data_1sjv_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 1sjv _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 ' 8' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.444 0 CA-C-O 121.685 0.603 . . . . 18.27 112.148 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -166.57 166.96 39.28 Favored Glycine 0 N--CA 1.44 -1.083 0 CA-C-O 122.436 1.02 . . . . 15.54 113.234 -179.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -153.38 151.91 23.61 Favored Glycine 0 N--CA 1.44 -1.037 0 N-CA-C 109.613 -1.395 . . . . 18.4 109.613 177.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 9.0 tt -119.79 126.67 51.58 Favored 'General case' 0 N--CA 1.438 -1.049 0 N-CA-C 106.235 -1.765 . . . . 23.54 106.235 170.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 10.6 m -121.93 151.93 25.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.585 0.707 . . . . 20.87 109.32 175.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -65.05 140.72 58.87 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 114.984 -1.007 . . . . 24.55 108.575 171.682 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.39 133.86 45.48 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 110.014 -0.365 . . . . 18.55 110.014 174.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 103.59 -22.96 34.21 Favored Glycine 0 C--N 1.33 0.233 0 CA-C-N 116.106 -0.497 . . . . 18.79 113.09 -179.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -82.32 173.09 12.38 Favored 'General case' 0 C--O 1.246 0.904 0 CA-C-O 121.424 0.63 . . . . 24.26 111.498 179.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 68.3 m -110.24 157.41 19.48 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-N 114.493 -1.231 . . . . 22.41 111.52 -175.907 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.1 tp -148.12 135.71 20.72 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 106.76 -1.57 . . . . 26.49 106.76 175.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 11.7 ttpt -111.09 122.3 47.53 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.949 -0.76 . . . . 33.41 108.949 177.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 73.4 mt -101.52 150.6 22.9 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 108.013 -1.106 . . . . 21.37 108.013 176.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 85.2 p -140.69 156.63 46.17 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 121.277 0.561 . . . . 22.16 111.439 174.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . . . -142.81 123.33 14.01 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 108.073 -1.084 . . . . 25.79 108.073 177.533 nan nan nan nan nan nan nan nan 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -102.46 151.02 22.78 Favored 'General case' 0 N--CA 1.463 0.189 0 O-C-N 123.183 0.302 . . . . 30.46 110.419 176.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.405 0 C-N-CA 123.772 0.829 . . . . 32.16 112.557 179.748 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.2 p . . . . . 0 N--CA 1.495 1.812 0 N-CA-C 112.427 0.529 . . . . 38.55 112.427 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -92.31 110.16 3.86 Favored Glycine 0 CA--C 1.523 0.566 0 N-CA-C 117.453 1.741 . . . . 36.86 117.453 -167.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' GLY . . . . . 0.405 ' C ' ' O ' ' A' ' 169' ' ' HOH . . . -89.84 -124.86 2.72 Favored Glycine 0 CA--C 1.532 1.152 0 CA-C-O 121.517 0.509 . . . . 34.11 114.173 170.565 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -63.1 132.19 51.06 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 123.808 0.843 . . . . 32.72 109.363 -176.659 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.01 139.26 39.55 Favored 'General case' 0 CA--C 1.506 -0.715 0 N-CA-C 106.723 -1.584 . . . . 38.38 106.723 -179.755 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -163.71 171.82 39.45 Favored Glycine 0 N--CA 1.443 -0.841 0 C-N-CA 119.654 -1.26 . . . . 20.79 115.369 -179.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 89.9 m95 -116.65 133.58 55.85 Favored 'General case' 0 N--CA 1.431 -1.396 0 N-CA-C 106.347 -1.723 . . . . 19.67 106.347 175.719 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -117.44 162.83 17.33 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 114.917 -1.038 . . . . 30.43 108.216 171.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.0 ptt180 -138.47 155.58 48.32 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.187 0.518 . . . . 18.33 110.972 170.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -142.34 123.23 14.4 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.111 -0.949 . . . . 29.15 110.257 175.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -96.1 148.84 35.14 Favored Pre-proline 0 C--N 1.325 -0.476 0 N-CA-C 108.576 -0.898 . . . . 26.08 108.576 172.002 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -54.27 134.71 62.13 Favored 'Trans proline' 0 CA--C 1.528 0.223 0 C-N-CA 121.41 1.407 . . . . 29.46 112.462 -178.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.46 3.04 70.2 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 116.065 1.186 . . . . 30.33 116.065 179.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 53.3 mttt -120.11 161.88 20.25 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 117.837 0.819 . . . . 38.76 110.608 178.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -78.73 154.16 30.27 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 108.793 -0.818 . . . . 33.25 108.793 176.242 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 10.5 ptp180 -63.76 148.73 48.46 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.81 -0.632 . . . . 36.98 110.742 176.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -129.0 133.0 47.58 Favored 'General case' 0 CA--C 1.505 -0.764 0 N-CA-C 107.71 -1.218 . . . . 29.96 107.71 -178.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 30.0 tp -65.84 136.46 56.19 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.695 -0.854 . . . . 23.19 108.695 167.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 96.6 t -105.96 -51.28 8.01 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.52 0 C-N-CA 122.592 0.357 . . . . 18.32 110.411 179.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -155.64 143.41 19.71 Favored 'General case' 0 CA--C 1.512 -0.51 0 C-N-CA 122.968 0.507 . . . . 18.38 110.256 -173.088 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 81.0 p -131.69 155.21 48.03 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.546 0.689 . . . . 21.1 110.947 173.078 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 18.0 tt -140.73 140.72 33.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 114.975 -1.011 . . . . 18.14 108.519 168.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 47.4 p30 -105.62 -176.85 3.19 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 108.202 -1.036 . . . . 17.96 108.202 179.622 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 12.1 p -68.14 -24.59 65.02 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.972 -0.558 . . . . 