data_3q6e_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 3q6e _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 ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.291 0 N-CA-C 112.004 -0.438 . . . . 48.869999999999997 112.004 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 10.0 tt -71.68 -49.15 47.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 113.349 0.87 . . . . 61.170000000000002 113.349 -176.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' VAL . . . . . . . . . . . . . 90.0 t -54.19 -31.59 22.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.892 -0.595 . . . . 52.509999999999998 110.186 -179.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 19.0 mp0 -82.06 -55.29 4.66 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.756 -0.656 . . . . 65.799999999999997 110.103 -178.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 42.2 tt0 -57.54 -52.56 64.92 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 114.02 1.119 . . . . 79.5 114.02 -173.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 77.3 m -66.76 -14.3 62.43 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 112.399 0.518 . . . . 38.420000000000002 112.399 -177.445 -58.93 -29.472 -101.432 104.477 2.027 100.946 154.751 -64.735 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 43.0 t -89.47 -54.62 4.0 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 120.232 -0.587 . . . . 49.869999999999997 109.568 176.428 176.906 51.442 93.003 107.19 2.055 107.175 -82.642 -63.03 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.2 p -73.95 -36.98 64.67 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.574 -0.451 . . . . 58.439999999999998 111.724 -176.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 43.7 m -113.16 -160.55 0.72 Allowed 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.346 -0.542 . . . . 60.329999999999998 110.186 173.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 15.3 mt -119.79 120.71 64.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 CA-C-N 115.816 -0.629 . . . . 39.939999999999998 110.476 177.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 89.0 m -88.42 144.8 26.15 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.805 -0.634 . . . . 48.109999999999999 112.279 178.711 -64.735 154.751 -101.432 100.946 2.027 104.477 -29.472 -58.93 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 99.7 p -74.72 162.76 28.4 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 108.561 -0.904 . . . . 44.799999999999997 108.561 170.34 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 49.1 tp -55.06 -43.75 74.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.249 0.547 . . . . 31.93 110.986 178.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.99 -26.44 67.55 Favored 'General case' 0 C--O 1.216 -0.673 0 C-N-CA 118.965 -1.094 . . . . 81.810000000000002 112.507 -174.542 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -65.39 -39.56 92.38 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 120.22 -0.592 . . . . 52.68 110.956 173.847 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 22.0 mt -65.05 -46.32 81.69 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.231 0.539 . . . . 31.27 110.855 176.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -65.66 -16.27 63.58 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.466 -0.788 . . . . 34.450000000000003 112.756 -172.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -64.67 -13.65 54.99 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 113.131 0.789 . . . . 39.75 113.131 173.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -102.76 3.68 37.12 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 114.12 1.155 . . . . 54.170000000000002 114.12 179.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 59.2 m -72.22 147.81 46.14 Favored 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 108.063 -1.088 . . . . 32.920000000000002 108.063 171.04 -55.129 -48.081 -75.668 105.302 2.017 102.375 -61.433 -59.087 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 . . . . . 0 CA--C 1.512 -0.487 0 C-N-CA 120.84 -0.344 . . . . 50.229999999999997 111.438 179.442 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 24.6 p90 . . . . . 0 C--O 1.222 -0.361 0 N-CA-C 112.242 0.46 . . . . 39.979999999999997 112.242 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -86.75 156.81 3.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 107.034 -1.469 . . . . 31.780000000000001 107.034 174.804 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 57.4 t30 48.23 50.94 15.67 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 114.623 1.342 . . . . 51.869999999999997 114.623 -177.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -153.59 162.32 41.36 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 119.738 -0.785 . . . . 41.960000000000001 111.858 172.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -69.6 126.93 31.23 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.327 -0.62 . . . . 42.960000000000001 109.327 173.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 76.9 mt -116.4 96.88 5.73 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 107.402 -1.333 . . . . 26.050000000000001 107.402 179.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 73.1 m -108.3 147.21 31.78 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.575 -0.738 . . . . 46.880000000000003 111.638 -177.977 -63.03 -82.642 93.003 107.175 2.055 107.19 51.442 176.906 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.88 -129.06 46.71 Favored Glycine 0 C--O 1.226 -0.346 0 CA-C-N 115.917 -0.583 . . . . 29.289999999999999 112.681 174.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 90.7 p -63.56 -22.11 66.71 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 119.984 -0.687 . . . . 36.240000000000002 112.503 -175.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 62.2 m-70 -69.39 -30.37 68.33 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 119.971 -0.692 . . . . 40.310000000000002 112.221 -176.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 15.3 tp -67.82 -41.01 83.72 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 119.874 -0.73 . . . . 27.670000000000002 109.277 175.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' VAL . . . . . 0.453 ' CG1' ' CG1' ' D' ' 12' ' ' VAL . 39.0 t -64.45 -39.62 86.19 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 CA-C-O 121.461 0.648 . . . . 23.289999999999999 110.927 178.398 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -61.94 -40.5 95.75 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.194 0.521 . . . . 32.759999999999998 110.874 177.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.4 -47.57 75.84 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.61 -0.723 . . . . 19.07 110.248 179.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 83.8 mt -59.15 -42.08 89.85 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 116.323 -0.399 . . . . 22.84 111.552 178.157 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -59.54 -42.35 92.16 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.65 0.262 . . . . 28.59 110.359 -179.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 80.5 mt -70.29 -48.1 58.22 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-O 121.537 0.684 . . . . 24.98 111.687 -179.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 76.0 t -60.92 -47.86 91.58 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.915 0 N-CA-C 113.122 0.786 . . . . 23.800000000000001 113.122 178.455 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 79.8 m -84.54 -20.15 32.02 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 113.327 0.862 . . . . 23.050000000000001 113.327 -167.445 -59.087 -61.433 -75.668 102.375 2.017 105.302 -48.081 -55.129 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 56.68 -131.65 51.52 Favored Glycine 0 C--O 1.219 -0.785 0 C-N-CA 120.246 -0.978 . . . . 30.27 111.05 174.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' GLU . . . . . 0.603 ' CG ' ' CE ' ' D' ' 29' ' ' LYS . 1.8 tp10 -80.79 -8.35 59.66 Favored 'General case' 0 C--O 1.213 -0.835 0 N-CA-C 113.188 0.81 . . . . 75.209999999999994 113.188 -171.357 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 77.8 mtm180 -63.62 -31.27 72.39 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 122.069 -0.394 . . . . 34.240000000000002 111.16 169.483 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.78 -175.6 26.59 Favored Glycine 0 N--CA 1.452 -0.24 0 N-CA-C 108.495 -1.842 . . . . 27.77 108.495 -170.