data_6n02_residue ############################ # Computer software used # ############################ 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 6n02 _Structure_validation_residue.Date_analyzed 2019-03-22 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 ' 0' ' ' MET . . . . . 0.542 ' N ' ' O ' ' A' ' 303' ' ' HOH . 17.1 tpp . . . . . 0 CA--C 1.536 0.414 0 N-CA-C 111.273 0.101 . . . . 107.18 111.273 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 59.9 t -130.59 120.65 48.74 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 N-CA-C 107.853 -1.166 . . . . 68.0 107.853 161.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 9.5 mp -89.42 139.62 30.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.039 0.447 . . . . 40.15 110.141 174.739 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 60.6 p -65.61 161.93 19.38 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 119.42 -0.912 . . . . 47.02 109.661 168.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -58.19 -39.32 78.64 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.222 -0.899 . . . . 103.75 111.009 174.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -59.35 -43.18 97.54 Favored Glycine 0 C--N 1.334 0.472 0 C-N-CA 119.919 -1.134 . . . . 52.94 112.373 177.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -65.33 -41.35 94.05 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 119.723 -0.791 . . . . 46.46 110.319 -179.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' TRP . . . . . . . . . . . . . 24.4 m95 -61.37 -37.09 82.15 Favored 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 120.043 -0.663 . . . . 43.92 111.057 175.59 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 22.5 mm-40 -65.49 -42.48 92.12 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 119.509 -0.876 . . . . 97.48 110.234 176.773 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 14.4 mt -57.97 -46.16 85.57 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.768 -0.373 . . . . 52.9 110.991 174.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 37.1 t -60.64 -46.84 95.08 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 CA-C-O 121.011 0.434 . . . . 40.04 110.056 -179.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' LEU . . . . . . . . . . . . . 44.6 mt -71.43 -34.83 70.64 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 119.37 -0.932 . . . . 54.3 110.482 -176.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 18.3 t-80 -60.78 -46.19 91.45 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 120.885 0.374 . . . . 88.25 110.24 175.349 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 77.0 t -64.12 -43.93 97.53 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 C-N-CA 120.124 -0.631 . . . . 56.51 110.391 174.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 28.4 t-105 -61.22 -32.22 72.0 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 118.8 -1.16 . . . . 46.22 112.424 -176.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.85 -25.52 66.71 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 119.946 -0.701 . . . . 51.52 111.178 176.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 18.1 mttm -81.2 -25.29 36.85 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.384 -0.526 . . . . 93.69 111.87 175.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 47.3 t -66.95 -48.61 79.04 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 C-N-CA 120.031 -0.668 . . . . 48.96 110.117 168.822 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLU . . . . . 0.446 ' OE1' ' NZ ' ' A' ' 77' ' ' LYS . 51.2 mt-10 -62.9 -14.18 43.44 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 112.856 0.687 . . . . 68.36 112.856 -177.179 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.06 -20.76 60.91 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 112.507 0.558 . . . . 50.24 112.507 174.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 61.2 t0 -154.75 73.35 0.89 Allowed 'General case' 0 C--O 1.224 -0.267 0 N-CA-C 106.791 -1.559 . . . . 63.01 106.791 177.785 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 18.1 t -65.18 -43.05 95.56 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.407 0 C-N-CA 119.633 -0.827 . . . . 49.51 109.793 -174.316 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.45 -45.67 86.47 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 120.744 -0.382 . . . . 41.87 111.103 -177.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.06 -44.81 94.5 Favored Glycine 0 C--N 1.336 0.571 0 C-N-CA 119.619 -1.277 . . . . 40.57 112.325 177.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' HIS . . . . . 0.482 ' NE2' ' NE2' ' A' ' 119' ' ' HIS . 65.7 m80 -68.82 -45.98 69.79 Favored 'General case' 0 CA--C 1.521 -0.158 0 O-C-N 122.033 -0.686 . . . . 47.89 110.644 -178.56 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -62.89 -42.46 99.67 Favored Glycine 0 C--N 1.334 0.433 0 C-N-CA 120.267 -0.968 . . . . 40.39 111.976 -177.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 63.0 tt0 -58.71 -53.91 53.03 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 120.842 0.354 . . . . 66.11 110.823 175.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -57.78 -41.24 81.63 Favored 'General case' 0 C--O 1.24 0.581 0 C-N-CA 120.478 -0.489 . . . . 48.91 110.747 -179.