-N 121.415 -0.803 . . . . 30.449999999999999 111.517 -165.688 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' SER . . . . . . . . . . . . . 90.2 p -96.41 13.27 28.38 Favored 'General case' 0 CA--C 1.563 1.47 0 C-N-CA 125.125 1.37 . . . . 28.649999999999999 112.127 173.143 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 11.3 p -50.23 130.82 24.37 Favored Pre-proline 0 C--O 1.195 -1.797 0 O-C-N 121.152 -0.968 . . . . 25.379999999999999 109.91 178.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_exo -57.27 135.6 71.25 Favored 'Trans proline' 0 C--O 1.243 0.769 0 C-N-CA 121.164 1.242 . . . . 23.870000000000001 113.511 177.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 67.9 mt -123.26 125.99 72.71 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.005 0 O-C-N 123.904 0.752 . . . . 21.77 110.596 175.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 8.7 tt -110.46 117.67 34.19 Favored 'General case' 0 CA--C 1.481 -1.7 0 N-CA-C 103.794 -2.669 . . . . 25.539999999999999 103.794 175.56 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' MET . . . . . 0.631 ' SD ' HD11 ' A' ' 53' ' ' LEU . 40.7 mtt -93.55 141.12 28.83 Favored 'General case' 0 N--CA 1.435 -1.201 0 N-CA-C 107.591 -1.263 . . . . 36.869999999999997 107.591 178.316 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LEU . . . . . . . . . . . . . 1.5 mt -125.18 134.91 52.21 Favored 'General case' 0 N--CA 1.431 -1.409 0 C-N-CA 126.742 2.017 . . . . 30.59 107.26 -178.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' SER . . . . . . . . . . . . . 15.8 t -166.72 141.01 4.04 Favored 'General case' 0 N--CA 1.432 -1.342 0 O-C-N 120.396 -1.44 . . . . 29.66 110.141 -175.286 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . -62.31 -25.95 68.15 Favored 'General case' 0 C--O 1.247 0.922 0 N-CA-C 114.312 1.227 . . . . 29.670000000000002 114.312 164.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' LYS . . . . . 0.435 ' HD2' ' O ' ' A' ' 139' ' ' HOH . 24.3 mttm -72.28 126.73 30.53 Favored 'General case' 0 N--CA 1.477 0.899 0 O-C-N 120.995 -1.065 . . . . 46.079999999999998 109.005 177.617 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 47.4 p-10 -131.0 11.88 5.13 Favored 'General case' 0 CA--C 1.493 -1.246 0 CA-C-N 114.424 -1.262 . . . . 30.91 113.774 -166.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' SER . . . . . . . . . . . . . 8.3 p -75.55 165.22 25.42 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 123.93 0.769 . . . . 30.800000000000001 111.172 176.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 19.5 tt0 -62.99 -46.27 88.49 Favored 'General case' 0 CA--C 1.502 -0.891 0 C-N-CA 124.453 1.101 . . . . 39.32 109.115 -178.415 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' PHE . . . . . . . . . . . . . 71.0 t80 -53.5 -44.18 68.85 Favored 'General case' 0 C--O 1.208 -1.117 0 CA-C-N 115.517 -0.765 . . . . 39.850000000000001 110.731 178.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -68.51 -48.24 64.9 Favored 'General case' 0 CA--C 1.49 -1.329 0 N-CA-C 109.361 -0.607 . . . . 28.579999999999998 109.361 -171.036 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' LYS . . . . . 0.578 ' NZ ' ' O ' ' A' ' 170' ' ' HOH . 75.2 mttt -63.86 -47.96 78.62 Favored 'General case' 0 N--CA 1.489 1.518 0 CA-C-N 115.786 -0.643 . . . . 33.020000000000003 110.139 179.204 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 78.2 t -61.32 -45.52 98.44 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.931 0 CA-C-N 116.427 -0.351 . . . . 22.210000000000001 110.906 -179.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ILE . . . . . . . . . . . . . 2.0 tt -69.54 -38.13 76.11 Favored 'Isoleucine or valine' 0 C--O 1.19 -2.026 0 C-N-CA 118.182 -1.407 . . . . 36.109999999999999 112.285 -178.28 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . -57.01 -46.37 91.48 Favored Glycine 0 C--O 1.224 -0.51 0 N-CA-C 111.374 -0.69 . . . . 