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.2 p90 -160.3 171.97 18.18 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-O 121.802 0.81 . . . . 27.98 111.099 -169.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 43.3 p90 -126.54 146.97 49.93 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.793 -0.817 . . . . 36.240000000000002 108.793 175.048 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -132.83 122.43 24.44 Favored 'General case' 0 C--O 1.245 0.825 0 N-CA-C 106.65 -1.611 . . . . 29.640000000000001 106.65 -169.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 13.5 p -141.33 91.26 8.73 Favored Pre-proline 0 CA--C 1.514 -0.439 0 CA-C-N 115.787 -0.642 . . . . 50.350000000000001 110.059 -169.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo -58.54 -27.73 83.38 Favored 'Trans proline' 0 CA--C 1.532 0.409 0 C-N-CA 125.027 3.818 . . . . 53.909999999999997 113.251 179.47 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 90.6 mttt . . . . . 0 N--CA 1.47 0.545 0 N-CA-C 113.618 0.97 . . . . 100.83 113.618 -176.35 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.309 0 CA-C-O 121.268 0.371 . . . . 43.039999999999999 113.193 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 2' ' ' ILE . . . . . . . . . . . . . 13.4 tt -56.25 -40.39 65.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 N-CA-C 112.754 0.65 . . . . 34.789999999999999 112.754 -177.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 3' ' ' VAL . . . . . . . . . . . . . 77.3 t -65.0 -45.15 95.5 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 121.645 0.735 . . . . 37.369999999999997 110.441 -178.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 34.6 mp0 -57.47 -49.25 76.89 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.452 -0.794 . . . . 58.149999999999999 110.429 174.459 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 5' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -74.48 -39.0 62.75 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 114.493 1.294 . . . . 56.159999999999997 114.493 -172.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 6' ' ' CYS . . . . . . . . . . . . . 74.2 m -109.93 -23.62 11.25 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 114.656 1.354 . . . . 32.270000000000003 114.656 -172.125 -61.5 -76.417 107.218 98.034 2.059 101.186 -158.609 66.629 1 1 . 1 . 001 ecloud orig full ' C' C ' 7' ' ' CYS . . . . . . . . . . . . . 41.9 t -94.11 -59.85 1.87 Allowed 'General case' 0 CA--C 1.517 -0.295 0 O-C-N 123.336 0.397 . . . . 37.149999999999999 111.573 -178.798 178.002 51.945 96.751 109.805 2.063 110.946 -77.346 -65.58 1 1 . 1 . 001 ecloud orig full ' C' C ' 8' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.19 -43.99 66.33 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 120.216 -0.594 . . . . 59.630000000000003 110.682 -179.616 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 9' ' ' SER . . . . . . . . . . . . . 67.9 m -97.6 -167.32 1.51 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.803 0.335 . . . . 56.759999999999998 110.83 170.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 10' ' ' ILE . . . . . . . . . . . . . 62.0 mt -118.16 129.68 74.14 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.463 0 N-CA-C 107.088 -1.449 . . . . 52.450000000000003 107.088 179.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 11' ' ' CYS . . . . . . . . . . . . . 27.9 p -115.09 161.03 18.93 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 113.727 1.01 . . . . 37.869999999999997 113.727 -174.709 66.629 -158.609 107.218 101.186 2.059 98.034 -76.417 -61.5 1 1 . 1 . 001 ecloud orig full ' C' C ' 12' ' ' SER . . . . . . . . . . . . . 95.8 p -92.18 166.71 12.49 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 107.252 -1.388 . . . . 36.280000000000001 107.252 177.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 4.3 mp -61.28 -35.95 78.73 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.685 0.755 . . . . 51.020000000000003 110.067 176.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 14' ' ' TYR . . . . . . . . . . . . . 28.7 t80 -51.11 -51.76 50.34 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 114.859 -1.064 . . . . 76.480000000000004 110.294 175.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 15' ' ' GLN . . . . . . . . . . . . . 61.2 mt-30 -62.14 -39.93 94.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 58.939999999999998 111.749 179.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 16' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.79 -45.59 91.95 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 120.694 -0.402 . . . . 43.840000000000003 111.015 178.865 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 17' ' ' GLU . . . . . . . . . . . . . 65.7 mt-10 -60.51 -22.07 63.15 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 113.393 0.886 . . . . 64.569999999999993 113.393 -176.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -57.12 -23.74 49.23 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.807 -0.633 . . . . 64.950000000000003 111.608 176.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 19' ' ' TYR . . . . . . . . . . . . . 55.3 m-85 -100.72 2.71 41.64 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 113.891 1.071 . . . . 42.670000000000002 113.891 -178.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 20' ' ' CYS . . . . . . . . . . . . . 63.3 m -67.88 157.73 34.24 Favored 'General case' 0 N--CA 1.461 0.077 0 N-CA-C 107.938 -1.134 . . . . 35.619999999999997 107.938 169.904 -57.021 -49.891 -76.936 105.844 2.026 101.937 -61.33 -59.348 1 1 . 1 . 001 ecloud orig full ' C' C ' 21' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 . . . . . 0 C--N 1.33 -0.268 0 N-CA-C 112.738 0.644 . . . . 54.979999999999997 112.738 175.736 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 1' ' ' PHE . . . . . 0.632 ' N ' ' O05' ' D' ' 31' ' ' QQ7 . 8.3 m-85 . . . . . 0 CA--C 1.522 -0.118 0 CA-C-O 119.811 -0.137 . . . . 65.319999999999993 110.908 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 2' ' ' VAL . . . . . 0.852 ' N ' ' O13' ' D' ' 31' ' ' QQ7 . 3.9 m -91.95 -46.81 14.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 O-C-N 123.531 0.519 . . . . 70.040000000000006 111.32 -179.893 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 3' ' ' ASN . . . . . 0.602 ' O ' ' N ' ' D' ' 5' ' ' HIS . 4.6 m-20 47.6 102.92 0.0 OUTLIER 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 113.542 -1.663 . . . . 64.239999999999995 107.933 -156.234 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 15.79 7.2 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 120.742 3.608 . . . . 63.810000000000002 120.742 166.733 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 5' ' ' HIS . . . . . 0.602 ' N ' ' O ' ' D' ' 3' ' ' ASN . 98.1 m-70 -92.45 136.99 32.75 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 112.297 0.48 . . . . 44.07 112.297 -179.896 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 6' ' ' LEU . . . . . . . . . . . . . 96.1 mt -112.17 108.13 17.27 Favored 'General case' 0 C--O 1.24 0.554 0 N-CA-C 108.92 -0.77 . . . . 31.539999999999999 108.92 176.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 7' ' ' CYS . . . . . . . . . . . . . 99.4 m -128.76 147.29 50.77 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 113.082 0.771 . . . . 43.369999999999997 113.082 -175.589 -65.58 -77.346 96.751 110.946 2.063 109.805 51.945 178.002 1 1 . 1 . 001 ecloud orig full ' D' D ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.23 -130.68 47.85 Favored Glycine 0 N--CA 1.448 -0.531 0 CA-C-N 115.049 -0.978 . . . . 32.409999999999997 112.434 174.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 9' ' ' SER . . . . . . . . . . . . . 79.6 p -55.43 -30.83 61.21 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 113.356 0.873 . . . . 25.02 113.356 -178.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 10' ' ' HIS . . . . . . . . . . . . . 6.7 t-160 -69.69 -29.41 66.82 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 119.73 -0.788 . . . . 52.649999999999999 110.645 -179.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 11' ' ' LEU . . . . . . . . . . . . . 12.0 tp -67.99 -41.26 82.6 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 122.218 1.009 . . . . 29.489999999999998 109.423 -179.061 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 12' ' ' VAL . . . . . 0.453 ' CG1' ' CG1' ' B' ' 12' ' ' VAL . 1.1 t -68.54 -40.34 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.237 0 CA-C-N 114.463 -1.244 . . . . 