15.96 112.387 -171.361 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 85.7 mtm180 -85.41 -1.09 56.64 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.342 -0.39 . . . . 25.58 111.988 179.187 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 88.64 6.49 73.12 Favored Glycine 0 CA--C 1.524 0.602 0 CA-C-O 119.906 -0.386 . . . . 14.25 113.648 179.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ILE . . . . . . . . . . . . . 3.1 mt -75.18 126.15 35.61 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.663 0 N-CA-C 108.746 -0.835 . . . . 20.05 108.746 -179.516 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 65.7 p -104.59 160.99 14.5 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.804 -1.089 . . . . 17.3 109.306 -174.04 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -150.55 150.36 31.13 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 107.404 -1.332 . . . . 30.41 107.404 170.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -135.36 146.41 48.35 Favored 'General case' 0 C--O 1.239 0.508 0 O-C-N 123.879 0.737 . . . . 17.07 109.518 -176.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -62.56 157.11 21.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.676 -0.693 . . . . 16.15 110.091 173.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -57.22 -32.04 66.11 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 113.291 0.849 . . . . 20.87 113.291 -179.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 15.9 p90 -74.56 -10.64 59.75 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 114.884 1.439 . . . . 19.31 114.884 -179.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 73.7 t -69.57 -44.52 79.62 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.631 0 C-N-CA 120.55 -0.46 . . . . 16.76 110.308 -177.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 6.2 mptt 53.56 39.71 30.43 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 113.492 0.923 . . . . 22.78 113.492 176.372 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 77.72 8.17 87.24 Favored Glycine 0 C--O 1.224 -0.481 0 N-CA-C 115.252 0.861 . . . . 18.96 115.252 174.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 62.9 mtm180 -88.51 -21.67 24.02 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 117.76 0.78 . . . . 17.45 112.193 -172.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 9.3 m-30 -115.66 151.31 35.27 Favored 'General case' 0 C--O 1.244 0.816 0 CA-C-O 121.126 0.488 . . . . 19.5 110.142 -173.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 59.9 m -132.98 123.48 25.96 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.621 -0.718 . . . . 22.66 109.228 177.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 20.3 tt -97.76 137.3 25.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 107.723 -1.214 . . . . 21.36 107.723 173.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 87.8 p -145.1 161.06 40.38 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.588 -0.523 . . . . 25.63 109.588 -179.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.02 133.61 54.09 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 106.778 -1.564 . . . . 42.44 106.778 178.984 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -101.62 100.22 10.6 Favored 'General case' 1 C--N 1.06 -12.014 2 O-C-N 111.949 -6.72 . . . . 48.28 107.195 144.702 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -62.34 -17.77 59.73 Favored 'General case' 1 C--N 1.564 9.914 2 O-C-N 108.331 -8.981 . . . . 20.0 114.662 -173.319 . . . . . . . . 3 2 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.82 -35.79 72.65 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-N 122.189 2.268 . . . . 51.93 109.795 178.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -100.41 -16.31 17.65 Favored 'General case' 0 C--O 1.251 1.135 0 N-CA-C 113.012 0.745 . . . . 20.0 113.012 -175.436 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 99.4 mttt 63.7 0.99 0.98 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 114.85 -2.5 . . . . 20.0 114.339 -168.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -74.09 139.58 44.72 Favored 'General case' 1 C--N 1.059 -12.055 2 C-N-CA 109.139 -5.024 . . . . 33.88 120.447 155.656 . . . . . . . . 4 3 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -103.14 150.5 6.68 Favored 'Isoleucine or valine' 0 C--O 1.252 1.196 2 O-C-N 134.696 7.497 . . . . 31.0 106.297 175.474 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -131.06 153.32 49.42 Favored 'General case' 1 C--N 1.048 -12.536 0 CA-C-N 111.257 -2.701 . . . . 36.35 110.594 174.436 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 45.0 tp -128.75 107.24 9.51 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 107.059 -1.46 . . . . 22.06 107.059 167.446 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.85 116.33 25.93 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 107.633 -1.247 . . . . 31.76 107.633 173.412 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 76.0 mtm -109.21 110.33 21.51 Favored 'General case' 0 C--O 1.215 -0.733 0 CA-C-N 116.399 -0.364 . . . . 26.19 110.407 179.828 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -100.52 161.64 13.46 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 122.526 0.33 . . . . 23.9 111.167 175.709 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 38.9 m 51.0 48.04 23.8 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 121.949 0.88 . . . . 23.2 111.786 172.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 33.4 mt -63.76 146.92 52.98 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.083 -0.962 . . . . 20.56 110.685 179.699 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -126.73 158.16 68.93 Favored Pre-proline 0 C--O 1.238 0.483 0 C-N-CA 123.859 0.863 . . . . 32.46 109.71 178.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -50.46 -35.71 46.29 Favored 'Trans proline' 0 N--CA 1.473 0.287 0 C-N-CA 121.41 1.407 . . . . 20.47 114.242 177.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -69.26 -13.83 62.62 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.648 0.981 . . . . 34.32 113.648 179.184 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -79.03 -2.51 40.67 Favored 'General case' 0 C--O 1.223 -0.315 0 N-CA-C 114.597 1.332 . . . . 20.15 114.597 172.257 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 22.9 m -62.11 122.38 15.41 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 123.433 0.693 . . . . 14.22 109.554 179.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -177.88 169.0 2.05 Favored 'General case' 0 C--O 1.237 0.422 0 O-C-N 123.809 0.693 . . . . 13.6 109.847 -175.28 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 59.5 t -88.5 124.95 41.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 107.948 -1.13 . . . . 15.45 107.948 166.191 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -103.86 138.38 40.53 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.832 -0.803 . . . . 14.69 108.832 -178.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 38.3 p90 -144.18 148.88 35.58 Favored 'General case' 0 N--CA 1.439 -0.976 0 C-N-CA 119.632 -0.827 . . . . 26.55 113.166 176.