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 45.9 mt -64.62 -47.62 88.21 Favored 'Isoleucine or valine' 0 C--O 1.239 0.527 0 C-N-CA 119.726 -0.79 . . . . 40.46 109.907 -175.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 55.9 mt -62.41 -39.52 93.54 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 119.243 -0.983 . . . . 45.33 110.393 179.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 69.7 mt -63.02 -45.92 97.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 CA-C-N 116.659 -0.246 . . . . 44.84 110.589 -179.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 22.5 tpp180 -63.48 -46.05 87.93 Favored 'General case' 0 C--O 1.239 0.506 0 C-N-CA 119.912 -0.715 . . . . 57.2 110.914 179.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 50.0 tp -51.37 -49.6 61.18 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 120.998 0.428 . . . . 38.45 111.152 173.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 21.9 m-30 -68.87 -31.94 71.25 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-N 116.299 -0.41 . . . . 48.05 111.658 -176.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.9 mtmt -79.71 -39.44 31.16 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 118.804 -1.158 . . . . 94.15 111.345 -179.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 6.2 p -80.68 -24.45 38.89 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 119.656 -0.818 . . . . 60.08 112.415 -179.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 65.0 m80 -138.56 81.22 24.54 Favored Pre-proline 0 C--O 1.239 0.514 0 N-CA-C 108.47 -0.937 . . . . 42.25 108.47 177.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_exo -57.83 -32.08 94.04 Favored 'Trans proline' 0 C--O 1.24 0.576 0 CA-C-O 118.922 -0.533 . . . . 62.6 113.336 -179.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLU . . . . . 0.667 ' OE2' ' O ' ' A' ' 301' ' ' HOH . 18.4 pm0 -50.35 -31.36 14.39 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 118.305 0.502 . . . . 68.64 112.27 177.408 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 29.8 p -72.38 -21.42 61.29 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 120.168 -0.613 . . . . 49.56 112.126 179.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 19.3 tp -65.47 -41.07 93.77 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 119.834 -0.746 . . . . 56.34 110.975 178.75 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -67.12 -14.84 63.29 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 118.23 -1.388 . . . . 115.89 112.21 -176.193 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 20.0 mmtt -62.32 -14.46 39.64 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 113.079 0.77 . . . . 72.27 113.079 169.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -113.36 98.01 6.83 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 123.206 0.602 . . . . 58.21 109.627 -172.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -62.63 -26.19 68.5 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 119.585 -0.846 . . . . 101.23 111.224 176.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ARG . . . . . 0.527 ' O ' ' NE2' ' A' ' 48' ' ' HIS . 12.6 mtm180 -67.15 -31.67 72.26 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 112.683 0.624 . . . . 82.83 112.683 176.621 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -120.45 -12.99 8.88 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 115.08 1.511 . . . . 61.11 115.08 -169.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -53.15 -23.38 8.14 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 118.888 0.767 . . . . 100.2 112.319 -173.056 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' HIS . . . . . 0.527 ' NE2' ' O ' ' A' ' 45' ' ' ARG . 3.6 p80 -78.32 -1.01 31.12 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 125.243 1.417 . . . . 97.16 113.339 178.03 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 22.0 mt -97.88 124.95 42.53 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 119.033 0.833 . . . . 84.0 109.041 -179.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -115.18 -62.88 1.54 Allowed 'General case' 0 C--O 1.235 0.333 0 N-CA-C 112.971 0.73 . . . . 98.26 112.971 -171.732 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' THR . . . . . . . . . . . . . 1.8 t -69.73 153.81 42.85 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 119.054 0.843 . . . . 96.66 110.711 178.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -61.9 -37.21 83.76 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.545 -0.752 . . . . 87.57 110.814 175.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.6 -34.77 74.7 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 111.573 0.212 . . . . 75.76 111.573 177.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -67.14 -48.38 68.23 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 120.841 0.353 . . . . 94.96 110.944 177.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 59.4 mtt -60.47 -39.49 87.81 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 120.594 -0.442 . . . . 63.67 111.69 179.794 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 4.0 ttpt -68.35 -24.69 64.83 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 119.535 -0.866 . . . . 102.46 111.391 179.