data_3hry_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 3hry _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' ' ' MET . . . . . 0.64 ' O ' ' O ' ' A' ' 80' ' ' HOH . 5.1 ttt . . . . . 0 C--O 1.221 -0.43 0 N-CA-C 111.473 0.175 . . . . 180.06999999999999 111.473 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -62.8 144.29 56.67 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.109 1.763 . . . . 108.23999999999999 109.714 178.216 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 32.3 t -135.76 118.32 15.91 Favored 'General case' 0 CA--C 1.518 -0.266 0 C-N-CA 120.786 -0.365 . . . . 82.390000000000001 111.59 -179.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ILE . . . . . 0.421 ' CD1' ' CG1' ' A' ' 26' ' ' VAL . 1.5 pt -127.14 164.58 27.6 Favored 'Isoleucine or valine' 0 C--O 1.184 -2.382 0 C-N-CA 122.716 0.407 . . . . 86.439999999999998 111.811 -179.419 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ASN . . . . . 0.483 ' OD1' ' N ' ' A' ' 7' ' ' ARG . 4.5 p30 -86.62 169.94 12.28 Favored 'General case' 0 C--N 1.313 -1.007 0 C-N-CA 124.185 0.994 . . . . 74.109999999999999 109.248 176.694 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' PHE . . . . . 0.517 ' CD2' ' C ' ' A' ' 6' ' ' PHE . 0.2 OUTLIER -62.77 -42.34 99.65 Favored 'General case' 0 C--O 1.196 -1.728 0 CA-C-N 114.905 -1.043 . . . . 100.09 110.113 -173.454 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ARG . . . . . 0.483 ' N ' ' OD1' ' A' ' 5' ' ' ASN . 0.0 OUTLIER -78.22 -19.54 53.6 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 115.069 -0.969 . . . . 189.86000000000001 113.594 -173.938 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.6 m -86.04 -26.49 25.32 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 107.892 -1.151 . . . . 61.579999999999998 107.892 170.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -71.66 -47.61 53.16 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.229 -0.896 . . . . 74.939999999999998 112.41 172.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ARG . . . . . 0.545 ' NH2' ' O ' ' A' ' 89' ' ' HOH . 69.0 ttt180 -51.33 -58.47 6.12 Favored 'General case' 0 CA--C 1.492 -1.261 0 N-CA-C 107.285 -1.376 . . . . 102.92 107.285 174.498 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -58.86 -55.41 31.04 Favored Glycine 0 C--N 1.314 -0.663 0 N-CA-C 118.147 2.019 . . . . 77.689999999999998 118.147 -174.102 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -106.58 25.47 11.14 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 113.92 1.082 . . . . 73.810000000000002 113.92 -173.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LEU . . . . . . . . . . . . . 1.5 tp -50.1 -43.12 51.44 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 114.792 1.404 . . . . 63.799999999999997 114.792 -178.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 40.4 t -54.31 -56.44 18.44 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.862 -0.608 . . . . 77.819999999999993 109.96 177.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . . . -64.67 -12.18 43.54 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.969 -0.56 . . . . 81.560000000000002 112.042 178.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 73.4 t -89.26 -35.27 7.46 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.456 0 CA-C-O 121.47 0.653 . . . . 80.319999999999993 110.3 -178.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 39.4 mt -72.71 -30.89 64.57 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 115.735 -0.666 . . . . 67.75 109.559 -179.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' ASN . . . . . 1.148 ' CB ' ' O ' ' A' ' 90' ' ' HOH . . . -63.24 -30.48 71.61 Favored 'General case' 0 CA--C 1.5 -0.961 0 N-CA-C 106.945 -1.502 . . . . 60.460000000000001 106.945 177.232 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ASN . . . . . . . . . . . . . 15.5 m-20 -76.5 -42.43 43.41 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 115.233 1.568 . . . . 66.239999999999995 115.233 178.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 91.2 t -74.47 -19.21 16.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 108.504 -0.924 . . . . 70.459999999999994 108.504 179.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' GLU . . . . . 0.544 ' OE1' ' NH1' ' B' ' 33' ' ' ARG . 25.1 tt0 -81.69 -0.12 41.31 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.868 -1.06 . . . . 105.51000000000001 110.906 176.35 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -110.47 -11.15 14.52 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.478 -0.783 . . . . 110.23999999999999 110.367 -178.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 131.68 -4.01 5.41 Favored Glycine 0 C--O 1.227 -0.282 0 N-CA-C 114.512 0.565 . . . . 92.75 114.512 -179.827 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . . . -84.35 150.97 25.01 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 122.682 1.23 . . . . 79.180000000000007 113.596 -176.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 59.6 mt-10 -120.48 115.07 22.75 Favored 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 106.134 -1.802 . . . . 116.84 106.134 171.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' VAL . . . . . 0.421 ' CG1' ' CD1' ' A' ' 4' ' ' ILE . 86.8 t -107.99 117.13 52.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.345 -0.388 . . . . 76.069999999999993 111.753 -172.724 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 54.1 tt0 -90.18 92.3 8.89 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 114.682 1.364 . . . . 64.859999999999999 114.682 -172.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 0.5 OUTLIER -71.56 105.24 1.76 Allowed 'Isoleucine or valine' 0 C--O 1.203 -1.362 0 O-C-N 120.654 -1.279 . . . . 66.170000000000002 111.126 179.938 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 41.3 p -89.59 159.49 17.15 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 123.393 0.677 . . . . 67.439999999999998 110.481 178.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 22.7 mtm180 -144.73 166.12 26.12 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 110.264 -0.272 . . . . 100.38 110.264 175.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . . . -75.7 123.83 26.23 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 113.447 0.906 . . . . 138.50999999999999 113.447 -177.044 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 66.01 -4.78 2.26 Favored Glycine 0 C--N 1.333 0.367 0 N-CA-C 111.033 -0.827 . . . . 101.86 111.033 -177.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ARG . . . . . 0.568 ' NH1' ' OE2' ' B' ' 21' ' ' GLU . 0.0 OUTLIER -103.42 152.48 21.57 Favored 'General case' 0 C--O 1.199 -1.566 0 CA-C-O 122.202 1.001 . . . . 143.38 112.455 -174.778 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 79.1 mm-40 -82.4 143.03 47.38 Favored Pre-proline 0 C--N 1.301 -1.527 0 CA-C-N 115.429 -0.805 . . . . 91.239999999999995 111.175 179.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -62.99 130.58 29.57 Favored 'Trans proline' 0 CA--C 1.553 1.45 1 C-N-CA 127.997 5.798 . . . . 80.420000000000002 118.222 -172.367 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -101.8 133.59 46.3 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 114.947 -1.024 . . . . 67.340000000000003 109.827 168.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.9 p -117.37 158.89 17.83 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 N-CA-C 109.065 -0.717 . . . . 65.0 109.065 -179.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 10.4 mt -131.21 114.54 26.65 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.618 0 CA-C-N 115.63 -0.714 . . . . 60.920000000000002 111.701 -176.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 11.1 p -122.75 151.21 26.75 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.815 0 N-CA-C 104.694 -2.336 . . . . 69.200000000000003 104.694 -179.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 94.3 p -63.82 167.09 6.4 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.223 -0.591 . . . . 83.689999999999998 111.657 179.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' LYS . . . . . . . . . . . . . 24.5 tttt -69.62 -40.79 76.39 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 120.198 -0.601 . . . . 98.480000000000004 112.275 -175.968 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.95 -58.84 6.81 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.865 -0.334 . . . . 83.560000000000002 111.009 178.09 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . . . -62.68 -23.04 66.93 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 112.821 0.674 . . . . 87.670000000000002 112.821 -179.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' PHE . . . . . . . . . . . . . 45.6 t80 -81.04 -47.94 12.88 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 114.465 1.283 . . . . 67.319999999999993 114.465 -176.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . . . -85.04 6.24 26.17 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 120.95 0.405 . . . . 116.81 110.507 -178.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -96.5 -38.38 10.03 Favored 'General case' 0 C--O 1.226 -0.142 0 CA-C-N 115.321 -0.854 . . . . 92.079999999999998 109.566 177.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' TYR . . . . . . . . . . . . . 17.0 m-85 -75.59 -19.13 59.47 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 108.772 -0.825 . . . . 85.299999999999997 108.772 171.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 30.0 ttpt -82.0 -54.07 5.61 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 115.334 1.605 . . . . 88.359999999999999 115.334 176.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . . . -52.82 -51.14 62.0 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.988 0.423 . . . . 124.26000000000001 110.708 172.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -83.71 18.95 1.77 Allowed 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.905 -0.589 . . . . 87.120000000000005 111.865 -178.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -99.27 -29.77 12.62 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 106.431 -1.692 . . . . 99.480000000000004 106.431 177.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' LEU . . . . . 0.466 ' C ' ' OD1' ' A' ' 53' ' ' ASP . 0.3 OUTLIER -95.9 26.98 3.77 Favored 'General case' 0 C--O 1.208 -1.11 0 N-CA-C 108.139 -1.06 . . . . 89.870000000000005 108.139 179.236 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ASP . . . . . 0.703 ' N ' ' OD1' ' A' ' 53' ' ' ASP . 0.0 OUTLIER 50.42 59.71 4.37 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 104.874 -2.269 . . . . 199.41 104.874 -173.786 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -46.0 142.95 2.44 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 120.498 3.518 . . . . 124.91 120.498 -155.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . . . -161.11 169.51 22.24 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 117.449 2.389 . . . . 135.02000000000001 117.449 2.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . 0.261 . . -151.18 -29.69 0.18 Allowed 'General case' 0 CA--C 1.539 0.55 1 N-CA-C 122.617 4.302 . . . . 119.09999999999999 122.617 -179.656 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . 68.81 -124.54 0.14 Allowed 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 120.786 3.625 . . . . 131.97 120.786 -177.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 70.7 m -172.05 -108.57 0.01 OUTLIER 'General case' 0 C--O 1.244 0.805 0 CA-C-O 121.884 0.849 . . . . 110.11 112.703 -179.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . . . -68.77 -26.61 65.31 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-N 115.075 -0.966 . . . . 96.890000000000001 110.183 -178.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' PHE . . . . . 0.721 ' O ' ' CG ' ' A' ' 60' ' ' PHE . . . -94.39 9.45 38.24 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.888 -0.782 . . . . 82.700000000000003 108.888 175.755 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . . . -92.13 50.65 1.68 Allowed 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.603 -0.726 . . . . 59.020000000000003 111.227 -178.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' THR . . . . . 0.484 ' N ' ' CA ' ' A' ' 63' ' ' LEU . 25.2 m 151.11 43.74 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.181 0.515 . . . . 70.319999999999993 110.356 178.559 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LEU . . . . . 0.49 ' O ' ' CB ' ' A' ' 64' ' ' ASP . . . 71.08 3.6 4.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.649 -0.705 . . . . 52.189999999999998 111.407 178.959 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ASP . . . . . 0.49 ' CB ' ' O ' ' A' ' 63' ' ' LEU . 10.9 t0 139.25 -118.57 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 108.829 -0.804 . . . . 77.290000000000006 108.829 168.877 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . . . -142.98 -115.68 0.1 Allowed 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.885 -0.598 . . . . 63.310000000000002 112.37 -177.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . . . 171.89 69.54 0.0 OUTLIER 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 109.881 -0.415 . . . . 70.670000000000002 109.881 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 6.6 m-20 . . . . . 