24.780000000000001 111.374 175.521 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' LEU . . . . . . . . . . . . . 35.3 mt -68.09 -42.09 80.88 Favored 'General case' 0 N--CA 1.466 0.338 0 N-CA-C 113.116 0.784 . . . . 25.030000000000001 113.116 -179.098 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLU . . . . . . . . . . . . . 4.7 mm-40 -63.26 -38.5 91.41 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 123.506 0.504 . . . . 32.409999999999997 111.861 178.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -74.6 -3.96 34.25 Favored 'General case' 0 CA--C 1.55 0.972 0 N-CA-C 116.03 1.863 . . . . 40.289999999999999 116.03 173.873 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 129.96 -6.45 6.1 Favored Glycine 0 CA--C 1.492 -1.381 0 N-CA-C 116.886 1.514 . . . . 30.989999999999998 116.886 163.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -63.06 144.0 57.28 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 118.901 -1.12 . . . . 26.539999999999999 109.999 174.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ASP . . . . . . . . . . . . . 18.5 m-20 -88.11 -20.7 25.32 Favored 'General case' 0 N--CA 1.436 -1.136 0 CA-C-N 114.595 -1.184 . . . . 27.920000000000002 112.857 176.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -158.23 162.02 37.81 Favored 'General case' 0 N--CA 1.436 -1.152 0 N-CA-C 106.437 -1.69 . . . . 22.57 106.437 -179.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -147.97 122.61 9.84 Favored 'General case' 0 N--CA 1.425 -1.694 0 N-CA-C 105.872 -1.899 . . . . 30.399999999999999 105.872 -177.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' VAL . . . . . . . . . . . . . 65.2 t -126.27 137.55 57.42 Favored 'Isoleucine or valine' 0 C--O 1.208 -1.1 0 N-CA-C 105.665 -1.976 . . . . 21.760000000000002 105.665 -171.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 46.4 p -92.33 151.65 20.18 Favored 'General case' 0 C--N 1.304 -1.385 0 N-CA-C 113.469 0.915 . . . . 26.370000000000001 113.469 -177.422 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt -102.11 137.16 19.4 Favored Pre-proline 0 CA--C 1.5 -0.948 0 N-CA-C 106.115 -1.809 . . . . 40.670000000000002 106.115 177.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' PRO . . . . . . . . . . . . . 41.5 Cg_endo -80.24 149.45 79.53 Favored 'Cis proline' 0 C--N 1.348 0.539 0 O-C-N 124.166 1.614 . . . . 30.0 110.466 5.899 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' PHE . . . . . . . . . . . . . 43.9 p90 -118.27 163.83 16.11 Favored 'General case' 0 C--N 1.321 -0.654 0 CA-C-O 122.434 1.112 . . . . 32.780000000000001 108.244 -173.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -88.27 132.05 34.54 Favored 'General case' 0 C--N 1.311 -1.088 0 N-CA-C 105.59 -2.004 . . . . 25.350000000000001 105.59 173.881 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -64.24 -39.98 95.08 Favored 'General case' 0 C--O 1.207 -1.154 0 N-CA-C 108.765 -0.828 . . . . 35.229999999999997 108.765 -179.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 61.3 mtt85 -65.42 -39.37 92.06 Favored 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 120.688 -0.405 . . . . 47.840000000000003 112.069 179.186 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' GLU . . . . . . . . . . . . . 75.8 tt0 -66.77 -41.13 88.24 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 119.214 -0.994 . . . . 22.260000000000002 109.914 179.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -58.9 -44.79 91.28 Favored 'General case' 0 C--O 1.243 0.717 0 CA-C-O 122.322 1.058 . . . . 26.32 110.173 178.166 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' GLN . . . . . 0.437 ' HG2' ' O ' ' A' ' 168' ' ' HOH . 16.1 mt-30 -60.71 -43.97 97.16 Favored 'General case' 0 C--O 1.204 -1.32 0 C-N-CA 118.348 -1.341 . . . . 44.780000000000001 110.238 178.977 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -62.1 -41.19 97.96 Favored 'General case' 0 C--O 1.213 -0.846 0 C-N-CA 123.192 0.597 . . . . 