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.29 -6.24 59.0 Favored 'General case' 0 C--O 1.238 0.452 0 N-CA-C 112.357 0.503 . . . . 61.24 112.357 178.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.3 t -80.52 107.82 13.64 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.643 -0.873 . . . . 55.68 108.643 -179.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -64.0 -36.23 83.3 Favored 'General case' 0 C--O 1.239 0.543 0 C-N-CA 119.923 -0.711 . . . . 110.1 111.257 174.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.89 -32.21 72.54 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 119.174 -1.01 . . . . 93.12 111.792 -179.871 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 9.5 tt -64.41 -44.44 91.25 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 119.474 -0.89 . . . . 54.38 110.37 172.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 27.1 ttpp -58.61 -48.73 80.01 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.226 -0.589 . . . . 79.23 110.662 175.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.4 mtmt -53.5 -42.27 67.14 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 120.395 -0.522 . . . . 95.68 111.084 177.202 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 3.2 t60 -72.4 -35.18 68.33 Favored 'General case' 0 CA--C 1.515 -0.374 0 C-N-CA 117.563 -1.655 . . . . 68.38 111.68 -176.76 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -50.8 -45.92 48.83 Favored Glycine 0 C--N 1.338 0.64 0 C-N-CA 120.471 -0.871 . . . . 44.29 112.205 169.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 76.9 t -57.96 -48.53 83.86 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 O-C-N 122.209 -0.583 . . . . 47.5 109.868 178.08 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 87.9 m -53.38 -49.22 67.67 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 116.41 -0.359 . . . . 47.04 111.841 178.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 4.6 t -48.66 -66.04 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.508 -0.646 0 C-N-CA 123.877 0.871 . . . . 57.88 110.063 175.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LEU . . . . . 0.424 ' O ' ' N ' ' A' ' 73' ' ' GLY . 17.5 mt -65.57 -39.8 92.07 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 113.665 -1.607 . . . . 45.99 111.465 -167.887 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 51.6 p -61.37 -42.38 98.62 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 118.69 -1.204 . . . . 59.99 110.188 176.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.06 -46.25 85.18 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 119.498 -0.881 . . . . 41.42 110.722 175.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 20.1 tp -61.26 -44.35 97.39 Favored 'General case' 0 C--O 1.238 0.453 0 O-C-N 122.059 -0.4 . . . . 43.86 111.593 177.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' GLY . . . . . 0.424 ' N ' ' O ' ' A' ' 69' ' ' LEU . . . -64.72 -40.04 97.13 Favored Glycine 0 C--N 1.333 0.385 0 C-N-CA 120.281 -0.961 . . . . 42.11 112.499 -177.872 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.11 -40.7 74.12 Favored 'General case' 0 C--O 1.236 0.354 0 O-C-N 122.378 -0.484 . . . . 49.32 110.954 172.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 20.8 mt -69.26 -47.96 70.85 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 C-N-CA 119.687 -0.805 . . . . 48.14 110.133 179.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 54.8 mt -59.62 -39.31 83.85 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 120.572 -0.451 . . . . 49.9 111.026 -176.477 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' LYS . . . . . 0.446 ' NZ ' ' OE1' ' A' ' 18' ' ' GLU . 9.4 mttt -63.04 -19.32 64.27 Favored 'General case' 0 CA--C 1.52 -0.174 0 N-CA-C 112.33 0.493 . . . . 59.15 112.33 179.768 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -75.13 -7.24 53.23 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 119.81 -0.756 . . . . 75.06 112.721 176.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 32.7 mtpt 48.06 55.33 8.84 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 122.004 0.907 . . . . 66.75 111.53 179.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 87.15 -23.33 11.54 Favored Glycine 0 N--CA 1.439 -1.101 0 CA-C-N 114.902 -1.045 . . . . 59.52 115.28 176.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -84.33 59.96 5.7 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 123.07 1.414 . . . . 77.82 110.074 177.278 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' HIS . . . . . 0.671 ' NE2' ' OD2' ' A' ' 141' ' ' ASP . 1.1 p-80 -116.06 14.8 16.1 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-N 114.156 -1.384 . . . . 54.91 111.763 -168.818 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -45.84 -55.3 6.82 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-O 121.076 0.465 . . . . 94.67 111.192 178.389 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -69.93 -30.43 67.83 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 112.066 0.395 . . . . 57.86 112.066 -174.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 45.5 mp0 -77.06 -25.65 52.64 Favored 'General case' 0 CA--C 1.517 -0.297 0 C-N-CA 120.066 -0.654 . . . . 74.68 112.154 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 12.4 mt -78.8 -40.69 32.33 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 112.367 0.506 . . . . 