0 C--N 1.329 -0.308 0 N-CA-C 113.709 1.003 . . . . 86.200000000000003 113.709 -178.036 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.194 -1.836 0 N-CA-C 112.062 0.393 . . . . 120.98 112.062 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -97.07 14.42 25.72 Favored 'General case' 0 C--O 1.186 -2.267 0 N-CA-C 115.495 1.665 . . . . 103.14 115.495 -177.023 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' SER . . . . . . . . . . . . . 33.9 t -135.93 124.52 23.66 Favored 'General case' 0 C--O 1.201 -1.477 0 C-N-CA 118.192 -1.403 . . . . 100.56999999999999 111.704 164.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' ILE . . . . . . . . . . . . . . . -142.82 125.04 12.98 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.304 0 N-CA-C 105.686 -1.968 . . . . 84.659999999999997 105.686 -169.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' ASN . . . . . 0.868 ' ND2' ' CB ' ' B' ' 8' ' ' THR . 0.3 OUTLIER -65.52 178.14 1.04 Allowed 'General case' 0 C--O 1.223 -0.309 0 N-CA-C 112.845 0.683 . . . . 130.38999999999999 112.845 174.653 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' PHE . . . . . . . . . . . . . . . -66.79 -47.84 70.86 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.889 -0.324 . . . . 56.159999999999997 111.002 179.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' ARG . . . . . . . . . . . . . 8.8 ttm180 -61.83 -30.52 70.89 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 113.095 0.776 . . . . 181.16999999999999 113.095 -178.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' THR . . . . . 0.868 ' CB ' ' ND2' ' B' ' 5' ' ' ASN . . . -87.34 -17.83 31.49 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.289 0.478 . . . . 105.86 112.289 -177.77 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.01 -56.78 4.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.387 -0.37 . . . . 79.549999999999997 111.672 -178.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . . . -68.57 -44.0 75.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.208 -0.451 . . . . 157.72 111.213 -179.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . -56.74 -8.94 3.21 Favored Glycine 0 N--CA 1.425 -2.057 0 C-N-CA 118.957 -1.592 . . . . 115.31 113.075 176.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . . . -149.29 27.7 0.83 Allowed 'General case' 0 CA--C 1.499 -0.996 0 N-CA-C 115.499 1.666 . . . . 113.58 115.499 -175.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' LEU . . . . . . . . . . . . . 9.3 tp -54.78 -32.54 60.22 Favored 'General case' 0 N--CA 1.426 -1.627 0 CA-C-N 115.63 -0.713 . . . . 86.719999999999999 112.856 -174.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' SER . . . . . 0.474 ' O ' ' ND2' ' B' ' 18' ' ' ASN . 18.1 t -51.37 -54.44 26.46 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 108.31 -0.996 . . . . 94.319999999999993 108.31 179.517 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -70.04 -27.47 64.67 Favored 'General case' 0 C--O 1.178 -2.695 0 C-N-CA 120.511 -0.476 . . . . 104.66 109.921 -178.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 2.5 t -63.02 -47.48 92.52 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 N-CA-C 113.426 0.899 . . . . 81.260000000000005 113.426 -174.471 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -70.65 -37.92 73.77 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 123.587 0.555 . . . . 86.239999999999995 112.371 176.524 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' ASN . . . . . 0.474 ' ND2' ' O ' ' B' ' 14' ' ' SER . 0.8 OUTLIER -49.91 -40.61 43.8 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 122.486 1.136 . . . . 63.189999999999998 112.309 175.438 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -88.79 -19.59 25.81 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 114.373 -1.285 . . . . 71.739999999999995 111.724 -178.856 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' VAL . . . . . 0.423 ' O ' ' CA ' ' B' ' 23' ' ' GLY . 8.4 t -72.35 -44.63 62.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.615 0.721 . . . . 60.039999999999999 110.235 171.352 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' GLU . . . . . 0.568 ' OE2' ' NH1' ' A' ' 33' ' ' ARG . 1.0 OUTLIER -60.63 -24.78 65.8 Favored 'General case' 0 N--CA 1.422 -1.856 0 CA-C-O 121.99 0.9 . . . . 90.980000000000004 109.908 177.077 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' ALA . . . . . . . . . . . . . . . -87.79 3.01 49.79 Favored 'General case' 0 C--O 1.189 -2.12 1 N-CA-C 122.778 4.362 . . . . 89.700000000000003 122.778 -165.961 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' GLY . . . . . 0.423 ' CA ' ' O ' ' B' ' 20' ' ' VAL . . . -124.22 103.97 0.79 Allowed Glycine 0 N--CA 1.429 -1.772 0 C-N-CA 128.991 3.186 . . . . 129.50999999999999 114.235 -26.443 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -65.53 150.37 48.5 Favored 'General case' 0 C--O 1.199 -1.597 0 C-N-CA 126.032 1.733 . . . . 167.28 113.217 167.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -96.02 107.93 20.28 Favored 'General case' 0 C--O 1.194 -1.82 0 N-CA-C 104.685 -2.339 . . . . 132.66999999999999 104.685 162.998 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' VAL . . . . . 0.512 ' O ' ' N ' ' B' ' 38' ' ' ILE . 39.1 t -95.11 133.67 35.19 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.418 0 C-N-CA 124.069 0.948 . . . . 57.469999999999999 111.108 178.615 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -108.39 117.58 34.54 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 113.1 0.778 . . . . 120.33 113.1 -179.905 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' ILE . . . . . . . . . . . . . 80.4 mt -97.15 100.09 10.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.875 0.369 . . . . 92.900000000000006 111.608 -178.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 13.1 p -93.38 146.51 23.69 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.186 0.517 . . . . 63.0 112.234 -176.224 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -130.06 156.13 45.02 Favored 'General case' 0 CA--C 1.508 -0.654 0 N-CA-C 114.077 1.14 . . . . 85.780000000000001 114.077 -179.53 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 3.8 ttp-105 -68.61 91.96 0.45 Allowed 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 114.767 -1.106 . . . . 132.46000000000001 112.243 -171.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' GLY . . . . . . . . . . . . . . . 105.29 -15.05 47.26 Favored Glycine 0 N--CA 1.452 -0.297 0 CA-C-N 115.496 -0.774 . . . . 83.609999999999999 112.343 176.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' ARG . . . . . 0.544 ' NH1' ' OE1' ' A' ' 21' ' ' GLU . 12.6 mmm180 -102.56 158.81 15.97 Favored 'General case' 0 N--CA 1.463 0.178 0 N-CA-C 112.649 0.611 . . . . 122.47 112.649 -172.906 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . . . -60.0 149.52 73.62 Favored Pre-proline 0 C--O 1.246 0.897 0 CA-C-N 116.263 -0.426 . . . . 76.680000000000007 110.997 -177.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' PRO . . . . . . . . . . . . . 7.0 Cg_exo -78.42 148.18 23.36 Favored 'Trans proline' 0 N--CA 1.45 -1.087 0 C-N-CA 123.677 2.918 . . . . 84.829999999999998 111.152 -177.464 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' ALA . . . . . . . . . . . . . . . -115.24 176.38 5.09 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.951 0.405 . . . . 84.859999999999999 111.294 175.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' VAL . . . . . . . . . . . . . 3.7 t -143.64 118.7 4.18 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.039 0 N-CA-C 108.674 -0.861 . . . . 51.469999999999999 108.674 177.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' ILE . . . . . 0.512 ' N ' ' O ' ' B' ' 26' ' ' VAL . 6.1 tt -101.66 109.55 26.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 C-N-CA 120.039 -0.665 . . . . 64.340000000000003 112.17 174.713 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 7.5 p -126.15 154.45 35.42 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.421 0 N-CA-C 106.692 -1.595 . . . . 57.990000000000002 106.692 -176.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' SER . . . . . . . . . . . . . 51.6 p -58.73 134.97 57.29 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.023 0.379 . . . . 60.979999999999997 112.023 -175.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' LYS . . . . . . . . . . . . . 59.0 tttt -49.5 -51.59 35.18 Favored 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 118.946 -1.101 . . . . 88.609999999999999 110.43 -179.76 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -41.01 -42.62 1.94 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.674 -0.694 . . . . 70.709999999999994 111.42 -177.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 88.0 m -81.25 -45.06 16.84 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 113.796 1.036 . . . . 91.950000000000003 113.796 -171.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' PHE . . . . . 0.426 ' CE2' ' CD ' ' B' ' 48' ' ' LYS . 76.4 t80 -63.17 -40.99 99.12 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 119.731 -0.788 . . . . 84.579999999999998 110.407 177.715 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -51.33 -25.51 6.07 Favored 'General case' 0 CA--C 1.516 -0.362 0 C-N-CA 120.32 -0.552 . . . . 109.22 110.584 176.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . -89.08 -37.35 15.18 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 112.617 0.599 . . . . 60.030000000000001 112.617 176.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -55.13 -56.23 22.18 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 105.85 -1.908 . . . . 76.849999999999994 105.85 169.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' LYS . . . . . 0.426 ' CD ' ' CE2' ' B' ' 44' ' ' PHE . 1.1 tttp -54.93 -49.37 71.48 Favored 'General case' 0 N--CA 1.437 -1.088 0 CA-C-O 121.668 0.747 . . . . 133.97999999999999 110.807 -178.648 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 40.4 tttp -56.65 -52.38 65.11 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.947 -0.57 . . . . 94.609999999999999 111.293 -176.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -43.1 116.43 0.9 Allowed 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 107.651 -1.24 . . . . 80.849999999999994 107.651 169.382 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' ALA . . . . . 0.629 ' N ' ' CA ' ' B' ' 52' ' ' LEU . . . -131.77 -24.34 2.2 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.716 -0.674 . . . . 94.299999999999997 110.909 -177.83 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' LEU . . . . . 0.629 ' CA ' ' N ' ' B' ' 51' ' ' ALA . . . -120.71 -147.78 0.4 Allowed 'General case' 0 C--O 1.222 -0.381 0 N-CA-C 113.469 0.915 . . . . 75.629999999999995 113.469 . . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -125.33 128.7 48.61 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 115.91 -0.587 . . . . 84.780000000000001 112.477 -175.999 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -114.53 8.97 16.56 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 124.793 1.237 . . . . 79.870000000000005 114.075 8.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' GLU . . . . . . . . . . . . . 18.9 mp0 . . . . . 0 C--N 1.333 -0.127 0 CA-C-O 120.957 0.408 . . . . 94.739999999999995 111.339 174.416 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 2' ' ' GLN . . . . . . . . . . . . . . . . . . . . 0 C--O 1.208 -1.117 0 N-CA-C 109.87 -0.418 . . . . 203.71000000000001 109.87 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 3' ' ' SER . . . . . 0.734 ' O ' ' O ' ' C' ' 76' ' ' HOH . 8.8 t -81.58 164.6 21.79 Favored 'General case' 0 C--O 1.206 -1.195 0 N-CA-C 118.676 2.843 . . . . 166.09 118.676 -161.992 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . . . -162.73 136.98 1.29 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.552 0 C-N-CA 125.643 1.577 . . . . 232.44999999999999 108.621 -178.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 5' ' ' ASN . . . . . 0.748 ' O ' ' N ' ' C' ' 7' ' ' ARG . . . -80.32 -178.29 6.55 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 121.142 3.756 . . . . 246.96000000000001 121.142 -179.756 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 6' ' ' PHE . . . . . 0.945 ' CD2' ' N ' ' C' ' 6' ' ' PHE . 0.0 OUTLIER -64.75 80.31 0.04 OUTLIER 'General case' 0 N--CA 1.433 -1.314 0 N-CA-C 105.951 -1.87 . . . . 213.90000000000001 105.951 -169.404 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 7' ' ' ARG . . . . . 0.833 ' O ' ' CB ' ' C' ' 8' ' ' THR . . . -101.18 118.68 37.47 Favored 'General case' 0 CA--C 1.502 -0.895 0 N-CA-C 107.792 -1.188 . . . . 229.27000000000001 107.792 176.877 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 8' ' ' THR . . . . . 0.833 ' CB ' ' O ' ' C' ' 7' ' ' ARG . . . . . . . . 0 C--N 1.292 -1.93 0 CA-C-O 116.505 -1.712 . . . . 251.11000000000001 111.243 -179.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 14' ' ' SER . . . . . . . . . . . . . 19.6 t . . . . . 0 N--CA 1.457 -0.08 0 CA-C-O 120.844 0.354 . . . . 228.78 110.879 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . . . -83.18 -5.93 59.3 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.326 0.584 . . . . 133.06999999999999 110.288 179.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 16' ' ' VAL . . . . . . . . . . . . . 