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . . . -85.41 149.05 25.69 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.729 -1.123 . . . . 16.52 108.656 177.853 nan nan nan nan nan nan nan nan 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -145.84 144.03 29.99 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.462 -0.94 . . . . 25.79 108.462 -175.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 13.8 t -143.88 154.87 43.8 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 108.978 -0.749 . . . . 18.43 108.978 169.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -136.21 162.61 32.48 Favored 'General case' 0 N--CA 1.44 -0.974 0 C-N-CA 118.777 -1.169 . . . . 28.83 112.973 170.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -131.93 135.07 46.33 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 112.81 -1.995 . . . . 31.7 107.771 -174.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -145.7 138.82 26.1 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.549 0.69 . . . . 30.59 109.741 173.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 14.2 ptp180 -154.57 162.81 40.96 Favored 'General case' 0 CA--C 1.504 -0.803 0 CA-C-N 115.527 -0.761 . . . . 17.14 109.698 166.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 81.0 p -138.11 153.87 49.25 Favored 'General case' 0 N--CA 1.436 -1.137 0 CA-C-N 115.216 -0.902 . . . . 21.3 109.228 174.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -131.48 148.2 52.62 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 107.774 -1.195 . . . . 23.24 107.774 179.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' TRP . . . . . . . . . . . . . 47.1 p90 -142.8 154.32 44.1 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.919 0.39 . . . . 20.75 110.489 171.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -83.18 174.79 52.63 Favored Glycine 0 CA--C 1.503 -0.662 0 N-CA-C 110.208 -1.157 . . . . 21.32 110.208 -176.012 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.16 143.18 55.49 Favored 'General case' 0 N--CA 1.444 -0.738 0 N-CA-C 102.932 -2.988 . . . . 38.11 102.932 169.313 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -74.35 163.86 54.55 Favored Glycine 0 C--N 1.317 -0.525 0 C-N-CA 118.671 -1.728 . . . . 23.65 110.178 -178.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' THR . . . . . 0.403 ' CG2' ' O ' ' A' ' 136' ' ' HOH . 0.6 OUTLIER -122.55 132.32 54.25 Favored 'General case' 0 CA--C 1.511 -0.526 0 C-N-CA 119.416 -0.914 . . . . 25.0 109.211 161.923 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -73.56 124.02 25.1 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 114.544 -1.207 . . . . 23.56 107.868 179.534 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 69.2 t -114.76 116.76 53.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 108.049 -1.093 . . . . 15.47 108.049 172.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 98.4 m -113.58 130.69 56.32 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 108.296 -1.001 . . . . 16.61 108.296 176.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 45.0 t -117.17 117.71 56.23 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.729 0 N-CA-C 107.079 -1.452 . . . . 18.42 107.079 -178.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' SER . . . . . 0.489 ' O ' ' CB ' ' A' ' 110' ' ' SER . 9.6 p -103.07 122.8 45.4 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.457 -0.792 . . . . 28.51 110.671 -176.329 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' SER . . . . . 0.489 ' CB ' ' O ' ' A' ' 109' ' ' SER . 41.0 m . . . . . 0 CA--C 1.514 -0.404 0 C-N-CA 124.078 0.951 . . . . 31.41 108.454 160.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' HOH . . . . . 0.403 ' O ' ' CG2' ' A' ' 104' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' HOH . . . . . 0.405 ' O ' ' C ' ' A' ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.444 0 CA-C-O 121.685 0.603 . . . . 18.27 112.148 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -166.57 166.96 39.28 Favored Glycine 0 N--CA 1.44 -1.083 0 CA-C-O 122.436 1.02 . . . . 15.54 113.234 -179.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -153.38 151.91 23.61 Favored Glycine 0 N--CA 1.44 -1.037 0 N-CA-C 109.613 -1.395 . . . . 18.4 109.613 177.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 9.0 tt -119.79 126.67 51.58 Favored 'General case' 0 N--CA 1.438 -1.049 0 N-CA-C 106.235 -1.765 . . . . 23.54 106.235 170.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 10.6 m -121.93 151.93 25.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.585 0.707 . . . . 20.87 109.32 175.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -65.05 140.72 58.87 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 114.984 -1.007 . . . . 24.55 108.575 171.682 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.39 133.86 45.48 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 110.014 -0.365 . . . . 18.55 110.014 174.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 103.59 -22.96 34.21 Favored Glycine 0 C--N 1.33 0.233 0 CA-C-N 116.106 -0.497 . . . . 18.79 113.09 -179.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -82.32 173.09 12.38 Favored 'General case' 0 C--O 1.246 0.904 0 CA-C-O 121.424 0.63 . . . . 24.26 111.498 179.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 68.3 m -110.24 157.41 19.48 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-N 114.493 -1.231 . . . . 22.41 111.52 -175.907 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.1 tp -148.12 135.71 20.72 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 106.76 -1.57 . . . . 26.49 106.76 175.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 11.7 ttpt -111.09 122.3 47.53 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.949 -0.76 . . . . 33.41 108.949 177.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 73.4 mt -101.52 150.6 22.9 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 108.013 -1.106 . . . . 21.37 108.013 176.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 85.2 p -140.69 156.63 46.17 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 121.277 0.561 . . . . 22.16 111.439 174.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . . . -142.81 123.33 14.01 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 108.073 -1.084 . . . . 25.79 108.073 177.533 nan nan nan nan nan nan nan nan 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -102.46 151.02 22.78 Favored 'General case' 0 N--CA 1.463 0.189 0 O-C-N 123.183 0.302 . . . . 30.46 110.419 176.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.405 0 C-N-CA 123.772 0.829 . . . . 32.16 112.557 179.748 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.2 p . . . . . 0 N--CA 1.495 1.812 0 N-CA-C 112.427 0.529 . . . . 38.55 112.427 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -92.31 110.16 3.86 Favored Glycine 0 CA--C 1.523 0.566 0 N-CA-C 117.453 1.741 . . . . 36.86 117.453 -167.243 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' GLY . . . . . 0.543 ' HA2' ' O ' ' A' ' 169' ' ' HOH . . . -89.84 -124.86 2.72 Favored Glycine 0 CA--C 1.532 1.152 0 CA-C-O 121.517 0.509 . . . . 