30.920000000000002 110.494 -179.643 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 26.7 tp10 -62.14 -41.35 98.17 Favored 'General case' 0 C--O 1.221 -0.416 0 O-C-N 122.064 -0.397 . . . . 52.32 111.024 176.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.37 -51.35 69.74 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.82 0.343 . . . . 19.84 110.836 176.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 15' ' ' LEU . . . . . . . . . . . . . 85.1 mt -58.35 -43.52 88.4 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.811 0.339 . . . . 22.559999999999999 111.096 178.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 16' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -58.06 -43.52 86.97 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 120.28 -0.568 . . . . 27.52 109.797 -179.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 17' ' ' LEU . . . . . . . . . . . . . 96.0 mt -70.77 -49.67 44.1 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-O 120.948 0.404 . . . . 23.670000000000002 110.843 -177.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 18' ' ' VAL . . . . . . . . . . . . . 25.0 t -66.77 -37.7 80.02 Favored 'Isoleucine or valine' 0 C--O 1.241 0.618 0 CA-C-N 115.943 -0.572 . . . . 38.490000000000002 112.483 -173.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 19' ' ' CYS . . . . . . . . . . . . . 84.0 m -85.9 -19.98 29.72 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 113.929 1.085 . . . . 29.489999999999998 113.929 -171.529 -59.348 -61.33 -76.936 101.937 2.026 105.844 -49.891 -57.021 1 1 . 1 . 001 ecloud orig full ' D' D ' 20' ' ' GLY . . . . . . . . . . . . . . . 52.03 -131.63 37.09 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 121.399 -0.429 . . . . 31.739999999999998 113.815 176.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -68.42 -22.63 64.6 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 113.242 0.83 . . . . 85.599999999999994 113.242 -173.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 22' ' ' ARG . . . . . . . . . . . . . 58.3 mtm180 -63.46 -33.44 75.56 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.435 0.532 . . . . 43.210000000000001 112.435 175.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.25 -169.5 53.05 Favored Glycine 0 C--O 1.24 0.491 0 N-CA-C 111.244 -0.742 . . . . 29.550000000000001 111.244 -171.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 24' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -154.41 170.57 21.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.247 0.546 . . . . 22.719999999999999 112.447 -173.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 25' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -127.05 114.87 18.34 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 107.456 -1.313 . . . . 45.590000000000003 107.456 177.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 26' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -110.19 115.42 29.68 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.602 -0.726 . . . . 31.170000000000002 112.025 -174.903 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 27' ' ' THR . . . . . 0.447 ' CG2' ' CG2' ' D' ' 30' ' ' THR . 2.2 t -133.53 102.04 12.89 Favored Pre-proline 0 C--N 1.328 -0.36 0 N-CA-C 109.548 -0.538 . . . . 47.700000000000003 109.548 177.774 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 28' ' ' PRO . . . . . . . . . . . . . 16.8 Cg_exo -66.92 -25.87 44.59 Favored 'Trans proline' 0 N--CA 1.464 -0.245 0 O-C-N 122.593 0.786 . . . . 51.109999999999999 111.768 -174.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 29' ' ' LYS . . . . . 0.603 ' CE ' ' CG ' ' B' ' 21' ' ' GLU . 99.2 mttt -93.84 78.61 4.19 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.074 -0.65 . . . . 94.900000000000006 111.12 -177.084 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 30' ' ' THR . . . . . 0.447 ' CG2' ' CG2' ' D' ' 27' ' ' THR . 73.6 p . . . . . 0 CA--C 1.539 0.53 0 CA-C-O 122.276 1.036 . . . . 93.25 110.882 -177.005 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 31' ' ' QQ7 . . . . . 0.852 ' O13' ' N ' ' D' ' 2' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 45' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 55' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 58' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 41' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 42' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 43' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 44' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 45' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 48' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 49' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 53' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 54' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 56' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 57' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.291 0 N-CA-C 112.004 -0.438 . . . . 48.869999999999997 112.004 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ILE . . . . . 0.452 HG23 ' N ' ' A' ' 3' ' ' VAL . 10.0 tt -71.68 -49.15 47.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 113.349 0.87 . . . . 61.170000000000002 113.349 -176.793 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' VAL . . . . . 0.483 HG21 ' HA ' ' B' ' 28' ' ' PRO . 90.0 t -54.19 -31.59 22.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.892 -0.595 . . . . 52.509999999999998 110.186 -179.53 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 19.0 mp0 -82.06 -55.29 4.66 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.756 -0.656 . . . . 65.799999999999997 110.103 -178.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 42.2 tt0 -57.54 -52.56 64.92 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 114.02 1.119 . . . . 79.5 114.02 -173.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 77.3 m -66.76 -14.3 62.43 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 112.399 0.518 . . . . 38.420000000000002 112.399 -177.445 -58.93 -29.472 -101.432 104.477 2.027 100.946 154.751 -64.735 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 43.0 t -89.47 -54.62 4.0 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 120.232 -0.587 . . . . 49.869999999999997 109.568 176.428 176.906 51.442 93.003 107.19 2.055 107.175 -82.642 -63.03 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.2 p -73.95 -36.98 64.67 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.574 -0.451 . . . . 58.439999999999998 111.724 -176.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 43.7 m -113.16 -160.55 0.72 Allowed 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.346 -0.542 . . . . 60.329999999999998 110.186 173.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 15.3 mt -119.79 120.71 64.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 CA-C-N 115.816 -0.629 . . . . 39.939999999999998 110.476 177.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 89.0 m -88.42 144.8 26.15 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.805 -0.634 . . . . 48.109999999999999 112.279 178.711 -64.735 154.751 -101.432 100.946 2.027 104.477 -29.472 -58.93 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 99.7 p -74.72 162.76 28.4 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 108.561 -0.904 . . . . 44.799999999999997 108.561 170.34 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 49.1 tp -55.06 -43.75 74.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.249 0.547 . . . . 31.93 110.986 178.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.99 -26.44 67.55 Favored 'General case' 0 C--O 1.216 -0.673 0 C-N-CA 118.965 -1.094 . . . . 81.810000000000002 112.507 -174.542 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -65.39 -39.56 92.38 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 120.22 -0.592 . . . . 52.68 110.956 173.847 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 22.0 mt -65.05 -46.32 81.69 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.231 0.539 . . . . 31.27 110.855 176.213 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -65.66 -16.27 63.58 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.466 -0.788 . . . . 34.450000000000003 112.756 -172.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 77.9 m-20 -64.67 -13.65 54.99 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 113.131 0.789 . . . . 39.75 113.131 173.485 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -102.76 3.68 37.12 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 114.12 1.155 . . . . 54.170000000000002 114.12 179.