2.6 t -47.31 -32.81 2.49 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-N 115.141 -0.936 . . . . 256.39999999999998 111.438 173.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 17' ' ' LEU . . . . . . . . . . . . . 7.6 mt -73.76 -49.47 25.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.924 -0.58 . . . . 184.66999999999999 111.283 179.213 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . . . -52.0 -30.62 25.99 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 115.589 1.7 . . . . 143.36000000000001 115.589 179.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 19' ' ' ASN . . . . . . . . . . . . . . . -126.25 75.54 1.53 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.055 -0.521 . . . . 209.43000000000001 112.223 173.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 20' ' ' VAL . . . . . . . . . . . . . 3.1 t -66.2 140.48 19.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 N-CA-C 108.273 -1.01 . . . . 279.79000000000002 108.273 174.612 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . . . -55.13 -63.5 1.14 Allowed 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.785 1.032 . . . . 195.77000000000001 113.785 -174.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -158.75 97.8 1.46 Allowed 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 107.936 -1.135 . . . . 184.50999999999999 107.936 -0.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 23' ' ' GLY . . . . . 0.472 ' N ' ' CA ' ' C' ' 24' ' ' GLU . . . -156.71 48.93 0.46 Allowed Glycine 0 CA--C 1.52 0.344 0 N-CA-C 116.892 1.517 . . . . 207.5 116.892 175.398 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 24' ' ' GLU . . . . . 0.472 ' CA ' ' N ' ' C' ' 23' ' ' GLY . . . -137.63 159.9 40.69 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 117.968 0.884 . . . . 158.97 109.158 -6.482 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 25' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -127.66 -160.28 1.0 Allowed 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 114.514 1.301 . . . . 126.84 114.514 -174.032 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 26' ' ' VAL . . . . . . . . . . . . . 2.9 t 57.61 60.21 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-N 114.896 -1.047 . . . . 156.44 113.699 -178.25 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 27' ' ' GLU . . . . . . . . . . . . . . . -82.67 82.93 7.83 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.649 -0.705 . . . . 156.34 109.232 174.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 30.6 mt -53.57 117.98 1.02 Allowed 'Isoleucine or valine' 0 C--O 1.205 -1.28 0 N-CA-C 108.237 -1.023 . . . . 132.41999999999999 108.237 -178.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 29' ' ' THR . . . . . 0.609 ' CG2' ' N ' ' C' ' 30' ' ' ARG . 0.4 OUTLIER -91.95 170.29 9.98 Favored 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 107.009 -1.478 . . . . 188.97 107.009 -178.057 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 30' ' ' ARG . . . . . 0.609 ' N ' ' CG2' ' C' ' 29' ' ' THR . 1.0 OUTLIER -163.11 145.0 10.0 Favored 'General case' 0 C--O 1.221 -0.399 0 O-C-N 123.736 0.648 . . . . 225.74000000000001 112.165 175.098 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 31' ' ' ARG . . . . . . . . . . . . . . . -67.38 129.75 40.9 Favored 'General case' 0 C--O 1.204 -1.298 0 C-N-CA 119.441 -0.904 . . . . 104.15000000000001 109.857 -178.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . 46.81 42.16 14.57 Favored Glycine 0 N--CA 1.449 -0.481 0 N-CA-C 115.423 0.929 . . . . 125.01000000000001 115.423 178.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 33' ' ' ARG . . . . . . . . . . . . . . . -152.18 136.97 17.07 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.703 -0.48 . . . . 153.53999999999999 109.703 175.601 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 34' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -56.48 129.99 75.95 Favored Pre-proline 0 C--N 1.329 -0.325 0 C-N-CA 119.233 -0.987 . . . . 124.27 110.155 -178.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 35' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -67.92 145.51 68.42 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 120.494 0.796 . . . . 90.480000000000004 112.118 -175.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 36' ' ' ALA . . . . . . . . . . . . 0.259 . . -98.99 173.65 6.73 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 107.155 -1.424 . . . . 85.400000000000006 107.155 172.349 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 37' ' ' VAL . . . . . . . . . . . . . 5.7 t -132.89 159.96 42.89 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.782 0 C-N-CA 123.462 0.705 . . . . 85.670000000000002 110.385 173.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 38' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -133.23 77.06 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 N-CA-C 113.269 0.841 . . . . 120.94 113.269 174.126 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 39' ' ' VAL . . . . . 0.507 ' CG2' ' N ' ' C' ' 40' ' ' SER . 1.3 p -92.46 149.27 4.23 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.869 0 CA-C-N 114.745 -1.116 . . . . 105.62 112.637 -176.089 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 40' ' ' SER . . . . . 0.507 ' N ' ' CG2' ' C' ' 39' ' ' VAL . 0.1 OUTLIER -70.0 164.57 23.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.028 -0.533 . . . . 137.72 110.699 -177.842 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 41' ' ' LYS . . . . . . . . . . . . . 4.5 mttt -75.46 -23.45 56.87 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 107.702 -1.222 . . . . 124.06 107.702 -179.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.05 -43.16 71.82 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.071 -0.714 . . . . 124.33 109.071 -179.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 43' ' ' THR . . . . . . . . . . . . . 5.8 m -73.48 -28.98 62.22 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 119.996 -0.682 . . . . 130.27000000000001 109.826 179.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 44' ' ' PHE . . . . . . . . . . . . . 8.5 t80 -86.84 83.87 7.46 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.927 0.394 . . . . 117.83 110.28 -178.345 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 45' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -95.14 -30.26 14.13 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 114.077 1.139 . . . . 232.15000000000001 114.077 -169.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 46' ' ' ALA . . . . . . . . . . . . . . . -147.35 163.19 37.22 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 120.472 3.508 . . . . 164.09999999999999 120.472 -154.743 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 47' ' ' TYR . . . . . 0.557 ' CB ' ' CB ' ' C' ' 48' ' ' LYS . 7.3 m-85 -146.92 -164.52 2.01 Favored 'General case' 0 C--N 1.328 -0.33 1 N-CA-C 99.783 -4.155 . . . . 244.80000000000001 99.783 170.138 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 48' ' ' LYS . . . . . 0.557 ' CB ' ' CB ' ' C' ' 47' ' ' TYR . . . -151.52 126.6 9.81 Favored 'General case' 0 C--O 1.269 2.093 1 C-N-CA 132.043 4.137 . . . . 189.53999999999999 111.16 -13.743 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--N 1.292 -1.903 0 CA-C-N 118.933 0.788 . . . . 267.64999999999998 111.162 -177.446 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' HOH . . . . . 0.64 ' O ' ' O ' ' A' ' 1' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' HOH . . . . . 0.462 ' O ' ' OG1' ' A' ' 62' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' HOH . . . . . 0.545 ' O ' ' NH2' ' A' ' 10' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' HOH . . . . . 1.148 ' O ' ' CB ' ' A' ' 18' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 74' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 75' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 76' ' ' HOH . . . . . 0.734 ' O ' ' O ' ' C' ' 3' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 77' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 78' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 79' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' MET . . . . . 0.64 ' O ' ' O ' ' A' ' 80' ' ' HOH . 5.1 ttt . . . . . 0 C--O 1.221 -0.43 0 N-CA-C 111.473 0.175 . . . . 180.07 111.473 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -62.8 144.29 56.67 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.109 1.763 . . . . 108.24 109.714 178.216 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 32.3 t -135.76 118.32 15.91 Favored 'General case' 0 CA--C 1.518 -0.266 0 C-N-CA 120.786 -0.365 . . . . 82.39 111.59 -179.84 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ILE . . . . . 0.468 ' CD1' HG11 ' A' ' 26' ' ' VAL . 1.5 pt -127.14 164.58 27.6 Favored 'Isoleucine or valine' 0 C--O 1.184 -2.382 0 C-N-CA 122.716 0.407 . . . . 86.44 111.811 -179.419 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ASN . . . . . 0.698 ' OD1' ' HD3' ' A' ' 7' ' ' ARG . 4.5 p30 -86.62 169.94 12.28 Favored 'General case' 0 C--N 1.313 -1.007 0 C-N-CA 124.185 0.994 . . . . 74.11 109.248 176.694 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' PHE . . . . . 0.727 ' HD2' ' HG3' ' A' ' 7' ' ' ARG . 0.2 OUTLIER -62.77 -42.34 99.65 Favored 'General case' 0 C--O 1.196 -1.728 0 CA-C-N 114.905 -1.043 . . . . 100.09 110.113 -173.454 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ARG . . . . . 0.727 ' HG3' ' HD2' ' A' ' 6' ' ' PHE . 0.0 OUTLIER -78.22 -19.54 53.6 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 115.069 -0.969 . . . . 189.86 113.594 -173.938 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.6 m -86.04 -26.49 25.32 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 107.892 -1.151 . . . . 61.58 107.892 170.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ALA . . . . . 0.581 ' CB ' HD13 ' A' ' 28' ' ' ILE . . . -71.66 -47.61 53.16 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.229 -0.896 . . . . 74.94 112.41 172.856 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ARG . . . . . 0.47 ' NH2' ' O ' ' A' ' 89' ' ' HOH . 69.0 ttt180 -51.33 -58.47 6.12 Favored 'General case' 0 CA--C 1.492 -1.261 0 N-CA-C 107.285 -1.376 . . . . 102.92 107.285 174.498 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -58.86 -55.41 31.04 Favored Glycine 0 C--N 1.314 -0.663 0 N-CA-C 118.147 2.019 . . . . 77.69 118.147 -174.102 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ASN . . . . . 0.602 ' O ' HG23 ' A' ' 16' ' ' VAL . 14.1 m120 -106.58 25.47 11.14 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 113.92 1.082 . . . . 73.81 113.92 -173.986 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LEU . . . . . 0.531 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 1.5 tp -50.1 -43.12 51.44 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 114.792 1.404 . . . . 63.8 114.792 -178.601 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 40.4 t -54.31 -56.44 18.44 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.862 -0.608 . . . . 77.82 109.96 177.046 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . . . -64.67 -12.18 43.54 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.969 -0.56 . . . . 81.56 112.042 178.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' VAL . . . . . 0.602 HG23 ' O ' ' A' ' 12' ' ' ASN . 73.4 t -89.26 -35.27 7.46 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.456 0 CA-C-O 121.47 0.653 . . . . 80.32 110.3 -178.43 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 13' ' ' LEU . 39.4 mt -72.71 -30.89 64.57 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 115.735 -0.666 . . . . 67.75 109.559 -179.816 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' ASN . . . . . 1.148 ' CB ' ' O ' ' A' ' 90' ' ' HOH . . . -63.24 -30.48 71.61 Favored 'General case' 0 CA--C 1.5 -0.961 0 N-CA-C 106.945 -1.502 . . . . 60.46 106.945 177.232 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ASN . . . . . 0.421 ' HB2' ' O ' ' A' ' 16' ' ' VAL . 15.5 m-20 -76.5 -42.43 43.41 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 115.233 1.568 . . . . 66.24 115.233 178.82 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' VAL . . . . . 0.493 HG13 ' O ' ' A' ' 24' ' ' GLU . 91.2 t -74.47 -19.21 16.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 108.504 -0.924 . . . . 70.46 108.504 179.716 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' GLU . . . . . 0.544 ' OE1' ' NH1' ' B' ' 33' ' ' ARG . 25.1 tt0 -81.69 -0.12 41.31 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.868 -1.06 . . . . 105.51 110.906 176.35 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -110.47 -11.15 14.52 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.478 -0.783 . . . . 110.24 110.367 -178.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 131.68 -4.01 5.41 Favored Glycine 0 C--O 1.227 -0.282 0 N-CA-C 114.512 0.565 . . . . 92.75 114.512 -179.827 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' GLU . . . . . 0.493 ' O ' HG13 ' A' ' 20' ' ' VAL . . . -84.35 150.97 25.01 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 122.682 1.23 . . . . 79.18 113.596 -176.099 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 59.6 mt-10 -120.48 115.07 22.75 Favored 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 106.134 -1.802 . . . . 116.84 106.134 171.