59.81 112.367 -175.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 11.7 mtmm -51.29 -50.54 75.37 Favored Pre-proline 0 C--O 1.241 0.615 0 N-CA-C 113.653 0.982 . . . . 90.41 113.653 -174.458 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -61.12 -37.24 76.65 Favored 'Trans proline' 0 CA--C 1.511 -0.627 0 CA-C-N 121.455 1.555 . . . . 49.24 112.688 178.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 6.8 tp -67.54 -50.28 59.34 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-O 120.986 0.422 . . . . 55.74 110.558 178.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -55.19 -48.04 74.38 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-N 115.994 -0.548 . . . . 39.43 110.827 173.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -56.0 -52.14 65.25 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.085 -0.646 . . . . 68.32 111.069 -179.52 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' SER . . . . . 0.437 ' OG ' ' O2A' ' A' ' 201' ' ' HEM . 47.3 p -72.55 -31.88 65.62 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 118.78 -1.168 . . . . 47.03 111.388 -174.891 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 42.0 m80 -82.89 -30.4 28.54 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 117.933 -1.507 . . . . 38.54 111.171 -176.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -72.31 -51.66 19.73 Favored 'General case' 0 CA--C 1.528 0.118 0 C-N-CA 119.442 -0.903 . . . . 42.04 111.305 172.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' THR . . . . . . . . . . . . . 19.7 p -95.9 -35.84 11.31 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 113.756 1.021 . . . . 62.69 113.756 -162.947 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 9.3 mmtm -98.27 -48.46 5.06 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 118.76 0.709 . . . . 101.74 112.364 -179.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' HIS . . . . . 0.457 ' NE2' ' O1A' ' A' ' 201' ' ' HEM . 11.7 m-70 -80.89 -26.26 36.97 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 120.4 -0.52 . . . . 52.47 111.806 179.336 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 25.8 mmtm 57.58 52.8 7.94 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 121.729 0.775 . . . . 76.47 110.481 -178.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 33.3 mm -92.68 118.23 67.89 Favored Pre-proline 0 C--O 1.239 0.509 0 N-CA-C 107.867 -1.16 . . . . 46.9 107.867 -179.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -67.37 150.48 80.98 Favored 'Trans proline' 0 C--N 1.33 -0.397 0 CA-C-N 119.498 0.856 . . . . 43.92 110.778 172.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 48.1 mm -55.04 -34.63 32.32 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 CA-C-N 114.964 -1.016 . . . . 43.64 110.863 176.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -55.27 -36.3 65.97 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 119.823 -0.751 . . . . 79.36 111.055 178.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 8.5 m-30 -64.99 -29.78 70.72 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.319 -0.552 . . . . 48.86 111.715 176.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 2.9 mp -67.66 -31.21 71.04 Favored 'General case' 0 CA--C 1.518 -0.282 0 C-N-CA 120.18 -0.608 . . . . 45.07 111.527 173.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 62.9 mt-10 -66.26 -44.63 83.09 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 119.799 -0.76 . . . . 83.05 110.662 174.478 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 22.7 m-30 -57.27 -47.04 82.46 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 120.601 -0.439 . . . . 37.72 110.989 178.057 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 14.8 tt -68.5 -28.0 38.64 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 C-N-CA 117.499 -1.681 . . . . 44.21 110.67 -178.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 45.1 m -63.8 -47.71 79.79 Favored 'General case' 0 CA--C 1.514 -0.43 0 C-N-CA 119.514 -0.874 . . . . 36.25 110.243 176.36 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -55.56 -44.51 76.88 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 120.875 -0.33 . . . . 82.53 111.373 173.129 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.72 -32.56 74.09 Favored 'General case' 0 C--O 1.241 0.633 0 C-N-CA 120.318 -0.553 . . . . 39.15 110.951 -179.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' ILE . . . . . . . . . . . . . 43.4 mt -66.23 -51.44 59.03 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 C-N-CA 120.154 -0.618 . . . . 36.21 110.274 175.323 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 25.8 mm -57.27 -48.2 82.85 Favored 'Isoleucine or valine' 0 C--O 1.242 0.661 0 CA-C-O 121.682 0.753 . . . . 43.97 110.151 -179.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' HIS . . . . . . . . . . . . . 38.6 t-80 -56.37 -48.85 76.0 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 116.107 -0.497 . . . . 57.19 111.05 179.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.8 t -66.86 -38.21 80.98 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.355 0 C-N-CA 120.177 -0.609 . . . . 45.81 110.027 -174.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 56.2 mt -61.31 -35.55 77.69 Favored 'General case' 0 CA--C 1.518 -0.25 0 C-N-CA 120.439 -0.505 . . . . 