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 59.2 m -72.22 147.81 46.14 Favored 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 108.063 -1.088 . . . . 32.920000000000002 108.063 171.04 -55.129 -48.081 -75.668 105.302 2.017 102.375 -61.433 -59.087 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 . . . . . 0 CA--C 1.512 -0.487 0 C-N-CA 120.84 -0.344 . . . . 50.229999999999997 111.438 179.442 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 24.6 p90 . . . . . 0 C--O 1.222 -0.361 0 N-CA-C 112.242 0.46 . . . . 39.979999999999997 112.242 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -86.75 156.81 3.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 107.034 -1.469 . . . . 31.780000000000001 107.034 174.804 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 57.4 t30 48.23 50.94 15.67 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 114.623 1.342 . . . . 51.869999999999997 114.623 -177.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -153.59 162.32 41.36 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 119.738 -0.785 . . . . 41.960000000000001 111.858 172.057 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -69.6 126.93 31.23 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.327 -0.62 . . . . 42.960000000000001 109.327 173.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 76.9 mt -116.4 96.88 5.73 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 107.402 -1.333 . . . . 26.050000000000001 107.402 179.037 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 73.1 m -108.3 147.21 31.78 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.575 -0.738 . . . . 46.880000000000003 111.638 -177.977 -63.03 -82.642 93.003 107.175 2.055 107.19 51.442 176.906 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.88 -129.06 46.71 Favored Glycine 0 C--O 1.226 -0.346 0 CA-C-N 115.917 -0.583 . . . . 29.289999999999999 112.681 174.152 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 90.7 p -63.56 -22.11 66.71 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 119.984 -0.687 . . . . 36.240000000000002 112.503 -175.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 62.2 m-70 -69.39 -30.37 68.33 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 119.971 -0.692 . . . . 40.310000000000002 112.221 -176.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 15.3 tp -67.82 -41.01 83.72 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 119.874 -0.73 . . . . 27.670000000000002 109.277 175.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' VAL . . . . . 0.729 ' CG1' HG13 ' D' ' 12' ' ' VAL . 39.0 t -64.45 -39.62 86.19 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 CA-C-O 121.461 0.648 . . . . 23.289999999999999 110.927 178.398 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -61.94 -40.5 95.75 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.194 0.521 . . . . 32.759999999999998 110.874 177.156 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.4 -47.57 75.84 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.61 -0.723 . . . . 19.07 110.248 179.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 83.8 mt -59.15 -42.08 89.85 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 116.323 -0.399 . . . . 22.84 111.552 178.157 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -59.54 -42.35 92.16 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.65 0.262 . . . . 28.59 110.359 -179.669 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 80.5 mt -70.29 -48.1 58.22 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-O 121.537 0.684 . . . . 24.98 111.687 -179.321 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 76.0 t -60.92 -47.86 91.58 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.915 0 N-CA-C 113.122 0.786 . . . . 23.800000000000001 113.122 178.455 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 79.8 m -84.54 -20.15 32.02 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 113.327 0.862 . . . . 23.050000000000001 113.327 -167.445 -59.087 -61.433 -75.668 102.375 2.017 105.302 -48.081 -55.129 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 56.68 -131.65 51.52 Favored Glycine 0 C--O 1.219 -0.785 0 C-N-CA 120.246 -0.978 . . . . 30.27 111.05 174.644 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' GLU . . . . . 1.1 ' HG2' ' HE3' ' D' ' 29' ' ' LYS . 1.8 tp10 -80.79 -8.35 59.66 Favored 'General case' 0 C--O 1.213 -0.835 0 N-CA-C 113.188 0.81 . . . . 75.209999999999994 113.188 -171.357 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 77.8 mtm180 -63.62 -31.27 72.39 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 122.069 -0.394 . . . . 34.240000000000002 111.16 169.483 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.78 -175.6 26.59 Favored Glycine 0 N--CA 1.452 -0.24 0 N-CA-C 108.495 -1.842 . . . . 27.77 108.495 -170.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.2 p90 -160.3 171.97 18.18 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-O 121.802 0.81 . . . . 27.98 111.099 -169.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 43.3 p90 -126.54 146.97 49.93 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.793 -0.817 . . . . 36.240000000000002 108.793 175.048 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -132.83 122.43 24.44 Favored 'General case' 0 C--O 1.245 0.825 0 N-CA-C 106.65 -1.611 . . . . 29.640000000000001 106.65 -169.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 13.5 p -141.33 91.26 8.73 Favored Pre-proline 0 CA--C 1.514 -0.439 0 CA-C-N 115.787 -0.642 . . . . 50.350000000000001 110.059 -169.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' PRO . . . . . 0.483 ' HA ' HG21 ' A' ' 3' ' ' VAL . 48.6 Cg_exo -58.54 -27.73 83.38 Favored 'Trans proline' 0 CA--C 1.532 0.409 0 C-N-CA 125.027 3.818 . . . . 53.909999999999997 113.251 179.47 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 90.6 mttt . . . . . 0 N--CA 1.47 0.545 0 N-CA-C 113.618 0.97 . . . . 100.83 113.618 -176.35 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 1' ' ' GLY . . . . . 0.792 ' HA3' ' OG1' ' D' ' 30' ' ' THR . . . . . . . . 0 N--CA 1.451 -0.309 0 CA-C-O 121.268 0.371 . . . . 43.039999999999999 113.193 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 2' ' ' ILE . . . . . . . . . . . . . 13.4 tt -56.25 -40.39 65.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 N-CA-C 112.754 0.65 . . . . 34.789999999999999 112.754 -177.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 3' ' ' VAL . . . . . 0.403 ' O ' ' HB3' ' C' ' 7' ' ' CYS . 77.3 t -65.0 -45.15 95.5 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 121.645 0.735 . . . . 37.369999999999997 110.441 -178.264 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 34.6 mp0 -57.47 -49.25 76.89 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.452 -0.794 . . . . 58.149999999999999 110.429 174.459 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 5' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -74.48 -39.0 62.75 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 114.493 1.294 . . . . 56.159999999999997 114.493 -172.475 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 6' ' ' CYS . . . . . . . . . . . . . 74.2 m -109.93 -23.62 11.25 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 114.656 1.354 . . . . 32.270000000000003 114.656 -172.125 -61.5 -76.417 107.218 98.034 2.059 101.186 -158.609 66.629 1 1 . 1 . 001 ecloud build full ' C' C ' 7' ' ' CYS . . . . . 0.452 ' O ' ' HD2' ' D' ' 5' ' ' HIS . 41.9 t -94.11 -59.85 1.87 Allowed 'General case' 0 CA--C 1.517 -0.295 0 O-C-N 123.336 0.397 . . . . 37.149999999999999 111.573 -178.798 178.002 51.945 96.751 109.805 2.063 110.946 -77.346 -65.58 2 2 . 1 . 001 ecloud build full ' C' C ' 8' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.19 -43.99 66.33 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 120.216 -0.594 . . . . 59.630000000000003 110.682 -179.616 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 9' ' ' SER . . . . . 0.423 ' HB3' ' O ' ' C' ' 39' ' ' HOH . 67.9 m -97.6 -167.32 1.51 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.803 0.335 . . . . 56.759999999999998 110.83 170.301 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 10' ' ' ILE . . . . . . . . . . . . . 62.0 mt -118.16 129.68 74.14 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.463 0 N-CA-C 107.088 -1.449 . . . . 52.450000000000003 107.088 179.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 11' ' ' CYS . . . . . 0.579 ' SG ' HD22 ' C' ' 16' ' ' LEU . 27.9 p -115.09 161.03 18.93 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 113.727 1.01 . . . . 