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' VAL . . . . . 0.468 HG11 ' CD1' ' A' ' 4' ' ' ILE . 86.8 t -107.99 117.13 52.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.345 -0.388 . . . . 76.07 111.753 -172.724 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 54.1 tt0 -90.18 92.3 8.89 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 114.682 1.364 . . . . 64.86 114.682 -172.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ILE . . . . . 0.853 HD11 HD11 ' A' ' 38' ' ' ILE . 0.5 OUTLIER -71.56 105.24 1.76 Allowed 'Isoleucine or valine' 0 C--O 1.203 -1.362 0 O-C-N 120.654 -1.279 . . . . 66.17 111.126 179.938 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 41.3 p -89.59 159.49 17.15 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 123.393 0.677 . . . . 67.44 110.481 178.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ARG . . . . . 0.587 ' HB2' ' HB2' ' A' ' 33' ' ' ARG . 22.7 mtm180 -144.73 166.12 26.12 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 110.264 -0.272 . . . . 100.38 110.264 175.039 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ARG . . . . . 0.77 ' O ' ' HG2' ' A' ' 33' ' ' ARG . . . -75.7 123.83 26.23 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 113.447 0.906 . . . . 138.51 113.447 -177.044 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 66.01 -4.78 2.26 Favored Glycine 0 C--N 1.333 0.367 0 N-CA-C 111.033 -0.827 . . . . 101.86 111.033 -177.391 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ARG . . . . . 0.77 ' HG2' ' O ' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -103.42 152.48 21.57 Favored 'General case' 0 C--O 1.199 -1.566 0 CA-C-O 122.202 1.001 . . . . 143.38 112.455 -174.778 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLU . . . . . 0.752 ' HG3' ' O ' ' B' ' 89' ' ' HOH . 79.1 mm-40 -82.4 143.03 47.38 Favored Pre-proline 0 C--N 1.301 -1.527 0 CA-C-N 115.429 -0.805 . . . . 91.24 111.175 179.579 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -62.99 130.58 29.57 Favored 'Trans proline' 0 CA--C 1.553 1.45 1 C-N-CA 127.997 5.798 . . . . 80.42 118.222 -172.367 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ALA . . . . . 0.656 ' CB ' HD12 ' B' ' 17' ' ' LEU . . . -101.8 133.59 46.3 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 114.947 -1.024 . . . . 67.34 109.827 168.015 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.9 p -117.37 158.89 17.83 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 N-CA-C 109.065 -0.717 . . . . 65.0 109.065 -179.959 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ILE . . . . . 0.853 HD11 HD11 ' A' ' 28' ' ' ILE . 10.4 mt -131.21 114.54 26.65 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.618 0 CA-C-N 115.63 -0.714 . . . . 60.92 111.701 -176.792 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' VAL . . . . . 0.888 HG13 ' HB2' ' A' ' 44' ' ' PHE . 11.1 p -122.75 151.21 26.75 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.815 0 N-CA-C 104.694 -2.336 . . . . 69.2 104.694 -179.7 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 94.3 p -63.82 167.09 6.4 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.223 -0.591 . . . . 83.69 111.657 179.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' LYS . . . . . 0.452 ' HE3' ' OE1' ' B' ' 27' ' ' GLU . 24.5 tttt -69.62 -40.79 76.39 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 120.198 -0.601 . . . . 98.48 112.275 -175.968 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.95 -58.84 6.81 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.865 -0.334 . . . . 83.56 111.009 178.09 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . . . -62.68 -23.04 66.93 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 112.821 0.674 . . . . 87.67 112.821 -179.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' PHE . . . . . 0.888 ' HB2' HG13 ' A' ' 39' ' ' VAL . 45.6 t80 -81.04 -47.94 12.88 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 114.465 1.283 . . . . 67.32 114.465 -176.628 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . . . -85.04 6.24 26.17 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 120.95 0.405 . . . . 116.81 110.507 -178.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -96.5 -38.38 10.03 Favored 'General case' 0 C--O 1.226 -0.142 0 CA-C-N 115.321 -0.854 . . . . 92.08 109.566 177.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' TYR . . . . . 0.425 ' HD2' ' CE1' ' B' ' 44' ' ' PHE . 17.0 m-85 -75.59 -19.13 59.47 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 108.772 -0.825 . . . . 85.3 108.772 171.72 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 30.0 ttpt -82.0 -54.07 5.61 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 115.334 1.605 . . . . 88.36 115.334 176.41 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . . . -52.82 -51.14 62.0 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.988 0.423 . . . . 124.26 110.708 172.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -83.71 18.95 1.77 Allowed 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.905 -0.589 . . . . 87.12 111.865 -178.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -99.27 -29.77 12.62 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 106.431 -1.692 . . . . 99.48 106.431 177.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' LEU . . . . . 0.482 ' N ' HD23 ' A' ' 52' ' ' LEU . 0.3 OUTLIER -95.9 26.98 3.77 Favored 'General case' 0 C--O 1.208 -1.11 0 N-CA-C 108.139 -1.06 . . . . 89.87 108.139 179.236 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ASP . . . . . 0.703 ' N ' ' OD1' ' A' ' 53' ' ' ASP . 0.0 OUTLIER 50.42 59.71 4.37 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 104.874 -2.269 . . . . 199.41 104.874 -173.786 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -46.0 142.95 2.44 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 120.498 3.518 . . . . 124.91 120.498 -155.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . . . -161.11 169.51 22.24 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 117.449 2.389 . . . . 135.02 117.449 2.554 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . 0.261 . . -151.18 -29.69 0.18 Allowed 'General case' 0 CA--C 1.539 0.55 1 N-CA-C 122.617 4.302 . . . . 119.1 122.617 -179.656 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . 68.81 -124.54 0.14 Allowed 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 120.786 3.625 . . . . 131.97 120.786 -177.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 70.7 m -172.05 -108.57 0.01 OUTLIER 'General case' 0 C--O 1.244 0.805 0 CA-C-O 121.884 0.849 . . . . 134.6 112.703 -179.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . . . -68.77 -26.61 65.31 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-N 115.075 -0.966 . . . . 96.89 110.183 -178.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' PHE . . . . . 0.721 ' CG ' ' O ' ' A' ' 60' ' ' PHE . . . -94.39 9.45 38.24 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.888 -0.782 . . . . 82.7 108.888 175.755 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . . . -92.13 50.65 1.68 Allowed 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.603 -0.726 . . . . 73.28 111.227 -178.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' THR . . . . . 0.599 ' H ' ' CA ' ' A' ' 63' ' ' LEU . 25.2 m 151.11 43.74 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.181 0.515 . . . . 70.32 110.356 178.559 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LEU . . . . . 0.599 ' CA ' ' H ' ' A' ' 62' ' ' THR . . . 71.08 3.6 4.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.649 -0.705 . . . . 52.19 111.407 178.959 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ASP . . . . . 0.592 ' HB2' ' O ' ' A' ' 63' ' ' LEU . 10.9 t0 139.25 -118.57 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 108.829 -0.804 . . . . 77.29 108.829 168.877 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' SER . . . . . 0.407 ' H ' ' HB3' ' A' ' 64' ' ' ASP . . . -142.98 -115.68 0.1 Allowed 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.885 -0.598 . . . . 63.31 112.37 -177.531 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . . . 171.89 69.54 0.0 OUTLIER 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 109.881 -0.415 . . . . 70.67 109.881 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 6.6 m-20 . . . . . 0 C--N 1.329 -0.308 0 N-CA-C 113.709 1.003 . . . . 86.2 113.709 -178.036 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 1' ' ' MET . . . . . 0.687 ' HG3' ' H ' ' B' ' 3' ' ' SER . 0.5 OUTLIER . . . . . 0 C--O 1.194 -1.836 0 N-CA-C 112.062 0.393 . . . . 120.98 112.062 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 2' ' ' GLN . . . . . 0.439 ' N ' ' HG3' ' B' ' 1' ' ' MET . 0.1 OUTLIER -97.07 14.42 25.72 Favored 'General case' 0 C--O 1.186 -2.267 0 N-CA-C 115.495 1.665 . . . . 103.14 115.495 -177.023 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 3' ' ' SER . . . . . 0.687 ' H ' ' HG3' ' B' ' 1' ' ' MET . 33.9 t -135.93 124.52 23.66 Favored 'General case' 0 C--O 1.201 -1.477 0 C-N-CA 118.192 -1.403 . . . . 100.57 111.704 164.134 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 4' ' ' ILE . . . . . 0.438 ' O ' ' HA ' ' B' ' 28' ' ' ILE . . . -142.82 125.04 12.98 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.304 0 N-CA-C 105.686 -1.968 . . . . 84.66 105.686 -169.557 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 5' ' ' ASN . . . . . 0.723 ' OD1' ' CB ' ' B' ' 8' ' ' THR . 5.7 p30 -65.52 178.14 1.04 Allowed 'General case' 0 C--O 1.223 -0.309 0 N-CA-C 112.845 0.683 . . . . 130.39 112.845 174.653 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 6' ' ' PHE . . . . . . . . . . . . . . . -66.79 -47.84 70.86 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.889 -0.324 . . . . 56.16 111.002 179.082 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' ARG . . . . . . . . . . . . . 8.8 ttm180 -61.83 -30.52 70.89 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 113.095 0.776 . . . . 181.17 113.095 -178.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' THR . . . . . 0.723 ' CB ' ' OD1' ' B' ' 5' ' ' ASN . . . -87.34 -17.83 31.49 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.289 0.478 . . . . 105.86 112.289 -177.77 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.01 -56.78 4.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.387 -0.37 . . . . 79.55 111.672 -178.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . . . -68.57 -44.0 75.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.208 -0.451 . . . . 157.72 111.213 -179.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . -56.74 -8.94 3.21 Favored Glycine 0 N--CA 1.425 -2.057 0 C-N-CA 118.957 -1.592 . . . . 115.31 113.075 176.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . . . -149.29 27.7 0.83 Allowed 'General case' 0 CA--C 1.499 -0.996 0 N-CA-C 115.499 1.666 . . . . 113.58 115.499 -175.562 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' LEU . . . . . 0.603 ' HA ' ' HB ' ' B' ' 16' ' ' VAL . 9.3 tp -54.78 -32.54 60.22 Favored 'General case' 0 N--CA 1.426 -1.627 0 CA-C-N 115.63 -0.713 . . . . 86.72 112.856 -174.178 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 14' ' ' SER . . . . . . . . . . . . . 18.1 t -51.37 -54.44 26.46 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 108.31 -0.996 . . . . 94.32 108.31 179.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -70.04 -27.47 64.67 Favored 'General case' 0 C--O 1.178 -2.695 0 C-N-CA 120.511 -0.476 . . . . 104.66 109.921 -178.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' VAL . . . . . 0.603 ' HB ' ' HA ' ' B' ' 13' ' ' LEU . 2.5 t -63.02 -47.48 92.52 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 N-CA-C 113.426 0.899 . . . . 81.26 113.426 -174.471 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 17' ' ' LEU . . . . . 0.656 HD12 ' CB ' ' A' ' 36' ' ' ALA . 0.7 OUTLIER -70.65 -37.92 73.77 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 123.587 0.555 . . . . 86.24 112.371 176.524 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 18' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -49.91 -40.61 43.8 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 122.486 1.136 . . . . 63.19 112.309 175.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 46.1 m-20 -88.79 -19.59 25.81 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 114.373 -1.285 . . . . 71.74 111.724 -178.856 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' VAL . . . . . 0.508 HG23 ' O ' ' B' ' 16' ' ' VAL . 8.4 t -72.35 -44.63 62.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.615 0.721 . . . . 60.04 110.235 171.352 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 21' ' ' GLU . . . . . 0.568 ' OE2' ' NH1' ' A' ' 33' ' ' ARG . 1.0 OUTLIER -60.63 -24.78 65.8 Favored 'General case' 0 N--CA 1.422 -1.856 0 CA-C-O 121.99 0.9 . . . . 90.98 109.908 177.077 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 22' ' ' ALA . . . . . 0.457 ' N ' ' HA2' ' B' ' 23' ' ' GLY . . . -87.79 3.01 49.79 Favored 'General case' 0 C--O 1.189 -2.12 1 N-CA-C 122.778 4.362 . . . . 89.7 122.778 -165.961 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 23' ' ' GLY . . . . . 0.457 ' HA2' ' N ' ' B' ' 22' ' ' ALA . . . -124.22 103.97 0.79 Allowed Glycine 0 N--CA 1.429 -1.772 0 C-N-CA 128.991 3.186 . . . . 