39.64 111.063 177.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' HIS . . . . . 0.432 ' NE2' ' OE1' ' A' ' 128' ' ' GLN . 31.5 m-70 -66.83 -45.6 77.75 Favored 'General case' 0 C--N 1.333 -0.139 0 C-N-CA 119.355 -0.938 . . . . 52.22 111.218 175.912 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 88.9 p -75.58 -19.08 59.51 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 118.994 -1.082 . . . . 61.68 112.572 -174.9 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 13.4 mtt-85 -97.69 -16.15 20.07 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 113.2 0.815 . . . . 82.42 113.2 177.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' HIS . . . . . 0.482 ' NE2' ' NE2' ' A' ' 24' ' ' HIS . 62.4 m-70 -138.13 63.52 36.98 Favored Pre-proline 0 C--O 1.233 0.229 0 CA-C-N 118.227 0.467 . . . . 66.53 109.88 -178.616 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -60.86 -28.19 86.0 Favored 'Trans proline' 0 C--O 1.238 0.491 0 N-CA-C 114.101 0.77 . . . . 83.28 114.101 -173.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -99.92 -12.62 39.54 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.415 -0.898 . . . . 88.03 113.779 178.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ASP . . . . . . . . . . . . . 24.6 m-20 -98.26 -20.6 17.14 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 113.414 0.894 . . . . 84.39 113.414 -175.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -109.47 77.58 1.07 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.583 0.706 . . . . 58.19 109.33 -172.069 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -80.1 -172.03 43.76 Favored Glycine 0 CA--C 1.523 0.566 0 CA-C-O 122.651 1.139 . . . . 55.83 113.31 179.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -63.37 -44.26 95.28 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 114.537 -0.831 . . . . 62.33 111.62 -176.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -58.19 -56.05 27.09 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.114 0.483 . . . . 84.68 111.458 177.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -53.56 -40.71 65.8 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.397 -0.521 . . . . 55.31 110.965 178.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' GLN . . . . . 0.432 ' OE1' ' NE2' ' A' ' 116' ' ' HIS . 45.6 tt0 -64.17 -47.76 78.58 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 119.433 -0.907 . . . . 72.98 111.287 178.602 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . -56.03 -46.5 84.52 Favored Glycine 0 C--N 1.336 0.57 0 C-N-CA 119.528 -1.32 . . . . 39.72 111.525 176.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.88 -46.81 89.13 Favored 'General case' 0 C--O 1.238 0.481 0 O-C-N 122.355 -0.497 . . . . 45.56 110.818 179.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 63.0 tpp -64.96 -39.65 93.81 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 120.019 -0.672 . . . . 54.62 111.446 -179.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 7.9 m-20 -60.7 -44.25 96.79 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.638 -0.425 . . . . 69.84 111.245 177.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 7.5 mtpt -63.51 -39.03 93.36 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 120.59 -0.444 . . . . 66.29 110.674 178.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -66.22 -44.09 84.81 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 118.844 -1.142 . . . . 41.76 110.719 178.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 74.7 mt -68.04 -35.84 78.91 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 119.528 -0.869 . . . . 46.02 110.407 -179.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -61.29 -51.61 68.15 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 120.537 -0.465 . . . . 73.03 111.214 175.842 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 12.9 tp -53.24 -46.89 69.33 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.003 0.43 . . . . 46.11 110.442 176.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -52.11 -53.71 39.26 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.316 -0.402 . . . . 42.93 111.039 172.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 82.2 mtm-85 -62.73 -42.14 99.52 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.226 -0.589 . . . . 49.99 111.945 -178.6 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 15.2 mttp -63.05 -41.5 99.49 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 122.121 -0.362 . . . . 77.99 111.406 177.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' ASP . . . . . 0.671 ' OD2' ' NE2' ' A' ' 82' ' ' HIS . 66.1 m-20 -69.97 -36.25 75.07 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 119.602 -0.839 . . . . 50.49 111.106 179.117 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' ILE . . . . . . . . . . . . . 1.9 mm -64.09 -41.91 93.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 C-N-CA 119.787 -0.765 . . . . 61.49 109.67 175.047 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -55.56 -47.47 76.34 Favored 'General case' 0 CA--C 1.518 -0.257 0 C-N-CA 120.745 -0.382 . . . . 39.94 110.272 176.338 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -63.3 -33.51 75.68 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 119.17 -1.012 . . . . 47.92 111.121 -179.