37.869999999999997 113.727 -174.709 66.629 -158.609 107.218 101.186 2.059 98.034 -76.417 -61.5 2 2 . 1 . 001 ecloud build full ' C' C ' 12' ' ' SER . . . . . . . . . . . . . 95.8 p -92.18 166.71 12.49 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 107.252 -1.388 . . . . 36.280000000000001 107.252 177.255 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 4.3 mp -61.28 -35.95 78.73 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.685 0.755 . . . . 51.020000000000003 110.067 176.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 14' ' ' TYR . . . . . . . . . . . . . 28.7 t80 -51.11 -51.76 50.34 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 114.859 -1.064 . . . . 76.480000000000004 110.294 175.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 15' ' ' GLN . . . . . . . . . . . . . 61.2 mt-30 -62.14 -39.93 94.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 58.939999999999998 111.749 179.127 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 16' ' ' LEU . . . . . 0.579 HD22 ' SG ' ' C' ' 11' ' ' CYS . 0.1 OUTLIER -62.79 -45.59 91.95 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 120.694 -0.402 . . . . 43.840000000000003 111.015 178.865 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 17' ' ' GLU . . . . . . . . . . . . . 65.7 mt-10 -60.51 -22.07 63.15 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 113.393 0.886 . . . . 64.569999999999993 113.393 -176.046 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -57.12 -23.74 49.23 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.807 -0.633 . . . . 64.950000000000003 111.608 176.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 19' ' ' TYR . . . . . . . . . . . . . 55.3 m-85 -100.72 2.71 41.64 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 113.891 1.071 . . . . 42.670000000000002 113.891 -178.456 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 20' ' ' CYS . . . . . . . . . . . . . 63.3 m -67.88 157.73 34.24 Favored 'General case' 0 N--CA 1.461 0.077 0 N-CA-C 107.938 -1.134 . . . . 35.619999999999997 107.938 169.904 -57.021 -49.891 -76.936 105.844 2.026 101.937 -61.33 -59.348 1 1 . 1 . 001 ecloud build full ' C' C ' 21' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 . . . . . 0 C--N 1.33 -0.268 0 N-CA-C 112.738 0.644 . . . . 54.979999999999997 112.738 175.736 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 1' ' ' PHE . . . . . 0.632 ' N ' ' O05' ' D' ' 31' ' ' QQ7 . 8.3 m-85 . . . . . 0 CA--C 1.522 -0.118 0 CA-C-O 119.811 -0.137 . . . . 65.319999999999993 110.908 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 2' ' ' VAL . . . . . 0.852 ' N ' ' O13' ' D' ' 31' ' ' QQ7 . 3.9 m -91.95 -46.81 14.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 O-C-N 123.531 0.519 . . . . 70.040000000000006 111.32 -179.893 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 3' ' ' ASN . . . . . 0.602 ' O ' ' N ' ' D' ' 5' ' ' HIS . 4.6 m-20 47.6 102.92 0.0 OUTLIER 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 113.542 -1.663 . . . . 64.239999999999995 107.933 -156.234 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 15.79 7.2 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 120.742 3.608 . . . . 63.810000000000002 120.742 166.733 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 5' ' ' HIS . . . . . 0.602 ' N ' ' O ' ' D' ' 3' ' ' ASN . 98.1 m-70 -92.45 136.99 32.75 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 112.297 0.48 . . . . 44.289999999999999 112.297 -179.896 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 6' ' ' LEU . . . . . . . . . . . . . 96.1 mt -112.17 108.13 17.27 Favored 'General case' 0 C--O 1.24 0.554 0 N-CA-C 108.92 -0.77 . . . . 31.539999999999999 108.92 176.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 7' ' ' CYS . . . . . . . . . . . . . 99.4 m -128.76 147.29 50.77 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 113.082 0.771 . . . . 43.369999999999997 113.082 -175.589 -65.58 -77.346 96.751 110.946 2.063 109.805 51.945 178.002 1 1 . 1 . 001 ecloud build full ' D' D ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.23 -130.68 47.85 Favored Glycine 0 N--CA 1.448 -0.531 0 CA-C-N 115.049 -0.978 . . . . 32.409999999999997 112.434 174.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 9' ' ' SER . . . . . . . . . . . . . 79.6 p -55.43 -30.83 61.21 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 113.356 0.873 . . . . 25.02 113.356 -178.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 10' ' ' HIS . . . . . . . . . . . . . 6.7 t-160 -69.69 -29.41 66.82 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 119.73 -0.788 . . . . 52.649999999999999 110.645 -179.028 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 11' ' ' LEU . . . . . . . . . . . . . 12.0 tp -67.99 -41.26 82.6 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 122.218 1.009 . . . . 29.489999999999998 109.423 -179.061 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 12' ' ' VAL . . . . . 0.729 HG13 ' CG1' ' B' ' 12' ' ' VAL . 1.1 t -68.54 -40.34 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.237 0 CA-C-N 114.463 -1.244 . . . . 30.920000000000002 110.494 -179.643 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 26.7 tp10 -62.14 -41.35 98.17 Favored 'General case' 0 C--O 1.221 -0.416 0 O-C-N 122.064 -0.397 . . . . 52.32 111.024 176.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.37 -51.35 69.74 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.82 0.343 . . . . 19.84 110.836 176.418 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 15' ' ' LEU . . . . . . . . . . . . . 85.1 mt -58.35 -43.52 88.4 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.811 0.339 . . . . 22.559999999999999 111.096 178.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 16' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -58.06 -43.52 86.97 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 120.28 -0.568 . . . . 27.52 109.797 -179.044 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 17' ' ' LEU . . . . . . . . . . . . . 96.0 mt -70.77 -49.67 44.1 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-O 120.948 0.404 . . . . 23.670000000000002 110.843 -177.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 18' ' ' VAL . . . . . . . . . . . . . 25.0 t -66.77 -37.7 80.02 Favored 'Isoleucine or valine' 0 C--O 1.241 0.618 0 CA-C-N 115.943 -0.572 . . . . 38.490000000000002 112.483 -173.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 19' ' ' CYS . . . . . . . . . . . . . 84.0 m -85.9 -19.98 29.72 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 113.929 1.085 . . . . 29.489999999999998 113.929 -171.529 -59.348 -61.33 -76.936 101.937 2.026 105.844 -49.891 -57.021 1 1 . 1 . 001 ecloud build full ' D' D ' 20' ' ' GLY . . . . . . . . . . . . . . . 52.03 -131.63 37.09 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 121.399 -0.429 . . . . 31.739999999999998 113.815 176.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -68.42 -22.63 64.6 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 113.242 0.83 . . . . 85.599999999999994 113.242 -173.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 22' ' ' ARG . . . . . . . . . . . . . 58.3 mtm180 -63.46 -33.44 75.56 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.435 0.532 . . . . 43.210000000000001 112.435 175.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.25 -169.5 53.05 Favored Glycine 0 C--O 1.24 0.491 0 N-CA-C 111.244 -0.742 . . . . 29.550000000000001 111.244 -171.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 24' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -154.41 170.57 21.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.247 0.546 . . . . 22.719999999999999 112.447 -173.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 25' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -127.05 114.87 18.34 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 107.456 -1.313 . . . . 45.590000000000003 107.456 177.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 26' ' ' TYR . . . . . 0.564 ' CZ ' ' HG3' ' D' ' 28' ' ' PRO . 39.2 t80 -110.19 115.42 29.68 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.602 -0.726 . . . . 31.170000000000002 112.025 -174.903 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 27' ' ' THR . . . . . 0.855 HG23 HG21 ' D' ' 30' ' ' THR . 2.2 t -133.53 102.04 12.89 Favored Pre-proline 0 C--N 1.328 -0.36 0 N-CA-C 109.548 -0.538 . . . . 47.700000000000003 109.548 177.774 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 28' ' ' PRO . . . . . 0.564 ' HG3' ' CZ ' ' D' ' 26' ' ' TYR . 16.8 Cg_exo -66.92 -25.87 44.59 Favored 'Trans proline' 0 N--CA 1.464 -0.245 0 O-C-N 122.593 0.786 . . . . 