129.51 114.235 -26.443 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -65.53 150.37 48.5 Favored 'General case' 0 C--O 1.199 -1.597 0 C-N-CA 126.032 1.733 . . . . 167.28 113.217 167.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -96.02 107.93 20.28 Favored 'General case' 0 C--O 1.194 -1.82 0 N-CA-C 104.685 -2.339 . . . . 132.67 104.685 162.998 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 26' ' ' VAL . . . . . 0.617 ' HB ' HG23 ' B' ' 38' ' ' ILE . 39.1 t -95.11 133.67 35.19 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.418 0 C-N-CA 124.069 0.948 . . . . 57.47 111.108 178.615 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 27' ' ' GLU . . . . . 0.841 ' HG3' ' O ' ' B' ' 36' ' ' ALA . 34.2 tt0 -108.39 117.58 34.54 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 113.1 0.778 . . . . 120.33 113.1 -179.905 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 28' ' ' ILE . . . . . 0.438 ' HA ' ' O ' ' B' ' 4' ' ' ILE . 80.4 mt -97.15 100.09 10.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.875 0.369 . . . . 92.9 111.608 -178.069 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 13.1 p -93.38 146.51 23.69 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.186 0.517 . . . . 63.0 112.234 -176.224 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' ARG . . . . . 0.634 ' HG3' ' HB2' ' B' ' 33' ' ' ARG . 0.0 OUTLIER -130.06 156.13 45.02 Favored 'General case' 0 CA--C 1.508 -0.654 0 N-CA-C 114.077 1.14 . . . . 85.78 114.077 -179.53 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 3.8 ttp-105 -68.61 91.96 0.45 Allowed 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 114.767 -1.106 . . . . 132.46 112.243 -171.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' GLY . . . . . . . . . . . . . . . 105.29 -15.05 47.26 Favored Glycine 0 N--CA 1.452 -0.297 0 CA-C-N 115.496 -0.774 . . . . 83.61 112.343 176.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' ARG . . . . . 0.634 ' HB2' ' HG3' ' B' ' 30' ' ' ARG . 12.6 mmm180 -102.56 158.81 15.97 Favored 'General case' 0 N--CA 1.463 0.178 0 N-CA-C 112.649 0.611 . . . . 122.47 112.649 -172.906 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . . . -60.0 149.52 73.62 Favored Pre-proline 0 C--O 1.246 0.897 0 CA-C-N 116.263 -0.426 . . . . 76.68 110.997 -177.98 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' PRO . . . . . . . . . . . . . 7.0 Cg_exo -78.42 148.18 23.36 Favored 'Trans proline' 0 N--CA 1.45 -1.087 0 C-N-CA 123.677 2.918 . . . . 84.83 111.152 -177.464 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' ALA . . . . . 0.841 ' O ' ' HG3' ' B' ' 27' ' ' GLU . . . -115.24 176.38 5.09 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.951 0.405 . . . . 84.86 111.294 175.891 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 37' ' ' VAL . . . . . 0.446 HG11 ' CE2' ' A' ' 44' ' ' PHE . 3.7 t -143.64 118.7 4.18 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.039 0 N-CA-C 108.674 -0.861 . . . . 51.47 108.674 177.237 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 38' ' ' ILE . . . . . 0.617 HG23 ' HB ' ' B' ' 26' ' ' VAL . 6.1 tt -101.66 109.55 26.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 C-N-CA 120.039 -0.665 . . . . 64.34 112.17 174.713 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 7.5 p -126.15 154.45 35.42 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.421 0 N-CA-C 106.692 -1.595 . . . . 57.99 106.692 -176.188 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' SER . . . . . . . . . . . . . 51.6 p -58.73 134.97 57.29 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.023 0.379 . . . . 60.98 112.023 -175.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' LYS . . . . . 0.411 ' NZ ' ' HB3' ' C' ' 3' ' ' SER . 59.0 tttt -49.5 -51.59 35.18 Favored 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 118.946 -1.101 . . . . 88.61 110.43 -179.76 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -41.01 -42.62 1.94 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.674 -0.694 . . . . 70.71 111.42 -177.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' THR . . . . . 0.431 HG22 ' CE2' ' B' ' 47' ' ' TYR . 88.0 m -81.25 -45.06 16.84 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 113.796 1.036 . . . . 91.95 113.796 -171.527 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 44' ' ' PHE . . . . . 0.426 ' CE2' ' CD ' ' B' ' 48' ' ' LYS . 76.4 t80 -63.17 -40.99 99.12 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 119.731 -0.788 . . . . 84.58 110.407 177.715 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -51.33 -25.51 6.07 Favored 'General case' 0 CA--C 1.516 -0.362 0 C-N-CA 120.32 -0.552 . . . . 109.22 110.584 176.141 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . -89.08 -37.35 15.18 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 112.617 0.599 . . . . 60.03 112.617 176.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' TYR . . . . . 0.431 ' CE2' HG22 ' B' ' 43' ' ' THR . 20.3 m-85 -55.13 -56.23 22.18 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 105.85 -1.908 . . . . 76.85 105.85 169.793 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 48' ' ' LYS . . . . . 0.629 ' O ' ' HB3' ' B' ' 51' ' ' ALA . 1.1 tttp -54.93 -49.37 71.48 Favored 'General case' 0 N--CA 1.437 -1.088 0 CA-C-O 121.668 0.747 . . . . 133.98 110.807 -178.648 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 40.4 tttp -56.65 -52.38 65.11 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.947 -0.57 . . . . 94.61 111.293 -176.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -43.1 116.43 0.9 Allowed 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 107.651 -1.24 . . . . 80.85 107.651 169.382 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' ALA . . . . . 1.113 ' H ' ' HA ' ' B' ' 52' ' ' LEU . . . -131.77 -24.34 2.2 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.716 -0.674 . . . . 114.7 110.909 -177.83 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 52' ' ' LEU . . . . . 1.113 ' HA ' ' H ' ' B' ' 51' ' ' ALA . . . -120.71 -147.78 0.4 Allowed 'General case' 0 C--O 1.222 -0.381 0 N-CA-C 113.469 0.915 . . . . 75.63 113.469 . . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -125.33 128.7 48.61 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 115.91 -0.587 . . . . 84.78 112.477 -175.999 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -114.53 8.97 16.56 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 124.793 1.237 . . . . 79.87 114.075 8.564 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' GLU . . . . . . . . . . . . . 18.9 mp0 . . . . . 0 C--N 1.333 -0.127 0 CA-C-O 120.957 0.408 . . . . 94.74 111.339 174.416 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 2' ' ' GLN . . . . . . . . . . . . . . . . . . . . 0 C--O 1.208 -1.117 0 N-CA-C 109.87 -0.418 . . . . 203.71 109.87 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 3' ' ' SER . . . . . 0.734 ' O ' ' O ' ' C' ' 76' ' ' HOH . 8.8 t -81.58 164.6 21.79 Favored 'General case' 0 C--O 1.206 -1.195 0 N-CA-C 118.676 2.843 . . . . 166.09 118.676 -161.992 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . . . -162.73 136.98 1.29 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.552 0 C-N-CA 125.643 1.577 . . . . 232.45 108.621 -178.082 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 5' ' ' ASN . . . . . 0.748 ' O ' ' N ' ' C' ' 7' ' ' ARG . . . -80.32 -178.29 6.55 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 121.142 3.756 . . . . 246.96 121.142 -179.756 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 6' ' ' PHE . . . . . 0.996 ' HD2' ' N ' ' C' ' 6' ' ' PHE . 0.0 OUTLIER -64.75 80.31 0.04 OUTLIER 'General case' 0 N--CA 1.433 -1.314 0 N-CA-C 105.951 -1.87 . . . . 213.9 105.951 -169.404 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 7' ' ' ARG . . . . . 0.833 ' O ' ' CB ' ' C' ' 8' ' ' THR . . . -101.18 118.68 37.47 Favored 'General case' 0 CA--C 1.502 -0.895 0 N-CA-C 107.792 -1.188 . . . . 229.27 107.792 176.877 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 8' ' ' THR . . . . . 0.833 ' CB ' ' O ' ' C' ' 7' ' ' ARG . . . . . . . . 0 C--N 1.292 -1.93 0 CA-C-O 116.505 -1.712 . . . . 251.11 111.243 -179.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 14' ' ' SER . . . . . . . . . . . . . 19.6 t . . . . . 0 N--CA 1.457 -0.08 0 CA-C-O 120.844 0.354 . . . . 228.78 110.879 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . . . -83.18 -5.93 59.3 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.326 0.584 . . . . 133.07 110.288 179.101 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 16' ' ' VAL . . . . . 0.65 HG11 HG11 ' C' ' 26' ' ' VAL . 2.6 t -47.31 -32.81 2.49 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-N 115.141 -0.936 . . . . 256.4 111.438 173.935 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 17' ' ' LEU . . . . . 0.707 HD21 HD11 ' C' ' 38' ' ' ILE . 7.6 mt -73.76 -49.47 25.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.924 -0.58 . . . . 184.67 111.283 179.213 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . . . -52.0 -30.62 25.99 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 115.589 1.7 . . . . 143.36 115.589 179.582 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 19' ' ' ASN . . . . . . . . . . . . . . . -126.25 75.54 1.53 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.055 -0.521 . . . . 209.43 112.223 173.866 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 20' ' ' VAL . . . . . . . . . . . . . 3.1 t -66.2 140.48 19.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 N-CA-C 108.273 -1.01 . . . . 279.79 108.273 174.612 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . . . -55.13 -63.5 1.14 Allowed 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.785 1.032 . . . . 195.77 113.785 -174.396 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -158.75 97.8 1.46 Allowed 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 107.936 -1.135 . . . . 184.51 107.936 -0.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 23' ' ' GLY . . . . . 0.806 ' N ' ' HA ' ' C' ' 24' ' ' GLU . . . -156.71 48.93 0.46 Allowed Glycine 0 CA--C 1.52 0.344 0 N-CA-C 116.892 1.517 . . . . 207.5 116.892 175.398 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 24' ' ' GLU . . . . . 0.806 ' HA ' ' N ' ' C' ' 23' ' ' GLY . . . -137.63 159.9 40.69 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 117.968 0.884 . . . . 158.97 109.158 -6.482 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 25' ' ' GLU . . . . . 0.417 ' HG3' ' O ' ' C' ' 77' ' ' HOH . 0.9 OUTLIER -127.66 -160.28 1.0 Allowed 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 114.514 1.301 . . . . 126.84 114.514 -174.032 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 26' ' ' VAL . . . . . 0.65 HG11 HG11 ' C' ' 16' ' ' VAL . 2.9 t 57.61 60.21 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-N 114.896 -1.047 . . . . 156.44 113.699 -178.25 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 27' ' ' GLU . . . . . . . . . . . . . . . -82.67 82.93 7.83 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.649 -0.705 . . . . 156.34 109.232 174.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 30.6 mt -53.57 117.98 1.02 Allowed 'Isoleucine or valine' 0 C--O 1.205 -1.28 0 N-CA-C 108.237 -1.023 . . . . 132.42 108.237 -178.822 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 29' ' ' THR . . . . . 0.76 HG23 ' N ' ' C' ' 30' ' ' ARG . 0.4 OUTLIER -91.95 170.29 9.98 Favored 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 107.009 -1.478 . . . . 188.97 107.009 -178.057 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 30' ' ' ARG . . . . . 0.76 ' N ' HG23 ' C' ' 29' ' ' THR . 1.0 OUTLIER -163.11 145.0 10.0 Favored 'General case' 0 C--O 1.221 -0.399 0 O-C-N 123.736 0.648 . . . . 225.74 112.165 175.098 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 31' ' ' ARG . . . . . . . . . . . . . . . -67.38 129.75 40.9 Favored 'General case' 0 C--O 1.204 -1.298 0 C-N-CA 119.441 -0.904 . . . . 104.15 109.857 -178.147 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . 46.81 42.16 14.57 Favored Glycine 0 N--CA 1.449 -0.481 0 N-CA-C 115.423 0.929 . . . . 125.01 115.423 178.552 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 33' ' ' ARG . . . . . . . . . . . . . . . -152.18 136.97 17.07 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.703 -0.48 . . . . 153.54 109.703 175.601 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 34' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -56.48 129.99 75.95 Favored Pre-proline 0 C--N 1.329 -0.325 0 C-N-CA 119.233 -0.987 . . . . 124.27 110.155 -178.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 35' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -67.92 145.51 68.42 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 120.494 0.796 . . . . 90.48 112.118 -175.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 36' ' ' ALA . . . . . . . . . . . . 0.259 . . -98.99 173.65 6.73 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 107.155 -1.424 . . . . 85.4 107.155 172.349 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 37' ' ' VAL . . . . . . . . . . . . . 5.7 t -132.89 159.96 42.89 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.782 0 C-N-CA 123.462 0.705 . . . . 85.67 110.385 173.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 38' ' ' ILE . . . . . 0.707 HD11 HD21 ' C' ' 17' ' ' LEU . 