34.11 114.173 170.565 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -63.1 132.19 51.06 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 123.808 0.843 . . . . 32.72 109.363 -176.659 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.01 139.26 39.55 Favored 'General case' 0 CA--C 1.506 -0.715 0 N-CA-C 106.723 -1.584 . . . . 38.38 106.723 -179.755 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -163.71 171.82 39.45 Favored Glycine 0 N--CA 1.443 -0.841 0 C-N-CA 119.654 -1.26 . . . . 20.79 115.369 -179.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 89.9 m95 -116.65 133.58 55.85 Favored 'General case' 0 N--CA 1.431 -1.396 0 N-CA-C 106.347 -1.723 . . . . 19.67 106.347 175.719 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -117.44 162.83 17.33 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 114.917 -1.038 . . . . 30.43 108.216 171.277 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.0 ptt180 -138.47 155.58 48.32 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.187 0.518 . . . . 18.33 110.972 170.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -142.34 123.23 14.4 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.111 -0.949 . . . . 29.15 110.257 175.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -96.1 148.84 35.14 Favored Pre-proline 0 C--N 1.325 -0.476 0 N-CA-C 108.576 -0.898 . . . . 26.08 108.576 172.002 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -54.27 134.71 62.13 Favored 'Trans proline' 0 CA--C 1.528 0.223 0 C-N-CA 121.41 1.407 . . . . 29.46 112.462 -178.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.46 3.04 70.2 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 116.065 1.186 . . . . 30.33 116.065 179.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 53.3 mttt -120.11 161.88 20.25 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 117.837 0.819 . . . . 38.76 110.608 178.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -78.73 154.16 30.27 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 108.793 -0.818 . . . . 33.25 108.793 176.242 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 10.5 ptp180 -63.76 148.73 48.46 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.81 -0.632 . . . . 36.98 110.742 176.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -129.0 133.0 47.58 Favored 'General case' 0 CA--C 1.505 -0.764 0 N-CA-C 107.71 -1.218 . . . . 29.96 107.71 -178.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 30.0 tp -65.84 136.46 56.19 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.695 -0.854 . . . . 23.19 108.695 167.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 96.6 t -105.96 -51.28 8.01 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.52 0 C-N-CA 122.592 0.357 . . . . 18.32 110.411 179.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -155.64 143.41 19.71 Favored 'General case' 0 CA--C 1.512 -0.51 0 C-N-CA 122.968 0.507 . . . . 18.38 110.256 -173.088 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 81.0 p -131.69 155.21 48.03 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.546 0.689 . . . . 21.1 110.947 173.078 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 18.0 tt -140.73 140.72 33.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 114.975 -1.011 . . . . 18.14 108.519 168.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 47.4 p30 -105.62 -176.85 3.19 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 108.202 -1.036 . . . . 17.96 108.202 179.622 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 12.1 p -68.14 -24.59 65.02 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.972 -0.558 . . . . 15.96 112.387 -171.361 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ARG . . . . . 0.514 ' HB2' HD12 ' A' ' 52' ' ' ILE . 85.7 mtm180 -85.41 -1.09 56.64 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.342 -0.39 . . . . 25.58 111.988 179.187 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 88.64 6.49 73.12 Favored Glycine 0 CA--C 1.524 0.602 0 CA-C-O 119.906 -0.386 . . . . 14.25 113.648 179.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ILE . . . . . 0.514 HD12 ' HB2' ' A' ' 50' ' ' ARG . 3.1 mt -75.18 126.15 35.61 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.663 0 N-CA-C 108.746 -0.835 . . . . 20.05 108.746 -179.516 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 65.7 p -104.59 160.99 14.5 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.804 -1.089 . . . . 17.3 109.306 -174.04 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 58.1 t30 -150.55 150.36 31.13 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 107.404 -1.332 . . . . 30.41 107.404 170.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -135.36 146.41 48.35 Favored 'General case' 0 C--O 1.239 0.508 0 O-C-N 123.879 0.737 . . . . 17.07 109.518 -176.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -62.56 157.11 21.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.676 -0.693 . . . . 16.15 110.091 173.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -57.22 -32.04 66.11 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 113.291 0.849 . . . . 20.87 113.291 -179.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 15.9 p90 -74.56 -10.64 59.75 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 114.884 1.439 . . . . 19.31 114.884 -179.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 73.7 t -69.57 -44.52 79.62 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.631 0 C-N-CA 120.55 -0.46 . . . . 16.76 110.308 -177.007 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 6.2 mptt 53.56 39.71 30.43 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 113.492 0.923 . . . . 22.78 113.492 176.372 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 77.72 8.17 87.24 Favored Glycine 0 C--O 1.224 -0.481 0 N-CA-C 115.252 0.861 . . . . 18.96 115.252 174.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 62.9 mtm180 -88.51 -21.67 24.02 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 117.76 0.78 . . . . 17.45 112.193 -172.656 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 9.3 m-30 -115.66 151.31 35.27 Favored 'General case' 0 C--O 1.244 0.816 0 CA-C-O 121.126 0.488 . . . . 19.5 110.142 -173.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 59.9 m -132.98 123.48 25.96 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.621 -0.718 . . . . 22.66 109.228 177.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 20.3 tt -97.76 137.3 25.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 107.723 -1.214 . . . . 21.36 107.723 173.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 87.8 p -145.1 161.06 40.38 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.588 -0.523 . . . . 25.63 109.588 -179.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.02 133.61 54.09 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 106.778 -1.564 . . . . 42.44 106.778 178.984 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -101.62 100.22 10.6 Favored 'General case' 1 C--N 1.06 -12.014 2 O-C-N 111.949 -6.72 . . . . 