51.109999999999999 111.768 -174.498 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 29' ' ' LYS . . . . . 1.1 ' HE3' ' HG2' ' B' ' 21' ' ' GLU . 99.2 mttt -93.84 78.61 4.19 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.074 -0.65 . . . . 94.900000000000006 111.12 -177.084 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 30' ' ' THR . . . . . 0.855 HG21 HG23 ' D' ' 27' ' ' THR . 73.6 p . . . . . 0 CA--C 1.539 0.53 0 CA-C-O 122.276 1.036 . . . . 93.25 110.882 -177.005 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 31' ' ' QQ7 . . . . . 0.852 ' O13' ' N ' ' D' ' 2' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 44' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 52' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 59' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 41' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 42' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 43' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 46' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 47' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 50' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 51' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 39' ' ' HOH . . . . . 0.423 ' O ' ' HB3' ' C' ' 9' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 45' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 55' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 58' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 41' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 42' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 43' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 44' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 45' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 48' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 49' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 53' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 54' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 56' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 57' ' ' HOH . . . . . 0.68 ' O ' ' H9 ' ' D' ' 31' ' ' QQ7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.291 0 N-CA-C 112.004 -0.438 . . . . 48.87 112.004 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ILE . . . . . 0.452 HG23 ' N ' ' A' ' 3' ' ' VAL . 10.0 tt -71.68 -49.15 47.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 N-CA-C 113.349 0.87 . . . . 61.17 113.349 -176.793 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' VAL . . . . . 0.483 HG21 ' HA ' ' B' ' 28' ' ' PRO . 90.0 t -54.19 -31.59 22.15 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.408 0 CA-C-N 115.892 -0.595 . . . . 52.51 110.186 -179.53 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 19.0 mp0 -82.06 -55.29 4.66 Favored 'General case' 0 C--N 1.325 -0.493 0 CA-C-N 115.756 -0.656 . . . . 65.8 110.103 -178.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 42.2 tt0 -57.54 -52.56 64.92 Favored 'General case' 0 C--N 1.324 -0.514 0 N-CA-C 114.02 1.119 . . . . 79.5 114.02 -173.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' CYS . . . . . . . . . . . . . 77.3 m -66.76 -14.3 62.43 Favored 'General case' 0 CA--C 1.511 -0.539 0 N-CA-C 112.399 0.518 . . . . 38.42 112.399 -177.445 -58.93 -29.472 -101.432 104.477 2.027 100.946 154.751 -64.735 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' CYS . . . . . . . . . . . . . 43.0 t -89.47 -54.62 4.0 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 120.232 -0.587 . . . . 49.87 109.568 176.428 176.906 51.442 93.003 107.19 2.055 107.175 -82.642 -63.03 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 19.2 p -73.95 -36.98 64.67 Favored 'General case' 0 C--N 1.327 -0.39 0 C-N-CA 120.574 -0.451 . . . . 58.44 111.724 -176.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 43.7 m -113.16 -160.55 0.72 Allowed 'General case' 0 C--N 1.326 -0.425 0 C-N-CA 120.346 -0.542 . . . . 60.33 110.186 173.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 15.3 mt -119.79 120.71 64.12 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.443 0 CA-C-N 115.816 -0.629 . . . . 39.94 110.476 177.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 89.0 m -88.42 144.8 26.15 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 115.805 -0.634 . . . . 48.11 112.279 178.711 -64.735 154.751 -101.432 100.946 2.027 104.477 -29.472 -58.93 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 99.7 p -74.72 162.76 28.4 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 108.561 -0.904 . . . . 44.8 108.561 170.34 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 49.1 tp -55.06 -43.75 74.13 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 121.249 0.547 . . . . 31.93 110.986 178.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -65.99 -26.44 67.55 Favored 'General case' 0 C--O 1.216 -0.673 0 C-N-CA 118.965 -1.094 . . . . 81.81 112.507 -174.542 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLN . . . . . . . . . . . . . 97.8 mt-30 -65.39 -39.56 92.38 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 120.22 -0.592 . . . . 52.68 110.956 173.847 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LEU . . . . . . . . . . . . . 22.0 mt -65.05 -46.32 81.69 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-O 121.231 0.539 . . . . 31.27 110.855 176.213 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.4 tt0 -65.66 -16.27 63.58 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.466 -0.788 . . . . 34.45 112.756 -172.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ASN . . . . . . . . . . . . . 5.4 m120 -64.67 -13.65 54.99 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 113.131 0.789 . . . . 39.75 113.131 173.485 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 51.5 m-85 -102.76 3.68 37.12 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 114.12 1.155 . . . . 54.17 114.12 179.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' CYS . . . . . . . . . . . . . 59.2 m -72.22 147.81 46.14 Favored 'General case' 0 N--CA 1.463 0.201 0 N-CA-C 108.063 -1.088 . . . . 32.92 108.063 171.04 -55.129 -48.081 -75.668 105.302 2.017 102.375 -61.433 -59.087 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 86.2 m-20 . . . . . 0 CA--C 1.512 -0.487 0 C-N-CA 120.84 -0.344 . . . . 50.23 111.438 179.442 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' PHE . . . . . . . . . . . . . 24.6 p90 . . . . . 0 C--O 1.222 -0.361 0 N-CA-C 112.242 0.46 . . . . 39.98 112.242 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -86.75 156.81 3.28 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 N-CA-C 107.034 -1.469 . . . . 31.78 107.034 174.804 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' ASN . . . . . . . . . . . . . 57.4 t30 48.23 50.94 15.67 Favored 'General case' 0 C--N 1.326 -0.428 0 N-CA-C 114.623 1.342 . . . . 51.87 114.623 -177.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -153.59 162.32 41.36 Favored 'General case' 0 C--N 1.328 -0.346 0 C-N-CA 119.738 -0.785 . . . . 41.96 111.858 172.057 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' HIS . . . . . . . . . . . . . 95.0 m-70 -69.6 126.93 31.23 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 109.327 -0.62 . . . . 42.96 109.327 173.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 76.9 mt -116.4 96.88 5.73 Favored 'General case' 0 N--CA 1.447 -0.612 0 N-CA-C 107.402 -1.333 . . . . 26.05 107.402 179.037 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' CYS . . . . . . . . . . . . . 73.1 m -108.3 147.21 31.78 Favored 'General case' 0 C--N 1.32 -0.691 0 CA-C-N 115.575 -0.738 . . . . 46.88 111.638 -177.977 -63.03 -82.642 93.003 107.175 2.055 107.19 51.442 176.906 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.88 -129.06 46.71 Favored Glycine 0 C--O 1.226 -0.346 0 CA-C-N 115.917 -0.583 . . . . 29.29 112.681 174.152 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' SER . . . . . . . . . . . . . 90.7 p -63.56 -22.11 66.71 Favored 'General case' 0 C--N 1.325 -0.464 0 C-N-CA 119.984 -0.687 . . . . 36.24 112.503 -175.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' HIS . . . . . . . . . . . . . 62.2 m-70 -69.39 -30.37 68.33 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 119.971 -0.692 . . . . 40.31 112.221 -176.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' LEU . . . . . . . . . . . . . 15.3 tp -67.82 -41.01 83.72 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 119.874 -0.73 . . . . 27.67 109.277 175.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' VAL . . . . . 0.729 ' CG1' HG13 ' D' ' 12' ' ' VAL . 