0.1 OUTLIER -133.23 77.06 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 N-CA-C 113.269 0.841 . . . . 120.94 113.269 174.126 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 39' ' ' VAL . . . . . 0.521 HG22 ' O ' ' C' ' 40' ' ' SER . 1.3 p -92.46 149.27 4.23 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.869 0 CA-C-N 114.745 -1.116 . . . . 105.62 112.637 -176.089 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 40' ' ' SER . . . . . 0.521 ' O ' HG22 ' C' ' 39' ' ' VAL . 0.1 OUTLIER -70.0 164.57 23.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.028 -0.533 . . . . 137.72 110.699 -177.842 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 41' ' ' LYS . . . . . . . . . . . . . 4.5 mttt -75.46 -23.45 56.87 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 107.702 -1.222 . . . . 124.06 107.702 -179.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.05 -43.16 71.82 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.071 -0.714 . . . . 124.33 109.071 -179.894 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 43' ' ' THR . . . . . 0.494 HG21 ' HA2' ' C' ' 23' ' ' GLY . 5.8 m -73.48 -28.98 62.22 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 119.996 -0.682 . . . . 130.27 109.826 179.294 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 44' ' ' PHE . . . . . 0.547 ' HE2' ' CE1' ' C' ' 47' ' ' TYR . 8.5 t80 -86.84 83.87 7.46 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.927 0.394 . . . . 117.83 110.28 -178.345 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 45' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -95.14 -30.26 14.13 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 114.077 1.139 . . . . 232.15 114.077 -169.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 46' ' ' ALA . . . . . . . . . . . . . . . -147.35 163.19 37.22 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 120.472 3.508 . . . . 164.1 120.472 -154.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 47' ' ' TYR . . . . . 0.941 ' HB3' ' CB ' ' C' ' 48' ' ' LYS . 7.3 m-85 -146.92 -164.52 2.01 Favored 'General case' 0 C--N 1.328 -0.33 1 N-CA-C 99.783 -4.155 . . . . 244.8 99.783 170.138 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 48' ' ' LYS . . . . . 0.941 ' CB ' ' HB3' ' C' ' 47' ' ' TYR . . . -151.52 126.6 9.81 Favored 'General case' 0 C--O 1.269 2.093 1 C-N-CA 132.043 4.137 . . . . 189.54 111.16 -13.743 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--N 1.292 -1.903 0 CA-C-N 118.933 0.788 . . . . 267.65 111.162 -177.446 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 74' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 75' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 76' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 77' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 78' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 79' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 80' ' ' HOH . . . . . 0.64 ' O ' ' O ' ' A' ' 1' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 87' ' ' HOH . . . . . 0.462 ' O ' ' OG1' ' A' ' 62' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 89' ' ' HOH . . . . . 0.47 ' O ' ' NH2' ' A' ' 10' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' HOH . . . . . 1.148 ' O ' ' CB ' ' A' ' 18' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 74' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 75' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 76' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 77' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 79' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 80' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 89' ' ' HOH . . . . . 0.752 ' O ' ' HG3' ' A' ' 34' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 74' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 75' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 76' ' ' HOH . . . . . 0.734 ' O ' ' O ' ' C' ' 3' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 77' ' ' HOH . . . . . 0.417 ' O ' ' HG3' ' C' ' 25' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 78' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 79' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' MET . . . . . 0.64 ' O ' ' O ' ' A' ' 80' ' ' HOH . 5.1 ttt . . . . . 0 C--O 1.221 -0.43 0 N-CA-C 111.473 0.175 . . . . 180.07 111.473 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' GLN . . . . . . . . . . . . . 29.3 tt0 -62.8 144.29 56.67 Favored 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 126.109 1.763 . . . . 108.24 109.714 178.216 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 32.3 t -135.76 118.32 15.91 Favored 'General case' 0 CA--C 1.518 -0.266 0 C-N-CA 120.786 -0.365 . . . . 82.39 111.59 -179.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ILE . . . . . 0.468 ' CD1' HG11 ' A' ' 26' ' ' VAL . 1.5 pt -127.14 164.58 27.6 Favored 'Isoleucine or valine' 0 C--O 1.184 -2.382 0 C-N-CA 122.716 0.407 . . . . 86.44 111.811 -179.419 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ASN . . . . . 0.698 ' OD1' ' HD3' ' A' ' 7' ' ' ARG . 4.5 p30 -86.62 169.94 12.28 Favored 'General case' 0 C--N 1.313 -1.007 0 C-N-CA 124.185 0.994 . . . . 74.11 109.248 176.694 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' PHE . . . . . 0.727 ' HD2' ' HG3' ' A' ' 7' ' ' ARG . 0.2 OUTLIER -62.77 -42.34 99.65 Favored 'General case' 0 C--O 1.196 -1.728 0 CA-C-N 114.905 -1.043 . . . . 100.09 110.113 -173.454 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.727 ' HG3' ' HD2' ' A' ' 6' ' ' PHE . 0.0 OUTLIER -78.22 -19.54 53.6 Favored 'General case' 0 C--N 1.304 -1.393 0 CA-C-N 115.069 -0.969 . . . . 189.86 113.594 -173.938 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 4.6 m -86.04 -26.49 25.32 Favored 'General case' 0 N--CA 1.466 0.35 0 N-CA-C 107.892 -1.151 . . . . 61.58 107.892 170.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.581 ' CB ' HD13 ' A' ' 28' ' ' ILE . . . -71.66 -47.61 53.16 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.229 -0.896 . . . . 74.94 112.41 172.856 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ARG . . . . . 0.47 ' NH2' ' O ' ' A' ' 89' ' ' HOH . 69.0 ttt180 -51.33 -58.47 6.12 Favored 'General case' 0 CA--C 1.492 -1.261 0 N-CA-C 107.285 -1.376 . . . . 102.92 107.285 174.498 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -58.86 -55.41 31.04 Favored Glycine 0 C--N 1.314 -0.663 0 N-CA-C 118.147 2.019 . . . . 77.69 118.147 -174.102 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ASN . . . . . 0.602 ' O ' HG23 ' A' ' 16' ' ' VAL . 14.1 m120 -106.58 25.47 11.14 Favored 'General case' 0 C--N 1.326 -0.453 0 N-CA-C 113.92 1.082 . . . . 73.81 113.92 -173.986 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LEU . . . . . 0.531 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 1.5 tp -50.1 -43.12 51.44 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 114.792 1.404 . . . . 63.8 114.792 -178.601 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' SER . . . . . . . . . . . . . 40.4 t -54.31 -56.44 18.44 Favored 'General case' 0 C--N 1.327 -0.387 0 CA-C-N 115.862 -0.608 . . . . 77.82 109.96 177.046 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . . . -64.67 -12.18 43.54 Favored 'General case' 0 C--N 1.332 -0.184 0 CA-C-N 115.969 -0.56 . . . . 81.56 112.042 178.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' VAL . . . . . 0.602 HG23 ' O ' ' A' ' 12' ' ' ASN . 73.4 t -89.26 -35.27 7.46 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.456 0 CA-C-O 121.47 0.653 . . . . 80.32 110.3 -178.43 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.531 ' HG ' ' O ' ' A' ' 13' ' ' LEU . 39.4 mt -72.71 -30.89 64.57 Favored 'General case' 0 N--CA 1.444 -0.743 0 CA-C-N 115.735 -0.666 . . . . 67.75 109.559 -179.816 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' ASN . . . . . 1.148 ' CB ' ' O ' ' A' ' 90' ' ' HOH . . . -63.24 -30.48 71.61 Favored 'General case' 0 CA--C 1.5 -0.961 0 N-CA-C 106.945 -1.502 . . . . 60.46 106.945 177.232 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ASN . . . . . 0.421 ' HB2' ' O ' ' A' ' 16' ' ' VAL . 15.5 m-20 -76.5 -42.43 43.41 Favored 'General case' 0 N--CA 1.468 0.471 0 N-CA-C 115.233 1.568 . . . . 66.24 115.233 178.82 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.493 HG13 ' O ' ' A' ' 24' ' ' GLU . 91.2 t -74.47 -19.21 16.9 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.386 0 N-CA-C 108.504 -0.924 . . . . 70.46 108.504 179.716 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.544 ' OE1' ' NH1' ' B' ' 33' ' ' ARG . 25.1 tt0 -81.69 -0.12 41.31 Favored 'General case' 0 C--N 1.317 -0.842 0 CA-C-N 114.868 -1.06 . . . . 105.51 110.906 176.35 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -110.47 -11.15 14.52 Favored 'General case' 0 C--N 1.314 -0.957 0 CA-C-N 115.478 -0.783 . . . . 110.24 110.367 -178.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 131.68 -4.01 5.41 Favored Glycine 0 C--O 1.227 -0.282 0 N-CA-C 114.512 0.565 . . . . 92.75 114.512 -179.827 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.493 ' O ' HG13 ' A' ' 20' ' ' VAL . . . -84.35 150.97 25.01 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 122.682 1.23 . . . . 79.18 113.596 -176.099 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 59.6 mt-10 -120.48 115.07 22.75 Favored 'General case' 0 N--CA 1.441 -0.877 0 N-CA-C 106.134 -1.802 . . . . 116.84 106.134 171.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' VAL . . . . . 0.468 HG11 ' CD1' ' A' ' 4' ' ' ILE . 86.8 t -107.99 117.13 52.97 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.345 -0.388 . . . . 76.07 111.753 -172.724 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 54.1 tt0 -90.18 92.3 8.89 Favored 'General case' 0 N--CA 1.467 0.411 0 N-CA-C 114.682 1.364 . . . . 64.86 114.682 -172.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.853 HD11 HD11 ' A' ' 38' ' ' ILE . 0.5 OUTLIER -71.56 105.24 1.76 Allowed 'Isoleucine or valine' 0 C--O 1.203 -1.362 0 O-C-N 120.654 -1.279 . . . . 66.17 111.126 179.938 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 41.3 p -89.59 159.49 17.15 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 123.393 0.677 . . . . 67.44 110.481 178.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ARG . . . . . 0.587 ' HB2' ' HB2' ' A' ' 33' ' ' ARG . 22.7 mtm180 -144.73 166.12 26.12 Favored 'General case' 0 N--CA 1.463 0.224 0 N-CA-C 110.264 -0.272 . . . . 100.38 110.264 175.039 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.77 ' O ' ' HG2' ' A' ' 33' ' ' ARG . . . -75.7 123.83 26.23 Favored 'General case' 0 N--CA 1.464 0.242 0 N-CA-C 113.447 0.906 . . . . 138.51 113.447 -177.044 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 66.01 -4.78 2.26 Favored Glycine 0 C--N 1.333 0.367 0 N-CA-C 111.033 -0.827 . . . . 101.86 111.033 -177.391 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.77 ' HG2' ' O ' ' A' ' 31' ' ' ARG . 0.0 OUTLIER -103.42 152.48 21.57 Favored 'General case' 0 C--O 1.199 -1.566 0 CA-C-O 122.202 1.001 . . . . 143.38 112.455 -174.778 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLU . . . . . 0.752 ' HG3' ' O ' ' B' ' 89' ' ' HOH . 79.1 mm-40 -82.4 143.03 47.38 Favored Pre-proline 0 C--N 1.301 -1.527 0 CA-C-N 115.429 -0.805 . . . . 91.24 111.175 179.579 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -62.99 130.58 29.57 Favored 'Trans proline' 0 CA--C 1.553 1.45 1 C-N-CA 127.997 5.798 . . . . 80.42 118.222 -172.367 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ALA . . . . . 0.656 ' CB ' HD12 ' B' ' 17' ' ' LEU . . . -101.8 133.59 46.3 Favored 'General case' 0 CA--C 1.529 0.155 0 CA-C-N 114.947 -1.024 . . . . 67.34 109.827 168.015 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' VAL . . . . . . . . . . . . . 3.9 p -117.37 158.89 17.83 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.823 0 N-CA-C 109.065 -0.717 . . . . 65.0 109.065 -179.959 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.853 HD11 HD11 ' A' ' 28' ' ' ILE . 10.4 mt -131.21 114.54 26.65 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.618 0 CA-C-N 115.63 -0.714 . . . . 60.92 111.701 -176.792 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.888 HG13 ' HB2' ' A' ' 44' ' ' PHE . 11.1 p -122.75 151.21 26.75 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.815 0 N-CA-C 104.694 -2.336 . . . . 69.2 104.694 -179.7 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' SER . . . . . . . . . . . . . 94.3 p -63.82 167.09 6.4 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.223 -0.591 . . . . 83.69 111.657 179.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' LYS . . . . . 0.452 ' HE3' ' OE1' ' B' ' 27' ' ' GLU . 24.5 tttt -69.62 -40.79 76.39 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 120.198 -0.601 . . . . 98.48 112.275 -175.968 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . -59.95 -58.84 6.81 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 120.865 -0.334 . . . . 83.56 111.009 178.09 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . . . -62.68 -23.04 66.93 Favored 'General case' 0 CA--C 1.513 -0.479 0 N-CA-C 112.821 0.674 . . . . 87.67 112.821 -179.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' PHE . . . . . 0.888 ' HB2' HG13 ' A' ' 39' ' ' VAL . 45.6 t80 -81.04 -47.94 12.88 Favored 'General case' 0 CA--C 1.54 0.56 0 N-CA-C 114.465 1.283 . . . . 