48.28 107.195 144.702 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -62.34 -17.77 59.73 Favored 'General case' 1 C--N 1.564 9.914 2 O-C-N 108.331 -8.981 . . . . 20.0 114.662 -173.319 . . . . . . . . 3 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.82 -35.79 72.65 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-N 122.189 2.268 . . . . 51.93 109.795 178.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' LYS . . . . . 0.493 ' CB ' HG23 ' A' ' 73' ' ' THR . 99.2 mttt -100.41 -16.31 17.65 Favored 'General case' 0 C--O 1.251 1.135 0 N-CA-C 113.012 0.745 . . . . 20.0 113.012 -175.436 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' LYS . . . . . 0.44 ' HB2' ' O ' ' A' ' 71' ' ' LYS . 99.4 mttt 63.7 0.99 0.98 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 114.85 -2.5 . . . . 20.0 114.339 -168.698 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 73' ' ' THR . . . . . 0.493 HG23 ' CB ' ' A' ' 71' ' ' LYS . 0.2 OUTLIER -74.09 139.58 44.72 Favored 'General case' 1 C--N 1.059 -12.055 2 C-N-CA 109.139 -5.024 . . . . 33.88 120.447 155.656 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -103.14 150.5 6.68 Favored 'Isoleucine or valine' 0 C--O 1.252 1.196 2 O-C-N 134.696 7.497 . . . . 31.0 106.297 175.474 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -131.06 153.32 49.42 Favored 'General case' 1 C--N 1.048 -12.536 0 CA-C-N 111.257 -2.701 . . . . 36.35 110.594 174.436 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 45.0 tp -128.75 107.24 9.51 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 107.059 -1.46 . . . . 22.06 107.059 167.446 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.85 116.33 25.93 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 107.633 -1.247 . . . . 31.76 107.633 173.412 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 76.0 mtm -109.21 110.33 21.51 Favored 'General case' 0 C--O 1.215 -0.733 0 CA-C-N 116.399 -0.364 . . . . 26.19 110.407 179.828 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -100.52 161.64 13.46 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 122.526 0.33 . . . . 23.9 111.167 175.709 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 38.9 m 51.0 48.04 23.8 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 121.949 0.88 . . . . 23.2 111.786 172.368 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 33.4 mt -63.76 146.92 52.98 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.083 -0.962 . . . . 20.56 110.685 179.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -126.73 158.16 68.93 Favored Pre-proline 0 C--O 1.238 0.483 0 C-N-CA 123.859 0.863 . . . . 32.46 109.71 178.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -50.46 -35.71 46.29 Favored 'Trans proline' 0 N--CA 1.473 0.287 0 C-N-CA 121.41 1.407 . . . . 20.47 114.242 177.894 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -69.26 -13.83 62.62 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.648 0.981 . . . . 34.32 113.648 179.184 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -79.03 -2.51 40.67 Favored 'General case' 0 C--O 1.223 -0.315 0 N-CA-C 114.597 1.332 . . . . 20.15 114.597 172.257 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 22.9 m -62.11 122.38 15.41 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 123.433 0.693 . . . . 14.22 109.554 179.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -177.88 169.0 2.05 Favored 'General case' 0 C--O 1.237 0.422 0 O-C-N 123.809 0.693 . . . . 13.6 109.847 -175.28 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 59.5 t -88.5 124.95 41.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 107.948 -1.13 . . . . 15.45 107.948 166.191 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -103.86 138.38 40.53 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.832 -0.803 . . . . 14.69 108.832 -178.365 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 38.3 p90 -144.18 148.88 35.58 Favored 'General case' 0 N--CA 1.439 -0.976 0 C-N-CA 119.632 -0.827 . . . . 26.55 113.166 176.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . . . -85.41 149.05 25.69 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.729 -1.123 . . . . 16.52 108.656 177.853 nan nan nan nan nan nan nan nan 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -145.84 144.03 29.99 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.462 -0.94 . . . . 25.79 108.462 -175.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 13.8 t -143.88 154.87 43.8 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 108.978 -0.749 . . . . 18.43 108.978 169.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -136.21 162.61 32.48 Favored 'General case' 0 N--CA 1.44 -0.974 0 C-N-CA 118.777 -1.169 . . . . 28.83 112.973 170.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -131.93 135.07 46.33 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 112.81 -1.995 . . . . 31.7 107.771 -174.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -145.7 138.82 26.1 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.549 0.69 . . . . 30.59 109.741 173.368 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 14.2 ptp180 -154.57 162.81 40.96 Favored 'General case' 0 CA--C 1.504 -0.803 0 CA-C-N 115.527 -0.761 . . . . 17.14 109.698 166.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 81.0 p -138.11 153.87 49.25 Favored 'General case' 0 N--CA 1.436 -1.137 0 CA-C-N 115.216 -0.902 . . . . 21.3 109.228 174.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -131.48 148.2 52.62 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 107.774 -1.195 . . . . 23.24 107.774 179.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' TRP . . . . . . . . . . . . . 47.1 p90 -142.8 154.32 44.1 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.919 0.39 . . . . 20.75 110.489 171.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -83.18 174.79 52.63 Favored Glycine 0 CA--C 1.503 -0.662 0 N-CA-C 110.208 -1.157 . . . . 21.32 110.208 -176.012 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 7.0 mp0 -68.16 143.18 55.49 Favored 'General case' 0 N--CA 1.444 -0.738 0 N-CA-C 102.932 -2.988 . . . . 38.11 102.932 169.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -74.35 163.86 54.55 Favored Glycine 0 C--N 1.317 -0.525 0 C-N-CA 118.671 -1.728 . . . . 23.65 110.178 -178.425 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' THR . . . . . 0.433 HG22 ' O ' ' A' ' 136' ' ' HOH . 0.6 OUTLIER -122.55 132.32 54.25 Favored 'General case' 0 CA--C 1.511 -0.526 0 C-N-CA 119.416 -0.914 . . . . 25.0 109.211 161.923 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -73.56 124.02 25.1 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 114.544 -1.207 . . . . 23.56 107.868 179.534 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 69.2 t -114.76 116.76 53.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 108.049 -1.093 . . . . 15.47 108.049 172.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 98.4 m -113.58 130.69 56.32 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 108.296 -1.001 . . . . 16.61 108.296 176.717 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 45.0 t -117.17 117.71 56.23 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.729 0 N-CA-C 107.079 -1.452 . . . . 