21.09 109.394 -178.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' ARG . . . . . . . . . . . . . 93.5 mtt-85 -69.82 -37.39 76.21 Favored 'General case' 0 N--CA 1.479 0.992 0 N-CA-C 113.373 0.879 . . . . 20.719999999999999 113.373 179.762 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 48.0 t -62.78 -45.54 98.59 Favored 'Isoleucine or valine' 0 C--O 1.248 1.012 0 O-C-N 121.564 -0.71 . . . . 21.690000000000001 109.659 174.594 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' LYS . . . . . . . . . . . . . 88.8 tttt -58.18 -43.83 87.69 Favored 'General case' 0 C--O 1.21 -0.977 0 CA-C-O 122.464 1.126 . . . . 21.32 110.948 176.85 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ALA . . . . . . . . . . . . . . . -66.29 -41.76 89.31 Favored 'General case' 0 N--CA 1.477 0.896 0 O-C-N 121.046 -1.034 . . . . 24.879999999999999 109.903 -175.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.407 HD23 ' HA ' ' A' ' 115' ' ' LEU . 13.2 mt -62.11 -44.79 95.88 Favored 'General case' 0 C--O 1.258 1.544 0 N-CA-C 112.419 0.526 . . . . 32.659999999999997 112.419 176.231 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 67.4 mt -66.91 -36.96 83.44 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 121.027 -0.269 . . . . 28.170000000000002 111.615 -178.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' ARG . . . . . . . . . . . . . 3.9 ttp180 -58.11 -34.91 70.73 Favored 'General case' 0 N--CA 1.483 1.196 0 CA-C-O 121.211 0.529 . . . . 45.740000000000002 112.394 177.383 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 9.4 tpp180 -100.79 19.51 17.01 Favored 'General case' 1 C--O 3.624 126.036 1 CA-C-O 47.337 -34.649 . . . . 43.159999999999997 113.612 -168.902 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' SER . . . . . . . . . . . . . 1.1 t . . . . . 0 N--CA 1.461 0.117 1 O-C-N 75.722 -29.361 . . . . 49.770000000000003 113.51 -168.129 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' PHS . . . . . 0.943 ' O1P' ' HB3' ' A' ' 55' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.878 ' O ' HD22 ' A' ' 55' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' HOH . . . . . 0.645 ' O ' HD21 ' A' ' 53' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 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 . . . . . 0.53 ' O ' HD23 ' A' ' 53' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.579 ' O ' ' HA ' ' A' ' 2' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 0 . 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 0 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' HOH . . . . . 0.856 ' O ' ' HA ' ' A' ' 55' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.437 ' O ' ' HG2' ' A' ' 109' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' HOH . . . . . 0.578 ' O ' ' NZ ' ' A' ' 87' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 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 . 001 ecloud nobuild full ' A' A ' 177' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 180' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 181' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 183' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 184' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 185' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 186' ' ' HOH . . . . . 0.614 ' O ' ' CB ' ' A' ' 59' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 187' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 188' ' ' HOH . . . . . 0.672 ' O ' ' N ' ' A' ' 2' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 189' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 190' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 191' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 192' ' ' HOH . . . . . 0.569 ' O ' ' HE2' ' A' ' 23' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_