39.0 t -64.45 -39.62 86.19 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.799 0 CA-C-O 121.461 0.648 . . . . 23.29 110.927 178.398 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' GLU . . . . . . . . . . . . . 92.7 mt-10 -61.94 -40.5 95.75 Favored 'General case' 0 C--N 1.324 -0.501 0 CA-C-O 121.194 0.521 . . . . 32.76 110.874 177.156 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.4 -47.57 75.84 Favored 'General case' 0 C--O 1.234 0.282 0 CA-C-N 115.61 -0.723 . . . . 19.07 110.248 179.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 83.8 mt -59.15 -42.08 89.85 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-N 116.323 -0.399 . . . . 22.84 111.552 178.157 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' TYR . . . . . . . . . . . . . 56.3 t80 -59.54 -42.35 92.16 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-O 120.65 0.262 . . . . 28.59 110.359 -179.669 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 80.5 mt -70.29 -48.1 58.22 Favored 'General case' 0 C--O 1.223 -0.322 0 CA-C-O 121.537 0.684 . . . . 24.98 111.687 -179.321 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' VAL . . . . . . . . . . . . . 76.0 t -60.92 -47.86 91.58 Favored 'Isoleucine or valine' 0 C--N 1.315 -0.915 0 N-CA-C 113.122 0.786 . . . . 23.8 113.122 178.455 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' CYS . . . . . . . . . . . . . 79.8 m -84.54 -20.15 32.02 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 113.327 0.862 . . . . 23.05 113.327 -167.445 -59.087 -61.433 -75.668 102.375 2.017 105.302 -48.081 -55.129 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' GLY . . . . . . . . . . . . . . . 56.68 -131.65 51.52 Favored Glycine 0 C--O 1.219 -0.785 0 C-N-CA 120.246 -0.978 . . . . 30.27 111.05 174.644 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' GLU . . . . . 1.1 ' HG2' ' HE3' ' D' ' 29' ' ' LYS . 1.8 tp10 -80.79 -8.35 59.66 Favored 'General case' 0 C--O 1.213 -0.835 0 N-CA-C 113.188 0.81 . . . . 75.21 113.188 -171.357 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' ARG . . . . . . . . . . . . . 77.8 mtm180 -63.62 -31.27 72.39 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 122.069 -0.394 . . . . 34.24 111.16 169.483 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . 67.78 -175.6 26.59 Favored Glycine 0 N--CA 1.452 -0.24 0 N-CA-C 108.495 -1.842 . . . . 27.77 108.495 -170.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' PHE . . . . . . . . . . . . . 54.2 p90 -160.3 171.97 18.18 Favored 'General case' 0 C--O 1.242 0.696 0 CA-C-O 121.802 0.81 . . . . 27.98 111.099 -169.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' PHE . . . . . . . . . . . . . 43.3 p90 -126.54 146.97 49.93 Favored 'General case' 0 C--N 1.323 -0.566 0 N-CA-C 108.793 -0.817 . . . . 36.24 108.793 175.048 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -132.83 122.43 24.44 Favored 'General case' 0 C--O 1.245 0.825 0 N-CA-C 106.65 -1.611 . . . . 29.64 106.65 -169.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' THR . . . . . . . . . . . . . 13.5 p -141.33 91.26 8.73 Favored Pre-proline 0 CA--C 1.514 -0.439 0 CA-C-N 115.787 -0.642 . . . . 50.35 110.059 -169.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' PRO . . . . . 0.483 ' HA ' HG21 ' A' ' 3' ' ' VAL . 48.6 Cg_exo -58.54 -27.73 83.38 Favored 'Trans proline' 0 CA--C 1.532 0.409 0 C-N-CA 125.027 3.818 . . . . 53.91 113.251 179.47 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' LYS . . . . . . . . . . . . . 90.6 mttt . . . . . 0 N--CA 1.47 0.545 0 N-CA-C 113.618 0.97 . . . . 100.83 113.618 -176.35 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 1' ' ' GLY . . . . . 0.792 ' HA3' ' OG1' ' D' ' 30' ' ' THR . . . . . . . . 0 N--CA 1.451 -0.309 0 CA-C-O 121.268 0.371 . . . . 43.04 113.193 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 2' ' ' ILE . . . . . . . . . . . . . 13.4 tt -56.25 -40.39 65.44 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.388 0 N-CA-C 112.754 0.65 . . . . 34.79 112.754 -177.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 3' ' ' VAL . . . . . 0.403 ' O ' ' HB3' ' C' ' 7' ' ' CYS . 77.3 t -65.0 -45.15 95.5 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.337 0 CA-C-O 121.645 0.735 . . . . 37.37 110.441 -178.264 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 4' ' ' GLU . . . . . . . . . . . . . 34.6 mp0 -57.47 -49.25 76.89 Favored 'General case' 0 C--N 1.324 -0.52 0 CA-C-N 115.452 -0.794 . . . . 58.15 110.429 174.459 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 5' ' ' GLN . . . . . . . . . . . . . 82.3 mt-30 -74.48 -39.0 62.75 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 114.493 1.294 . . . . 56.16 114.493 -172.475 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 6' ' ' CYS . . . . . . . . . . . . . 74.2 m -109.93 -23.62 11.25 Favored 'General case' 0 C--O 1.238 0.483 0 N-CA-C 114.656 1.354 . . . . 32.27 114.656 -172.125 -61.5 -76.417 107.218 98.034 2.059 101.186 -158.609 66.629 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 7' ' ' CYS . . . . . 0.452 ' O ' ' HD2' ' D' ' 5' ' ' HIS . 41.9 t -94.11 -59.85 1.87 Allowed 'General case' 0 CA--C 1.517 -0.295 0 O-C-N 123.336 0.397 . . . . 37.15 111.573 -178.798 178.002 51.945 96.751 109.805 2.063 110.946 -77.346 -65.58 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 8' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -71.19 -43.99 66.33 Favored 'General case' 0 C--O 1.221 -0.432 0 C-N-CA 120.216 -0.594 . . . . 59.63 110.682 -179.616 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 9' ' ' SER . . . . . 0.423 ' HB3' ' O ' ' C' ' 39' ' ' HOH . 67.9 m -97.6 -167.32 1.51 Allowed 'General case' 0 C--N 1.33 -0.248 0 CA-C-O 120.803 0.335 . . . . 56.76 110.83 170.301 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 10' ' ' ILE . . . . . . . . . . . . . 62.0 mt -118.16 129.68 74.14 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.463 0 N-CA-C 107.088 -1.449 . . . . 52.45 107.088 179.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 11' ' ' CYS . . . . . 0.579 ' SG ' HD22 ' C' ' 16' ' ' LEU . 27.9 p -115.09 161.03 18.93 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 113.727 1.01 . . . . 37.87 113.727 -174.709 66.629 -158.609 107.218 101.186 2.059 98.034 -76.417 -61.5 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 12' ' ' SER . . . . . . . . . . . . . 95.8 p -92.18 166.71 12.49 Favored 'General case' 0 C--O 1.237 0.416 0 N-CA-C 107.252 -1.388 . . . . 36.28 107.252 177.255 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 13' ' ' LEU . . . . . . . . . . . . . 4.3 mp -61.28 -35.95 78.73 Favored 'General case' 0 N--CA 1.472 0.654 0 CA-C-O 121.685 0.755 . . . . 51.02 110.067 176.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 14' ' ' TYR . . . . . . . . . . . . . 28.7 t80 -51.11 -51.76 50.34 Favored 'General case' 0 C--N 1.322 -0.61 0 CA-C-N 114.859 -1.064 . . . . 76.48 110.294 175.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 15' ' ' GLN . . . . . . . . . . . . . 61.2 mt-30 -62.14 -39.93 94.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.189 -0.46 . . . . 58.94 111.749 179.127 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 16' ' ' LEU . . . . . 0.579 HD22 ' SG ' ' C' ' 11' ' ' CYS . 0.1 OUTLIER -62.79 -45.59 91.95 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 120.694 -0.402 . . . . 43.84 111.015 178.865 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 17' ' ' GLU . . . . . . . . . . . . . 65.7 mt-10 -60.51 -22.07 63.15 Favored 'General case' 0 CA--C 1.507 -0.703 0 N-CA-C 113.393 0.886 . . . . 64.57 113.393 -176.046 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . 59.9 t30 -57.12 -23.74 49.23 Favored 'General case' 0 C--N 1.322 -0.628 0 CA-C-N 115.807 -0.633 . . . . 64.95 111.608 176.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 19' ' ' TYR . . . . . . . . . . . . . 55.3 m-85 -100.72 2.71 41.64 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 113.891 1.071 . . . . 42.67 113.891 -178.456 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 20' ' ' CYS . . . . . . . . . . . . . 63.3 m -67.88 157.73 34.24 Favored 'General case' 0 N--CA 1.461 0.077 0 N-CA-C 107.938 -1.134 . . . . 35.62 107.938 169.904 -57.021 -49.891 -76.936 105.844 2.026 101.937 -61.33 -59.348 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 21' ' ' ASN . . . . . . . . . . . . . 87.2 m-20 . . . . . 0 C--N 1.33 -0.268 0 N-CA-C 112.738 0.644 . . . . 54.98 112.738 175.736 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 1' ' ' PHE . . . . . 0.632 ' N ' ' O05' ' D' ' 31' ' ' QQ7 . 8.3 m-85 . . . . . 