18.42 107.079 -178.024 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' SER . . . . . 0.489 ' O ' ' CB ' ' A' ' 110' ' ' SER . 9.6 p -103.07 122.8 45.4 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.457 -0.792 . . . . 28.51 110.671 -176.329 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 110' ' ' SER . . . . . 0.489 ' CB ' ' O ' ' A' ' 109' ' ' SER . 41.0 m . . . . . 0 CA--C 1.514 -0.404 0 C-N-CA 124.078 0.951 . . . . 31.41 108.454 160.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 136' ' ' HOH . . . . . 0.433 ' O ' HG22 ' A' ' 104' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 169' ' ' HOH . . . . . 0.543 ' O ' ' HA2' ' A' ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.444 0 CA-C-O 121.685 0.603 . . . . 18.27 112.148 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . -166.57 166.96 39.28 Favored Glycine 0 N--CA 1.44 -1.083 0 CA-C-O 122.436 1.02 . . . . 15.539999999999999 113.234 -179.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . -153.38 151.91 23.61 Favored Glycine 0 N--CA 1.44 -1.037 0 N-CA-C 109.613 -1.395 . . . . 18.399999999999999 109.613 177.402 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 9.0 tt -119.79 126.67 51.58 Favored 'General case' 0 N--CA 1.438 -1.049 0 N-CA-C 106.235 -1.765 . . . . 23.539999999999999 106.235 170.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' VAL . . . . . . . . . . . . . 10.6 m -121.93 151.93 25.67 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.605 0 CA-C-O 121.585 0.707 . . . . 20.870000000000001 109.32 175.537 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -65.05 140.72 58.87 Favored 'General case' 0 N--CA 1.443 -0.821 0 CA-C-N 114.984 -1.007 . . . . 24.550000000000001 108.575 171.682 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -54.39 133.86 45.48 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 110.014 -0.365 . . . . 18.550000000000001 110.014 174.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 103.59 -22.96 34.21 Favored Glycine 0 C--N 1.33 0.233 0 CA-C-N 116.106 -0.497 . . . . 18.789999999999999 113.09 -179.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 36.7 mt-10 -82.32 173.09 12.38 Favored 'General case' 0 C--O 1.246 0.904 0 CA-C-O 121.424 0.63 . . . . 24.260000000000002 111.498 179.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' SER . . . . . . . . . . . . . 68.3 m -110.24 157.41 19.48 Favored 'General case' 0 CA--C 1.512 -0.518 0 CA-C-N 114.493 -1.231 . . . . 22.41 111.52 -175.907 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 36.1 tp -148.12 135.71 20.72 Favored 'General case' 0 C--N 1.324 -0.534 0 N-CA-C 106.76 -1.57 . . . . 26.489999999999998 106.76 175.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 11.7 ttpt -111.09 122.3 47.53 Favored 'General case' 0 C--N 1.322 -0.606 0 N-CA-C 108.949 -0.76 . . . . 33.409999999999997 108.949 177.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 73.4 mt -101.52 150.6 22.9 Favored 'General case' 0 N--CA 1.444 -0.753 0 N-CA-C 108.013 -1.106 . . . . 21.370000000000001 108.013 176.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 85.2 p -140.69 156.63 46.17 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 121.277 0.561 . . . . 22.16 111.439 174.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' CYS . . . . . . . . . . . . . . . -142.81 123.33 14.01 Favored 'General case' 0 CA--C 1.509 -0.627 0 N-CA-C 108.073 -1.084 . . . . 25.789999999999999 108.073 177.533 nan nan nan nan nan nan nan nan 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -102.46 151.02 22.78 Favored 'General case' 0 N--CA 1.463 0.189 0 O-C-N 123.183 0.302 . . . . 30.460000000000001 110.419 176.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.467 0.405 0 C-N-CA 123.772 0.829 . . . . 32.159999999999997 112.557 179.748 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 1.2 p . . . . . 0 N--CA 1.495 1.812 0 N-CA-C 112.427 0.529 . . . . 38.549999999999997 112.427 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -92.31 110.16 3.86 Favored Glycine 0 CA--C 1.523 0.566 0 N-CA-C 117.453 1.741 . . . . 36.859999999999999 117.453 -167.243 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' GLY . . . . . 0.543 ' HA2' ' O ' ' A' ' 169' ' ' HOH . . . -89.84 -124.86 2.72 Favored Glycine 0 CA--C 1.532 1.152 0 CA-C-O 121.517 0.509 . . . . 34.109999999999999 114.173 170.565 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' PHE . . . . . . . . . . . . . 37.0 t80 -63.1 132.19 51.06 Favored 'General case' 0 CA--C 1.517 -0.313 0 C-N-CA 123.808 0.843 . . . . 32.719999999999999 109.363 -176.659 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -138.01 139.26 39.55 Favored 'General case' 0 CA--C 1.506 -0.715 0 N-CA-C 106.723 -1.584 . . . . 38.380000000000003 106.723 -179.755 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLY . . . . . . . . . . . . . . . -163.71 171.82 39.45 Favored Glycine 0 N--CA 1.443 -0.841 0 C-N-CA 119.654 -1.26 . . . . 20.789999999999999 115.369 -179.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' TRP . . . . . . . . . . . . . 89.9 m95 -116.65 133.58 55.85 Favored 'General case' 0 N--CA 1.431 -1.396 0 N-CA-C 106.347 -1.723 . . . . 19.670000000000002 106.347 175.719 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 39.4 m-85 -117.44 162.83 17.33 Favored 'General case' 0 C--N 1.314 -0.974 0 CA-C-N 114.917 -1.038 . . . . 30.43 108.216 171.277 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ARG . . . . . . . . . . . . . 38.0 ptt180 -138.47 155.58 48.32 Favored 'General case' 0 C--N 1.319 -0.728 0 CA-C-O 121.187 0.518 . . . . 18.329999999999998 110.972 170.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 12.5 tt0 -142.34 123.23 14.4 Favored 'General case' 0 C--N 1.315 -0.932 0 CA-C-N 115.111 -0.949 . . . . 29.149999999999999 110.257 175.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -96.1 148.84 35.14 Favored Pre-proline 0 C--N 1.325 -0.476 0 N-CA-C 108.576 -0.898 . . . . 26.079999999999998 108.576 172.002 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_exo -54.27 134.71 62.13 Favored 'Trans proline' 0 CA--C 1.528 0.223 0 C-N-CA 121.41 1.407 . . . . 29.460000000000001 112.462 -178.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 75.46 3.04 70.2 Favored Glycine 0 CA--C 1.523 0.572 0 N-CA-C 116.065 1.186 . . . . 30.329999999999998 116.065 179.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 53.3 mttt -120.11 161.88 20.25 Favored 'General case' 0 C--O 1.235 0.296 0 CA-C-N 117.837 0.819 . . . . 38.759999999999998 110.608 178.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -78.73 154.16 30.27 Favored 'General case' 0 C--N 1.327 -0.392 0 N-CA-C 108.793 -0.818 . . . . 33.25 108.793 176.242 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' ARG . . . . . . . . . . . . . 10.5 ptp180 -63.76 148.73 48.46 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 115.81 -0.632 . . . . 36.979999999999997 110.742 176.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -129.0 133.0 47.58 Favored 'General case' 0 CA--C 1.505 -0.764 0 N-CA-C 107.71 -1.218 . . . . 