67.32 114.465 -176.628 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . . . -85.04 6.24 26.17 Favored 'General case' 0 N--CA 1.472 0.637 0 CA-C-O 120.95 0.405 . . . . 116.81 110.507 -178.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -96.5 -38.38 10.03 Favored 'General case' 0 C--O 1.226 -0.142 0 CA-C-N 115.321 -0.854 . . . . 92.08 109.566 177.798 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.425 ' HD2' ' CE1' ' B' ' 44' ' ' PHE . 17.0 m-85 -75.59 -19.13 59.47 Favored 'General case' 0 N--CA 1.466 0.369 0 N-CA-C 108.772 -0.825 . . . . 85.3 108.772 171.72 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 30.0 ttpt -82.0 -54.07 5.61 Favored 'General case' 0 C--N 1.33 -0.257 0 N-CA-C 115.334 1.605 . . . . 88.36 115.334 176.41 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' LYS . . . . . . . . . . . . . . . -52.82 -51.14 62.0 Favored 'General case' 0 N--CA 1.465 0.287 0 CA-C-O 120.988 0.423 . . . . 124.26 110.708 172.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -83.71 18.95 1.77 Allowed 'General case' 0 N--CA 1.45 -0.448 0 CA-C-N 115.905 -0.589 . . . . 87.12 111.865 -178.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ALA . . . . . . . . . . . . . . . -99.27 -29.77 12.62 Favored 'General case' 0 CA--C 1.513 -0.474 0 N-CA-C 106.431 -1.692 . . . . 99.48 106.431 177.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' LEU . . . . . 0.482 ' N ' HD23 ' A' ' 52' ' ' LEU . 0.3 OUTLIER -95.9 26.98 3.77 Favored 'General case' 0 C--O 1.208 -1.11 0 N-CA-C 108.139 -1.06 . . . . 89.87 108.139 179.236 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ASP . . . . . 0.703 ' N ' ' OD1' ' A' ' 53' ' ' ASP . 0.0 OUTLIER 50.42 59.71 4.37 Favored 'General case' 0 N--CA 1.447 -0.583 0 N-CA-C 104.874 -2.269 . . . . 199.41 104.874 -173.786 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -46.0 142.95 2.44 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 120.498 3.518 . . . . 124.91 120.498 -155.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . . . -161.11 169.51 22.24 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 117.449 2.389 . . . . 135.02 117.449 2.554 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . 0.261 . . -151.18 -29.69 0.18 Allowed 'General case' 0 CA--C 1.539 0.55 1 N-CA-C 122.617 4.302 . . . . 119.1 122.617 -179.656 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . 68.81 -124.54 0.14 Allowed 'General case' 0 N--CA 1.475 0.776 0 N-CA-C 120.786 3.625 . . . . 131.97 120.786 -177.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 70.7 m -172.05 -108.57 0.01 OUTLIER 'General case' 0 C--O 1.244 0.805 0 CA-C-O 121.884 0.849 . . . . 134.6 112.703 -179.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . . . -68.77 -26.61 65.31 Favored 'General case' 0 CA--C 1.513 -0.457 0 CA-C-N 115.075 -0.966 . . . . 96.89 110.183 -178.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.721 ' CG ' ' O ' ' A' ' 60' ' ' PHE . . . -94.39 9.45 38.24 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.888 -0.782 . . . . 82.7 108.888 175.755 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . . . -92.13 50.65 1.68 Allowed 'General case' 0 N--CA 1.453 -0.287 0 CA-C-N 115.603 -0.726 . . . . 73.28 111.227 -178.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' THR . . . . . 0.599 ' H ' ' CA ' ' A' ' 63' ' ' LEU . 25.2 m 151.11 43.74 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 121.181 0.515 . . . . 70.32 110.356 178.559 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.599 ' CA ' ' H ' ' A' ' 62' ' ' THR . . . 71.08 3.6 4.73 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.649 -0.705 . . . . 52.19 111.407 178.959 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.592 ' HB2' ' O ' ' A' ' 63' ' ' LEU . 10.9 t0 139.25 -118.57 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 108.829 -0.804 . . . . 77.29 108.829 168.877 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' SER . . . . . 0.407 ' H ' ' HB3' ' A' ' 64' ' ' ASP . . . -142.98 -115.68 0.1 Allowed 'General case' 0 C--O 1.235 0.32 0 CA-C-N 115.885 -0.598 . . . . 63.31 112.37 -177.531 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' THR . . . . . . . . . . . . . . . 171.89 69.54 0.0 OUTLIER 'General case' 0 N--CA 1.455 -0.213 0 N-CA-C 109.881 -0.415 . . . . 70.67 109.881 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ASN . . . . . . . . . . . . . 6.6 m-20 . . . . . 0 C--N 1.329 -0.308 0 N-CA-C 113.709 1.003 . . . . 86.2 113.709 -178.036 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' MET . . . . . 0.687 ' HG3' ' H ' ' B' ' 3' ' ' SER . 0.5 OUTLIER . . . . . 0 C--O 1.194 -1.836 0 N-CA-C 112.062 0.393 . . . . 120.98 112.062 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' GLN . . . . . 0.439 ' N ' ' HG3' ' B' ' 1' ' ' MET . 0.1 OUTLIER -97.07 14.42 25.72 Favored 'General case' 0 C--O 1.186 -2.267 0 N-CA-C 115.495 1.665 . . . . 103.14 115.495 -177.023 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' SER . . . . . 0.687 ' H ' ' HG3' ' B' ' 1' ' ' MET . 33.9 t -135.93 124.52 23.66 Favored 'General case' 0 C--O 1.201 -1.477 0 C-N-CA 118.192 -1.403 . . . . 100.57 111.704 164.134 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' ILE . . . . . 0.438 ' O ' ' HA ' ' B' ' 28' ' ' ILE . . . -142.82 125.04 12.98 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.304 0 N-CA-C 105.686 -1.968 . . . . 84.66 105.686 -169.557 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' ASN . . . . . 0.964 HD21 ' CB ' ' B' ' 8' ' ' THR . 0.3 OUTLIER -65.52 178.14 1.04 Allowed 'General case' 0 C--O 1.223 -0.309 0 N-CA-C 112.845 0.683 . . . . 130.39 112.845 174.653 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' PHE . . . . . . . . . . . . . . . -66.79 -47.84 70.86 Favored 'General case' 0 C--N 1.329 -0.304 0 C-N-CA 120.889 -0.324 . . . . 56.16 111.002 179.082 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' ARG . . . . . . . . . . . . . 8.8 ttm180 -61.83 -30.52 70.89 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 113.095 0.776 . . . . 181.17 113.095 -178.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' THR . . . . . 0.964 ' CB ' HD21 ' B' ' 5' ' ' ASN . . . -87.34 -17.83 31.49 Favored 'General case' 0 C--N 1.329 -0.294 0 N-CA-C 112.289 0.478 . . . . 105.86 112.289 -177.77 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' ALA . . . . . . . . . . . . . . . -79.01 -56.78 4.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.387 -0.37 . . . . 79.55 111.672 -178.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' ARG . . . . . . . . . . . . . . . -68.57 -44.0 75.39 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.208 -0.451 . . . . 157.72 111.213 -179.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' GLY . . . . . . . . . . . . . . . -56.74 -8.94 3.21 Favored Glycine 0 N--CA 1.425 -2.057 0 C-N-CA 118.957 -1.592 . . . . 115.31 113.075 176.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' ASN . . . . . . . . . . . . . . . -149.29 27.7 0.83 Allowed 'General case' 0 CA--C 1.499 -0.996 0 N-CA-C 115.499 1.666 . . . . 113.58 115.499 -175.562 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' LEU . . . . . 0.603 ' HA ' ' HB ' ' B' ' 16' ' ' VAL . 9.3 tp -54.78 -32.54 60.22 Favored 'General case' 0 N--CA 1.426 -1.627 0 CA-C-N 115.63 -0.713 . . . . 86.72 112.856 -174.178 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' SER . . . . . 0.474 ' O ' ' ND2' ' B' ' 18' ' ' ASN . 18.1 t -51.37 -54.44 26.46 Favored 'General case' 0 CA--C 1.51 -0.567 0 N-CA-C 108.31 -0.996 . . . . 94.32 108.31 179.517 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -70.04 -27.47 64.67 Favored 'General case' 0 C--O 1.178 -2.695 0 C-N-CA 120.511 -0.476 . . . . 104.66 109.921 -178.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.603 ' HB ' ' HA ' ' B' ' 13' ' ' LEU . 2.5 t -63.02 -47.48 92.52 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.484 0 N-CA-C 113.426 0.899 . . . . 81.26 113.426 -174.471 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' LEU . . . . . 0.656 HD12 ' CB ' ' A' ' 36' ' ' ALA . 0.7 OUTLIER -70.65 -37.92 73.77 Favored 'General case' 0 CA--C 1.545 0.751 0 O-C-N 123.587 0.555 . . . . 86.24 112.371 176.524 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' ASN . . . . . 0.474 ' ND2' ' O ' ' B' ' 14' ' ' SER . 0.8 OUTLIER -49.91 -40.61 43.8 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-O 122.486 1.136 . . . . 63.19 112.309 175.438 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -88.79 -19.59 25.81 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-N 114.373 -1.285 . . . . 71.74 111.724 -178.856 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' VAL . . . . . 0.508 HG23 ' O ' ' B' ' 16' ' ' VAL . 8.4 t -72.35 -44.63 62.77 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.545 0 CA-C-O 121.615 0.721 . . . . 60.04 110.235 171.352 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' GLU . . . . . 0.568 ' OE2' ' NH1' ' A' ' 33' ' ' ARG . 1.0 OUTLIER -60.63 -24.78 65.8 Favored 'General case' 0 N--CA 1.422 -1.856 0 CA-C-O 121.99 0.9 . . . . 90.98 109.908 177.077 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' ALA . . . . . 0.457 ' N ' ' HA2' ' B' ' 23' ' ' GLY . . . -87.79 3.01 49.79 Favored 'General case' 0 C--O 1.189 -2.12 1 N-CA-C 122.778 4.362 . . . . 89.7 122.778 -165.961 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' GLY . . . . . 0.457 ' HA2' ' N ' ' B' ' 22' ' ' ALA . . . -124.22 103.97 0.79 Allowed Glycine 0 N--CA 1.429 -1.772 0 C-N-CA 128.991 3.186 . . . . 129.51 114.235 -26.443 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' GLU . . . . . . . . . . . . . 5.2 tp10 -65.53 150.37 48.5 Favored 'General case' 0 C--O 1.199 -1.597 0 C-N-CA 126.032 1.733 . . . . 167.28 113.217 167.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -96.02 107.93 20.28 Favored 'General case' 0 C--O 1.194 -1.82 0 N-CA-C 104.685 -2.339 . . . . 132.67 104.685 162.998 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' VAL . . . . . 0.617 ' HB ' HG23 ' B' ' 38' ' ' ILE . 39.1 t -95.11 133.67 35.19 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.418 0 C-N-CA 124.069 0.948 . . . . 57.47 111.108 178.615 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' GLU . . . . . 0.841 ' HG3' ' O ' ' B' ' 36' ' ' ALA . 34.2 tt0 -108.39 117.58 34.54 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 113.1 0.778 . . . . 120.33 113.1 -179.905 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' ILE . . . . . 0.438 ' HA ' ' O ' ' B' ' 4' ' ' ILE . 80.4 mt -97.15 100.09 10.09 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-O 120.875 0.369 . . . . 92.9 111.608 -178.069 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 13.1 p -93.38 146.51 23.69 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-O 121.186 0.517 . . . . 63.0 112.234 -176.224 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' ARG . . . . . 0.634 ' HG3' ' HB2' ' B' ' 33' ' ' ARG . 0.0 OUTLIER -130.06 156.13 45.02 Favored 'General case' 0 CA--C 1.508 -0.654 0 N-CA-C 114.077 1.14 . . . . 85.78 114.077 -179.53 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 3.8 ttp-105 -68.61 91.96 0.45 Allowed 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 114.767 -1.106 . . . . 132.46 112.243 -171.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' GLY . . . . . . . . . . . . . . . 105.29 -15.05 47.26 Favored Glycine 0 N--CA 1.452 -0.297 0 CA-C-N 115.496 -0.774 . . . . 83.61 112.343 176.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' ARG . . . . . 0.634 ' HB2' ' HG3' ' B' ' 30' ' ' ARG . 12.6 mmm180 -102.56 158.81 15.97 Favored 'General case' 0 N--CA 1.463 0.178 0 N-CA-C 112.649 0.611 . . . . 122.47 112.649 -172.906 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' GLU . . . . . . . . . . . . . . . -60.0 149.52 73.62 Favored Pre-proline 0 C--O 1.246 0.897 0 CA-C-N 116.263 -0.426 . . . . 76.68 110.997 -177.98 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' PRO . . . . . . . . . . . . . 7.0 Cg_exo -78.42 148.18 23.36 Favored 'Trans proline' 0 N--CA 1.45 -1.087 0 C-N-CA 123.677 2.918 . . . . 84.83 111.152 -177.464 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' ALA . . . . . 0.841 ' O ' ' HG3' ' B' ' 27' ' ' GLU . . . -115.24 176.38 5.09 Favored 'General case' 0 C--N 1.324 -0.526 0 CA-C-O 120.951 0.405 . . . . 84.86 111.294 175.891 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' VAL . . . . . 0.446 HG11 ' CE2' ' A' ' 44' ' ' PHE . 3.7 t -143.64 118.7 4.18 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.039 0 N-CA-C 108.674 -0.861 . . . . 51.47 108.674 177.237 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' ILE . . . . . 0.617 HG23 ' HB ' ' B' ' 26' ' ' VAL . 6.1 tt -101.66 109.55 26.21 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.425 0 C-N-CA 120.039 -0.665 . . . . 64.34 112.17 174.713 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' VAL . . . . . . . . . . . . . 7.5 p -126.15 154.45 35.42 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.421 0 N-CA-C 106.692 -1.595 . . . . 57.99 106.692 -176.188 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' SER . . . . . . . . . . . . . 51.6 p -58.73 134.97 57.29 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 112.023 0.379 . . . . 60.98 112.023 -175.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' LYS . . . . . 0.411 ' NZ ' ' HB3' ' C' ' 3' ' ' SER . 59.0 tttt -49.5 -51.59 35.18 Favored 'General case' 0 CA--C 1.52 -0.195 0 C-N-CA 118.946 -1.101 . . . . 