0 CA--C 1.522 -0.118 0 CA-C-O 119.811 -0.137 . . . . 65.32 110.908 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 2' ' ' VAL . . . . . 0.852 ' N ' ' O13' ' D' ' 31' ' ' QQ7 . 3.9 m -91.95 -46.81 14.28 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 O-C-N 123.531 0.519 . . . . 70.04 111.32 -179.893 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 3' ' ' ASN . . . . . 0.602 ' O ' ' N ' ' D' ' 5' ' ' HIS . 4.6 m-20 47.6 102.92 0.0 OUTLIER 'General case' 0 N--CA 1.444 -0.746 0 CA-C-N 113.542 -1.663 . . . . 64.24 107.933 -156.234 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 15.79 7.2 0.0 OUTLIER 'General case' 0 C--N 1.315 -0.916 0 N-CA-C 120.742 3.608 . . . . 63.81 120.742 166.733 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 5' ' ' HIS . . . . . 0.602 ' N ' ' O ' ' D' ' 3' ' ' ASN . 98.1 m-70 -92.45 136.99 32.75 Favored 'General case' 0 CA--C 1.533 0.315 0 N-CA-C 112.297 0.48 . . . . 44.29 112.297 -179.896 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 6' ' ' LEU . . . . . . . . . . . . . 96.1 mt -112.17 108.13 17.27 Favored 'General case' 0 C--O 1.24 0.554 0 N-CA-C 108.92 -0.77 . . . . 31.54 108.92 176.476 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 7' ' ' CYS . . . . . . . . . . . . . 99.4 m -128.76 147.29 50.77 Favored 'General case' 0 C--N 1.327 -0.403 0 N-CA-C 113.082 0.771 . . . . 43.37 113.082 -175.589 -65.58 -77.346 96.751 110.946 2.063 109.805 51.945 178.002 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 8' ' ' GLY . . . . . . . . . . . . . . . 55.23 -130.68 47.85 Favored Glycine 0 N--CA 1.448 -0.531 0 CA-C-N 115.049 -0.978 . . . . 32.41 112.434 174.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 9' ' ' SER . . . . . . . . . . . . . 79.6 p -55.43 -30.83 61.21 Favored 'General case' 0 C--N 1.328 -0.327 0 N-CA-C 113.356 0.873 . . . . 25.02 113.356 -178.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 10' ' ' HIS . . . . . . . . . . . . . 6.7 t-160 -69.69 -29.41 66.82 Favored 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 119.73 -0.788 . . . . 52.65 110.645 -179.028 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 11' ' ' LEU . . . . . . . . . . . . . 12.0 tp -67.99 -41.26 82.6 Favored 'General case' 0 C--N 1.325 -0.468 0 CA-C-O 122.218 1.009 . . . . 29.49 109.423 -179.061 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 12' ' ' VAL . . . . . 0.729 HG13 ' CG1' ' B' ' 12' ' ' VAL . 1.1 t -68.54 -40.34 81.84 Favored 'Isoleucine or valine' 0 N--CA 1.434 -1.237 0 CA-C-N 114.463 -1.244 . . . . 30.92 110.494 -179.643 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 13' ' ' GLU . . . . . . . . . . . . . 26.7 tp10 -62.14 -41.35 98.17 Favored 'General case' 0 C--O 1.221 -0.416 0 O-C-N 122.064 -0.397 . . . . 52.32 111.024 176.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 14' ' ' ALA . . . . . . . . . . . . . . . -57.37 -51.35 69.74 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-O 120.82 0.343 . . . . 19.84 110.836 176.418 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 15' ' ' LEU . . . . . . . . . . . . . 85.1 mt -58.35 -43.52 88.4 Favored 'General case' 0 N--CA 1.465 0.314 0 CA-C-O 120.811 0.339 . . . . 22.56 111.096 178.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 16' ' ' TYR . . . . . . . . . . . . . 32.2 t80 -58.06 -43.52 86.97 Favored 'General case' 0 N--CA 1.443 -0.813 0 C-N-CA 120.28 -0.568 . . . . 27.52 109.797 -179.044 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 17' ' ' LEU . . . . . . . . . . . . . 96.0 mt -70.77 -49.67 44.1 Favored 'General case' 0 C--O 1.22 -0.48 0 CA-C-O 120.948 0.404 . . . . 23.67 110.843 -177.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 18' ' ' VAL . . . . . . . . . . . . . 25.0 t -66.77 -37.7 80.02 Favored 'Isoleucine or valine' 0 C--O 1.241 0.618 0 CA-C-N 115.943 -0.572 . . . . 38.49 112.483 -173.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 19' ' ' CYS . . . . . . . . . . . . . 84.0 m -85.9 -19.98 29.72 Favored 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 113.929 1.085 . . . . 29.49 113.929 -171.529 -59.348 -61.33 -76.936 101.937 2.026 105.844 -49.891 -57.021 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 20' ' ' GLY . . . . . . . . . . . . . . . 52.03 -131.63 37.09 Favored Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 121.399 -0.429 . . . . 31.74 113.815 176.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 21' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -68.42 -22.63 64.6 Favored 'General case' 0 N--CA 1.466 0.373 0 N-CA-C 113.242 0.83 . . . . 85.6 113.242 -173.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 22' ' ' ARG . . . . . . . . . . . . . 58.3 mtm180 -63.46 -33.44 75.56 Favored 'General case' 0 C--N 1.325 -0.462 0 N-CA-C 112.435 0.532 . . . . 43.21 112.435 175.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 23' ' ' GLY . . . . . . . . . . . . . . . 73.25 -169.5 53.05 Favored Glycine 0 C--O 1.24 0.491 0 N-CA-C 111.244 -0.742 . . . . 29.55 111.244 -171.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 24' ' ' PHE . . . . . . . . . . . . . 51.9 p90 -154.41 170.57 21.05 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 121.247 0.546 . . . . 22.72 112.447 -173.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 25' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -127.05 114.87 18.34 Favored 'General case' 0 C--N 1.324 -0.517 0 N-CA-C 107.456 -1.313 . . . . 45.59 107.456 177.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 26' ' ' TYR . . . . . 0.564 ' CZ ' ' HG3' ' D' ' 28' ' ' PRO . 39.2 t80 -110.19 115.42 29.68 Favored 'General case' 0 C--N 1.324 -0.515 0 CA-C-N 115.602 -0.726 . . . . 31.17 112.025 -174.903 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 27' ' ' THR . . . . . 0.855 HG23 HG21 ' D' ' 30' ' ' THR . 2.2 t -133.53 102.04 12.89 Favored Pre-proline 0 C--N 1.328 -0.36 0 N-CA-C 109.548 -0.538 . . . . 47.7 109.548 177.774 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 28' ' ' PRO . . . . . 0.564 ' HG3' ' CZ ' ' D' ' 26' ' ' TYR . 16.8 Cg_exo -66.92 -25.87 44.59 Favored 'Trans proline' 0 N--CA 1.464 -0.245 0 O-C-N 122.593 0.786 . . . . 51.11 111.768 -174.498 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 29' ' ' LYS . . . . . 1.1 ' HE3' ' HG2' ' B' ' 21' ' ' GLU . 99.2 mttt -93.84 78.61 4.19 Favored 'General case' 0 C--N 1.327 -0.392 0 C-N-CA 120.074 -0.65 . . . . 94.9 111.12 -177.084 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 30' ' ' THR . . . . . 0.855 HG21 HG23 ' D' ' 27' ' ' THR . 73.6 p . . . . . 0 CA--C 1.539 0.53 0 CA-C-O 122.276 1.036 . . . . 93.25 110.882 -177.005 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 31' ' ' QQ7 . . . . . 0.852 ' O13' ' N ' ' D' ' 2' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 22' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 23' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 24' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 25' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 26' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 27' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 31' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 39' ' ' HOH . . . . . 0.423 ' O ' ' HB3' ' C' ' 9' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 45' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 55' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 58' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 32' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 33' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 34' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 35' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 36' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 37' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 38' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 39' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 40' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 41' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 42' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 43' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 44' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 45' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 48' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 49' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 53' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 54' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 56' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 57' ' ' HOH . . . . . 0.68 ' O ' ' H9 ' ' D' ' 31' ' ' QQ7 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_