29.960000000000001 107.71 -178.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 30.0 tp -65.84 136.46 56.19 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.695 -0.854 . . . . 23.190000000000001 108.695 167.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 96.6 t -105.96 -51.28 8.01 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.52 0 C-N-CA 122.592 0.357 . . . . 18.32 110.411 179.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ALA . . . . . . . . . . . . . . . -155.64 143.41 19.71 Favored 'General case' 0 CA--C 1.512 -0.51 0 C-N-CA 122.968 0.507 . . . . 18.379999999999999 110.256 -173.088 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' THR . . . . . . . . . . . . . 81.0 p -131.69 155.21 48.03 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.546 0.689 . . . . 21.100000000000001 110.947 173.078 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 18.0 tt -140.73 140.72 33.13 Favored 'Isoleucine or valine' 0 C--N 1.322 -0.596 0 CA-C-N 114.975 -1.011 . . . . 18.140000000000001 108.519 168.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 47.4 p30 -105.62 -176.85 3.19 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 108.202 -1.036 . . . . 17.960000000000001 108.202 179.622 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' SER . . . . . . . . . . . . . 12.1 p -68.14 -24.59 65.02 Favored 'General case' 0 C--N 1.319 -0.736 0 CA-C-N 115.972 -0.558 . . . . 15.960000000000001 112.387 -171.361 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.514 ' HB2' HD12 ' A' ' 52' ' ' ILE . 85.7 mtm180 -85.41 -1.09 56.64 Favored 'General case' 0 C--N 1.325 -0.485 0 CA-C-N 116.342 -0.39 . . . . 25.579999999999998 111.988 179.187 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 88.64 6.49 73.12 Favored Glycine 0 CA--C 1.524 0.602 0 CA-C-O 119.906 -0.386 . . . . 14.25 113.648 179.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.514 HD12 ' HB2' ' A' ' 50' ' ' ARG . 3.1 mt -75.18 126.15 35.61 Favored 'Isoleucine or valine' 0 CA--C 1.508 -0.663 0 N-CA-C 108.746 -0.835 . . . . 20.050000000000001 108.746 -179.516 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 65.7 p -104.59 160.99 14.5 Favored 'General case' 0 C--N 1.32 -0.71 0 CA-C-N 114.804 -1.089 . . . . 17.300000000000001 109.306 -174.04 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -150.55 150.36 31.13 Favored 'General case' 0 C--N 1.32 -0.687 0 N-CA-C 107.404 -1.332 . . . . 30.41 107.404 170.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 97.6 m-85 -135.36 146.41 48.35 Favored 'General case' 0 C--O 1.239 0.508 0 O-C-N 123.879 0.737 . . . . 17.07 109.518 -176.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -62.56 157.11 21.31 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 115.676 -0.693 . . . . 16.149999999999999 110.091 173.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 97.4 m-20 -57.22 -32.04 66.11 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 113.291 0.849 . . . . 20.870000000000001 113.291 -179.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . . 15.9 p90 -74.56 -10.64 59.75 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 114.884 1.439 . . . . 19.309999999999999 114.884 -179.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 73.7 t -69.57 -44.52 79.62 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.631 0 C-N-CA 120.55 -0.46 . . . . 16.760000000000002 110.308 -177.007 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 6.2 mptt 53.56 39.71 30.43 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 113.492 0.923 . . . . 22.780000000000001 113.492 176.372 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' GLY . . . . . . . . . . . . . . . 77.72 8.17 87.24 Favored Glycine 0 C--O 1.224 -0.481 0 N-CA-C 115.252 0.861 . . . . 18.960000000000001 115.252 174.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ARG . . . . . . . . . . . . . 62.9 mtm180 -88.51 -21.67 24.02 Favored 'General case' 0 C--N 1.323 -0.586 0 CA-C-N 117.76 0.78 . . . . 17.449999999999999 112.193 -172.656 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 9.3 m-30 -115.66 151.31 35.27 Favored 'General case' 0 C--O 1.244 0.816 0 CA-C-O 121.126 0.488 . . . . 19.5 110.142 -173.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' THR . . . . . . . . . . . . . 59.9 m -132.98 123.48 25.96 Favored 'General case' 0 N--CA 1.448 -0.574 0 CA-C-N 115.621 -0.718 . . . . 22.66 109.228 177.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ILE . . . . . . . . . . . . . 20.3 tt -97.76 137.3 25.76 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 N-CA-C 107.723 -1.214 . . . . 21.359999999999999 107.723 173.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' SER . . . . . . . . . . . . . 87.8 p -145.1 161.06 40.38 Favored 'General case' 0 C--N 1.322 -0.607 0 N-CA-C 109.588 -0.523 . . . . 25.629999999999999 109.588 -179.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -112.02 133.61 54.09 Favored 'General case' 0 CA--C 1.511 -0.52 0 N-CA-C 106.778 -1.564 . . . . 42.439999999999998 106.778 178.984 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 25.6 t70 -101.62 100.22 10.6 Favored 'General case' 1 C--N 1.06 -12.014 2 O-C-N 111.949 -6.72 . . . . 48.280000000000001 107.195 144.702 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ASN . . . . . . . . . . . . . 89.8 m-20 -62.34 -17.77 59.73 Favored 'General case' 1 C--N 1.564 9.914 2 O-C-N 108.331 -8.981 . . . . 20.0 114.662 -173.319 . . . . . . . . 3 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -70.82 -35.79 72.65 Favored 'General case' 0 N--CA 1.485 1.287 0 CA-C-N 122.189 2.268 . . . . 51.93 109.795 178.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' LYS . . . . . 0.493 ' CB ' HG23 ' A' ' 73' ' ' THR . 99.2 mttt -100.41 -16.31 17.65 Favored 'General case' 0 C--O 1.251 1.135 0 N-CA-C 113.012 0.745 . . . . 20.0 113.012 -175.436 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.44 ' HB2' ' O ' ' A' ' 71' ' ' LYS . 99.4 mttt 63.7 0.99 0.98 Allowed 'General case' 0 C--N 1.324 -0.539 0 CA-C-O 114.85 -2.5 . . . . 20.0 114.339 -168.698 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' THR . . . . . 0.493 HG23 ' CB ' ' A' ' 71' ' ' LYS . 0.2 OUTLIER -74.09 139.58 44.72 Favored 'General case' 1 C--N 1.059 -12.055 2 C-N-CA 109.139 -5.024 . . . . 33.880000000000003 120.447 155.656 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -103.14 150.5 6.68 Favored 'Isoleucine or valine' 0 C--O 1.252 1.196 2 O-C-N 134.696 7.497 . . . . 31.0 106.297 175.474 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -131.06 153.32 49.42 Favored 'General case' 1 C--N 1.048 -12.536 0 CA-C-N 111.257 -2.701 . . . . 36.350000000000001 110.594 174.436 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 45.0 tp -128.75 107.24 9.51 Favored 'General case' 0 C--N 1.321 -0.671 0 N-CA-C 107.059 -1.46 . . . . 22.059999999999999 107.059 167.446 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -87.85 116.33 25.93 Favored 'General case' 0 C--N 1.318 -0.787 0 N-CA-C 107.633 -1.247 . . . . 