88.61 110.43 -179.76 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' ALA . . . . . . . . . . . . . . . -41.01 -42.62 1.94 Allowed 'General case' 0 C--N 1.327 -0.385 0 CA-C-N 115.674 -0.694 . . . . 70.71 111.42 -177.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' THR . . . . . 0.431 HG22 ' CE2' ' B' ' 47' ' ' TYR . 88.0 m -81.25 -45.06 16.84 Favored 'General case' 0 C--N 1.328 -0.355 0 N-CA-C 113.796 1.036 . . . . 91.95 113.796 -171.527 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' PHE . . . . . 0.426 ' CE2' ' CD ' ' B' ' 48' ' ' LYS . 76.4 t80 -63.17 -40.99 99.12 Favored 'General case' 0 C--N 1.323 -0.544 0 C-N-CA 119.731 -0.788 . . . . 84.58 110.407 177.715 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 14.6 mm-40 -51.33 -25.51 6.07 Favored 'General case' 0 CA--C 1.516 -0.362 0 C-N-CA 120.32 -0.552 . . . . 109.22 110.584 176.141 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . -89.08 -37.35 15.18 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 112.617 0.599 . . . . 60.03 112.617 176.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' TYR . . . . . 0.431 ' CE2' HG22 ' B' ' 43' ' ' THR . 20.3 m-85 -55.13 -56.23 22.18 Favored 'General case' 0 CA--C 1.517 -0.319 0 N-CA-C 105.85 -1.908 . . . . 76.85 105.85 169.793 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' LYS . . . . . 0.629 ' O ' ' HB3' ' B' ' 51' ' ' ALA . 1.1 tttp -54.93 -49.37 71.48 Favored 'General case' 0 N--CA 1.437 -1.088 0 CA-C-O 121.668 0.747 . . . . 133.98 110.807 -178.648 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' LYS . . . . . . . . . . . . . 40.4 tttp -56.65 -52.38 65.11 Favored 'General case' 0 C--N 1.315 -0.923 0 CA-C-N 115.947 -0.57 . . . . 94.61 111.293 -176.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -43.1 116.43 0.9 Allowed 'General case' 0 C--N 1.323 -0.554 0 N-CA-C 107.651 -1.24 . . . . 80.85 107.651 169.382 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' ALA . . . . . 1.113 ' H ' ' HA ' ' B' ' 52' ' ' LEU . . . -131.77 -24.34 2.2 Favored 'General case' 0 C--N 1.33 -0.253 0 CA-C-N 115.716 -0.674 . . . . 114.7 110.909 -177.83 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' LEU . . . . . 1.113 ' HA ' ' H ' ' B' ' 51' ' ' ALA . . . -120.71 -147.78 0.4 Allowed 'General case' 0 C--O 1.222 -0.381 0 N-CA-C 113.469 0.915 . . . . 75.63 113.469 . . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -125.33 128.7 48.61 Favored 'General case' 0 CA--C 1.539 0.52 0 CA-C-N 115.91 -0.587 . . . . 84.78 112.477 -175.999 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -114.53 8.97 16.56 Favored 'General case' 0 C--N 1.329 -0.316 0 C-N-CA 124.793 1.237 . . . . 79.87 114.075 8.564 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' GLU . . . . . . . . . . . . . 18.9 mp0 . . . . . 0 C--N 1.333 -0.127 0 CA-C-O 120.957 0.408 . . . . 94.74 111.339 174.416 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 2' ' ' GLN . . . . . . . . . . . . . . . . . . . . 0 C--O 1.208 -1.117 0 N-CA-C 109.87 -0.418 . . . . 203.71 109.87 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 3' ' ' SER . . . . . 0.734 ' O ' ' O ' ' C' ' 76' ' ' HOH . 8.8 t -81.58 164.6 21.79 Favored 'General case' 0 C--O 1.206 -1.195 0 N-CA-C 118.676 2.843 . . . . 166.09 118.676 -161.992 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 4' ' ' ILE . . . . . . . . . . . . . . . -162.73 136.98 1.29 Allowed 'Isoleucine or valine' 0 C--O 1.219 -0.552 0 C-N-CA 125.643 1.577 . . . . 232.45 108.621 -178.082 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 5' ' ' ASN . . . . . 0.748 ' O ' ' N ' ' C' ' 7' ' ' ARG . . . -80.32 -178.29 6.55 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 121.142 3.756 . . . . 246.96 121.142 -179.756 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 6' ' ' PHE . . . . . 0.996 ' HD2' ' N ' ' C' ' 6' ' ' PHE . 0.0 OUTLIER -64.75 80.31 0.04 OUTLIER 'General case' 0 N--CA 1.433 -1.314 0 N-CA-C 105.951 -1.87 . . . . 213.9 105.951 -169.404 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 7' ' ' ARG . . . . . 0.833 ' O ' ' CB ' ' C' ' 8' ' ' THR . . . -101.18 118.68 37.47 Favored 'General case' 0 CA--C 1.502 -0.895 0 N-CA-C 107.792 -1.188 . . . . 229.27 107.792 176.877 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 8' ' ' THR . . . . . 0.833 ' CB ' ' O ' ' C' ' 7' ' ' ARG . . . . . . . . 0 C--N 1.292 -1.93 0 CA-C-O 116.505 -1.712 . . . . 251.11 111.243 -179.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 14' ' ' SER . . . . . . . . . . . . . 19.6 t . . . . . 0 N--CA 1.457 -0.08 0 CA-C-O 120.844 0.354 . . . . 228.78 110.879 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 15' ' ' GLU . . . . . . . . . . . . . . . -83.18 -5.93 59.3 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-O 121.326 0.584 . . . . 133.07 110.288 179.101 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 16' ' ' VAL . . . . . 0.65 HG11 HG11 ' C' ' 26' ' ' VAL . 2.6 t -47.31 -32.81 2.49 Favored 'Isoleucine or valine' 0 C--O 1.233 0.236 0 CA-C-N 115.141 -0.936 . . . . 256.4 111.438 173.935 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 17' ' ' LEU . . . . . 0.707 HD21 HD11 ' C' ' 38' ' ' ILE . 7.6 mt -73.76 -49.47 25.29 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 115.924 -0.58 . . . . 184.67 111.283 179.213 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 18' ' ' ASN . . . . . . . . . . . . . . . -52.0 -30.62 25.99 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 115.589 1.7 . . . . 143.36 115.589 179.582 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 19' ' ' ASN . . . . . . . . . . . . . . . -126.25 75.54 1.53 Allowed 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.055 -0.521 . . . . 209.43 112.223 173.866 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 20' ' ' VAL . . . . . . . . . . . . . 3.1 t -66.2 140.48 19.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 N-CA-C 108.273 -1.01 . . . . 279.79 108.273 174.612 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 21' ' ' GLU . . . . . . . . . . . . . . . -55.13 -63.5 1.14 Allowed 'General case' 0 CA--C 1.534 0.361 0 N-CA-C 113.785 1.032 . . . . 195.77 113.785 -174.396 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -158.75 97.8 1.46 Allowed 'General case' 0 C--N 1.333 -0.135 0 N-CA-C 107.936 -1.135 . . . . 184.51 107.936 -0.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 23' ' ' GLY . . . . . 0.806 ' N ' ' HA ' ' C' ' 24' ' ' GLU . . . -156.71 48.93 0.46 Allowed Glycine 0 CA--C 1.52 0.344 0 N-CA-C 116.892 1.517 . . . . 207.5 116.892 175.398 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 24' ' ' GLU . . . . . 0.806 ' HA ' ' N ' ' C' ' 23' ' ' GLY . . . -137.63 159.9 40.69 Favored 'General case' 0 C--N 1.331 -0.201 0 CA-C-N 117.968 0.884 . . . . 158.97 109.158 -6.482 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 25' ' ' GLU . . . . . 0.417 ' HG3' ' O ' ' C' ' 77' ' ' HOH . 0.9 OUTLIER -127.66 -160.28 1.0 Allowed 'General case' 0 N--CA 1.466 0.351 0 N-CA-C 114.514 1.301 . . . . 126.84 114.514 -174.032 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 26' ' ' VAL . . . . . 0.65 HG11 HG11 ' C' ' 16' ' ' VAL . 2.9 t 57.61 60.21 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 CA-C-N 114.896 -1.047 . . . . 156.44 113.699 -178.25 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 27' ' ' GLU . . . . . . . . . . . . . . . -82.67 82.93 7.83 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.649 -0.705 . . . . 156.34 109.232 174.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 28' ' ' ILE . . . . . . . . . . . . . 30.6 mt -53.57 117.98 1.02 Allowed 'Isoleucine or valine' 0 C--O 1.205 -1.28 0 N-CA-C 108.237 -1.023 . . . . 132.42 108.237 -178.822 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 29' ' ' THR . . . . . 0.76 HG23 ' N ' ' C' ' 30' ' ' ARG . 0.4 OUTLIER -91.95 170.29 9.98 Favored 'General case' 0 C--N 1.313 -0.993 0 N-CA-C 107.009 -1.478 . . . . 188.97 107.009 -178.057 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 30' ' ' ARG . . . . . 0.76 ' N ' HG23 ' C' ' 29' ' ' THR . 1.0 OUTLIER -163.11 145.0 10.0 Favored 'General case' 0 C--O 1.221 -0.399 0 O-C-N 123.736 0.648 . . . . 225.74 112.165 175.098 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 31' ' ' ARG . . . . . . . . . . . . . . . -67.38 129.75 40.9 Favored 'General case' 0 C--O 1.204 -1.298 0 C-N-CA 119.441 -0.904 . . . . 104.15 109.857 -178.147 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 32' ' ' GLY . . . . . . . . . . . . . . . 46.81 42.16 14.57 Favored Glycine 0 N--CA 1.449 -0.481 0 N-CA-C 115.423 0.929 . . . . 125.01 115.423 178.552 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 33' ' ' ARG . . . . . . . . . . . . . . . -152.18 136.97 17.07 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 109.703 -0.48 . . . . 153.54 109.703 175.601 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 34' ' ' GLU . . . . . . . . . . . . . 9.4 mm-40 -56.48 129.99 75.95 Favored Pre-proline 0 C--N 1.329 -0.325 0 C-N-CA 119.233 -0.987 . . . . 124.27 110.155 -178.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 35' ' ' PRO . . . . . . . . . . . . . 3.2 Cg_exo -67.92 145.51 68.42 Favored 'Trans proline' 0 C--N 1.352 0.727 0 C-N-CA 120.494 0.796 . . . . 90.48 112.118 -175.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 36' ' ' ALA . . . . . . . . . . . . 0.259 . . -98.99 173.65 6.73 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 107.155 -1.424 . . . . 85.4 107.155 172.349 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 37' ' ' VAL . . . . . . . . . . . . . 5.7 t -132.89 159.96 42.89 Favored 'Isoleucine or valine' 0 C--O 1.214 -0.782 0 C-N-CA 123.462 0.705 . . . . 85.67 110.385 173.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 38' ' ' ILE . . . . . 0.707 HD11 HD21 ' C' ' 17' ' ' LEU . 0.1 OUTLIER -133.23 77.06 0.47 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.55 0 N-CA-C 113.269 0.841 . . . . 120.94 113.269 174.126 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 39' ' ' VAL . . . . . 0.521 HG22 ' O ' ' C' ' 40' ' ' SER . 1.3 p -92.46 149.27 4.23 Favored 'Isoleucine or valine' 0 CA--C 1.502 -0.869 0 CA-C-N 114.745 -1.116 . . . . 105.62 112.637 -176.089 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 40' ' ' SER . . . . . 0.521 ' O ' HG22 ' C' ' 39' ' ' VAL . 0.1 OUTLIER -70.0 164.57 23.66 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.028 -0.533 . . . . 137.72 110.699 -177.842 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 41' ' ' LYS . . . . . . . . . . . . . 4.5 mttt -75.46 -23.45 56.87 Favored 'General case' 0 N--CA 1.43 -1.459 0 N-CA-C 107.702 -1.222 . . . . 124.06 107.702 -179.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 42' ' ' ALA . . . . . . . . . . . . . . . -70.05 -43.16 71.82 Favored 'General case' 0 N--CA 1.453 -0.314 0 N-CA-C 109.071 -0.714 . . . . 124.33 109.071 -179.894 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 43' ' ' THR . . . . . 0.494 HG21 ' HA2' ' C' ' 23' ' ' GLY . 5.8 m -73.48 -28.98 62.22 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 119.996 -0.682 . . . . 130.27 109.826 179.294 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 44' ' ' PHE . . . . . 0.547 ' HE2' ' CE1' ' C' ' 47' ' ' TYR . 8.5 t80 -86.84 83.87 7.46 Favored 'General case' 0 C--N 1.332 -0.163 0 CA-C-O 120.927 0.394 . . . . 117.83 110.28 -178.345 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 45' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -95.14 -30.26 14.13 Favored 'General case' 0 C--N 1.329 -0.287 0 N-CA-C 114.077 1.139 . . . . 232.15 114.077 -169.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 46' ' ' ALA . . . . . . . . . . . . . . . -147.35 163.19 37.22 Favored 'General case' 0 CA--C 1.543 0.694 0 N-CA-C 120.472 3.508 . . . . 164.1 120.472 -154.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 47' ' ' TYR . . . . . 0.941 ' HB3' ' CB ' ' C' ' 48' ' ' LYS . 7.3 m-85 -146.92 -164.52 2.01 Favored 'General case' 0 C--N 1.328 -0.33 1 N-CA-C 99.783 -4.155 . . . . 244.8 99.783 170.138 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 48' ' ' LYS . . . . . 0.941 ' CB ' ' HB3' ' C' ' 47' ' ' TYR . . . -151.52 126.6 9.81 Favored 'General case' 0 C--O 1.269 2.093 1 C-N-CA 132.043 4.137 . . . . 189.54 111.16 -13.743 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 49' ' ' LYS . . . . . . . . . . . . . . . . . . . . 0 C--N 1.292 -1.903 0 CA-C-N 118.933 0.788 . . . . 267.65 111.162 -177.446 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' HOH . . . . . 0.64 ' O ' ' O ' ' A' ' 1' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' HOH . . . . . 0.462 ' O ' ' OG1' ' A' ' 62' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' HOH . . . . . 0.47 ' O ' ' NH2' ' A' ' 10' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' HOH . . . . . 1.148 ' O ' ' CB ' ' A' ' 18' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' HOH . . . . . 0.752 ' O ' ' HG3' ' A' ' 34' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 74' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 75' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 76' ' ' HOH . . . . . 0.734 ' O ' ' O ' ' C' ' 3' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 77' ' ' HOH . . . . . 0.417 ' O ' ' HG3' ' C' ' 25' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 78' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 79' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_