31.760000000000002 107.633 173.412 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 76.0 mtm -109.21 110.33 21.51 Favored 'General case' 0 C--O 1.215 -0.733 0 CA-C-N 116.399 -0.364 . . . . 26.190000000000001 110.407 179.828 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 70.7 m-80 -100.52 161.64 13.46 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 122.526 0.33 . . . . 23.899999999999999 111.167 175.709 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' SER . . . . . . . . . . . . . 38.9 m 51.0 48.04 23.8 Favored 'General case' 0 N--CA 1.471 0.59 0 CA-C-O 121.949 0.88 . . . . 23.199999999999999 111.786 172.368 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' LEU . . . . . . . . . . . . . 33.4 mt -63.76 146.92 52.98 Favored 'General case' 0 C--N 1.32 -0.701 0 CA-C-N 115.083 -0.962 . . . . 20.559999999999999 110.685 179.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 94.5 mt-10 -126.73 158.16 68.93 Favored Pre-proline 0 C--O 1.238 0.483 0 C-N-CA 123.859 0.863 . . . . 32.460000000000001 109.71 178.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo -50.46 -35.71 46.29 Favored 'Trans proline' 0 N--CA 1.473 0.287 0 C-N-CA 121.41 1.407 . . . . 20.469999999999999 114.242 177.894 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' GLU . . . . . . . . . . . . . 6.2 pt-20 -69.26 -13.83 62.62 Favored 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 113.648 0.981 . . . . 34.32 113.648 179.184 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -79.03 -2.51 40.67 Favored 'General case' 0 C--O 1.223 -0.315 0 N-CA-C 114.597 1.332 . . . . 20.149999999999999 114.597 172.257 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' THR . . . . . . . . . . . . . 22.9 m -62.11 122.38 15.41 Favored 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 123.433 0.693 . . . . 14.220000000000001 109.554 179.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ALA . . . . . . . . . . . . . . . -177.88 169.0 2.05 Favored 'General case' 0 C--O 1.237 0.422 0 O-C-N 123.809 0.693 . . . . 13.6 109.847 -175.28 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 59.5 t -88.5 124.95 41.74 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.542 0 N-CA-C 107.948 -1.13 . . . . 15.449999999999999 107.948 166.191 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 32.2 m-85 -103.86 138.38 40.53 Favored 'General case' 0 CA--C 1.512 -0.516 0 N-CA-C 108.832 -0.803 . . . . 14.69 108.832 -178.365 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' TYR . . . . . . . . . . . . . 38.3 p90 -144.18 148.88 35.58 Favored 'General case' 0 N--CA 1.439 -0.976 0 C-N-CA 119.632 -0.827 . . . . 26.550000000000001 113.166 176.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' CYS . . . . . . . . . . . . . . . -85.41 149.05 25.69 Favored 'General case' 0 C--N 1.325 -0.467 0 CA-C-N 114.729 -1.123 . . . . 16.52 108.656 177.853 nan nan nan nan nan nan nan nan 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' TYR . . . . . . . . . . . . . 27.2 t80 -145.84 144.03 29.99 Favored 'General case' 0 C--N 1.324 -0.522 0 N-CA-C 108.462 -0.94 . . . . 25.789999999999999 108.462 -175.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' THR . . . . . . . . . . . . . 13.8 t -143.88 154.87 43.8 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 108.978 -0.749 . . . . 18.43 108.978 169.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' HIS . . . . . . . . . . . . . 1.3 p-80 -136.21 162.61 32.48 Favored 'General case' 0 N--CA 1.44 -0.974 0 C-N-CA 118.777 -1.169 . . . . 28.829999999999998 112.973 170.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' TYR . . . . . . . . . . . . . 95.7 m-85 -131.93 135.07 46.33 Favored 'General case' 0 N--CA 1.441 -0.909 0 CA-C-N 112.81 -1.995 . . . . 31.699999999999999 107.771 -174.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' PHE . . . . . . . . . . . . . 55.3 t80 -145.7 138.82 26.1 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-O 121.549 0.69 . . . . 30.59 109.741 173.368 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 14.2 ptp180 -154.57 162.81 40.96 Favored 'General case' 0 CA--C 1.504 -0.803 0 CA-C-N 115.527 -0.761 . . . . 17.140000000000001 109.698 166.151 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 81.0 p -138.11 153.87 49.25 Favored 'General case' 0 N--CA 1.436 -1.137 0 CA-C-N 115.216 -0.902 . . . . 21.300000000000001 109.228 174.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 27.0 m-85 -131.48 148.2 52.62 Favored 'General case' 0 C--N 1.317 -0.829 0 N-CA-C 107.774 -1.195 . . . . 23.239999999999998 107.774 179.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' TRP . . . . . . . . . . . . . 47.1 p90 -142.8 154.32 44.1 Favored 'General case' 0 C--N 1.321 -0.641 0 CA-C-O 120.919 0.39 . . . . 20.75 110.489 171.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' GLY . . . . . . . . . . . . . . . -83.18 174.79 52.63 Favored Glycine 0 CA--C 1.503 -0.662 0 N-CA-C 110.208 -1.157 . . . . 21.32 110.208 -176.012 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.16 143.18 55.49 Favored 'General case' 0 N--CA 1.444 -0.738 0 N-CA-C 102.932 -2.988 . . . . 38.109999999999999 102.932 169.313 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' GLY . . . . . . . . . . . . . . . -74.35 163.86 54.55 Favored Glycine 0 C--N 1.317 -0.525 0 C-N-CA 118.671 -1.728 . . . . 23.649999999999999 110.178 -178.425 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' THR . . . . . 0.433 HG22 ' O ' ' A' ' 136' ' ' HOH . 0.6 OUTLIER -122.55 132.32 54.25 Favored 'General case' 0 CA--C 1.511 -0.526 0 C-N-CA 119.416 -0.914 . . . . 25.0 109.211 161.923 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 7.9 tp-100 -73.56 124.02 25.1 Favored 'General case' 0 N--CA 1.44 -0.938 0 CA-C-N 114.544 -1.207 . . . . 23.559999999999999 107.868 179.534 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' VAL . . . . . . . . . . . . . 69.2 t -114.76 116.76 53.56 Favored 'Isoleucine or valine' 0 C--N 1.321 -0.652 0 N-CA-C 108.049 -1.093 . . . . 15.470000000000001 108.049 172.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' THR . . . . . . . . . . . . . 98.4 m -113.58 130.69 56.32 Favored 'General case' 0 CA--C 1.509 -0.607 0 N-CA-C 108.296 -1.001 . . . . 16.609999999999999 108.296 176.717 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 45.0 t -117.17 117.71 56.23 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.729 0 N-CA-C 107.079 -1.452 . . . . 18.420000000000002 107.079 -178.024 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' SER . . . . . 0.489 ' O ' ' CB ' ' A' ' 110' ' ' SER . 9.6 p -103.07 122.8 45.4 Favored 'General case' 0 C--N 1.32 -0.687 0 CA-C-N 115.457 -0.792 . . . . 28.510000000000002 110.671 -176.329 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' SER . . . . . 0.489 ' CB ' ' O ' ' A' ' 109' ' ' SER . 41.0 m . . . . . 0 CA--C 1.514 -0.404 0 C-N-CA 124.078 0.951 . . . . 31.41 108.454 160.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' HOH . . . . . 0.433 ' O ' HG22 ' A' ' 104' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' HOH . . . . . 0.543 ' O ' ' HA2' ' A' ' 28' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_