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 39.1 mmtm -74.84 -30.55 61.4 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 118.678 -1.209 . . . . 78.97 111.528 179.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -57.08 -52.07 66.75 Favored 'General case' 0 CA--C 1.513 -0.46 0 C-N-CA 120.105 -0.638 . . . . 42.08 110.708 168.574 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' LYS . . . . . 0.408 ' NZ ' ' O ' ' A' ' 153' ' ' GLY . 5.4 mttp -55.09 -39.02 68.84 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.664 -0.244 . . . . 99.82 111.157 179.758 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -67.2 -38.65 85.7 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 111.456 0.169 . . . . 101.02 111.456 -179.36 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 17.2 mt -73.87 1.36 10.83 Favored 'General case' 0 C--O 1.24 0.586 0 N-CA-C 112.964 0.727 . . . . 50.81 112.964 171.91 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . 85.42 28.3 30.52 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-O 119.556 -0.58 . . . . 52.8 113.938 177.933 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' TYR . . . . . . . . . . . . . 30.3 m-85 -125.45 143.53 50.95 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 118.279 1.039 . . . . 68.86 112.396 -170.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' GLN . . . . . . . . . . . . . 2.8 tt0 68.01 168.07 0.26 Allowed 'General case' 0 C--O 1.234 0.261 0 C-N-CA 127.069 2.148 . . . . 103.5 112.903 161.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' GLY . . . . . 0.408 ' O ' ' NZ ' ' A' ' 147' ' ' LYS . . . . . . . . 0 C--N 1.335 0.499 0 N-CA-C 117.34 1.696 . . . . 124.23 117.34 163.371 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' HEM . . . . . 0.457 ' O1A' ' NE2' ' A' ' 97' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' CMO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . 0.667 ' O ' ' OE2' ' A' ' 38' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . 0.542 ' O ' ' N ' ' A' ' 0' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 0' ' ' MET . . . . . 0.542 ' N ' ' O ' ' A' ' 303' ' ' HOH . 17.1 tpp . . . . . 0 CA--C 1.536 0.414 0 N-CA-C 111.273 0.101 . . . . 107.18 111.273 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 59.9 t -130.59 120.65 48.74 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 N-CA-C 107.853 -1.166 . . . . 68.0 107.853 161.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 9.5 mp -89.42 139.62 30.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.039 0.447 . . . . 40.15 110.141 174.739 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 60.6 p -65.61 161.93 19.38 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 119.42 -0.912 . . . . 47.02 109.661 168.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -58.19 -39.32 78.64 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.222 -0.899 . . . . 103.75 111.009 174.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -59.35 -43.18 97.54 Favored Glycine 0 C--N 1.334 0.472 0 C-N-CA 119.919 -1.134 . . . . 52.94 112.373 177.999 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -65.33 -41.35 94.05 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 119.723 -0.791 . . . . 46.46 110.319 -179.228 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' TRP . . . . . 0.585 ' O ' ' HG ' ' A' ' 11' ' ' LEU . 24.4 m95 -61.37 -37.09 82.15 Favored 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 120.043 -0.663 . . . . 43.92 111.057 175.59 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 22.5 mm-40 -65.49 -42.48 92.12 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 119.509 -0.876 . . . . 97.48 110.234 176.773 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 14.4 mt -57.97 -46.16 85.57 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.768 -0.373 . . . . 52.9 110.991 174.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 37.1 t -60.64 -46.84 95.08 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 CA-C-O 121.011 0.434 . . . . 40.04 110.056 -179.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' LEU . . . . . 0.585 ' HG ' ' O ' ' A' ' 7' ' ' TRP . 44.6 mt -71.43 -34.83 70.64 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 119.37 -0.932 . . . . 54.3 110.482 -176.346 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 18.3 t-80 -60.78 -46.19 91.45 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 120.885 0.374 . . . . 88.25 110.24 175.349 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 77.0 t -64.12 -43.93 97.53 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 C-N-CA 120.124 -0.631 . . . . 56.51 110.391 174.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 28.4 t-105 -61.22 -32.22 72.0 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 118.8 -1.16 . . . . 46.22 112.424 -176.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.85 -25.52 66.71 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 119.946 -0.701 . . . . 51.52 111.178 176.564 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 18.1 mttm -81.2 -25.29 36.85 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.384 -0.526 . . . . 93.69 111.87 175.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 47.3 t -66.95 -48.61 79.04 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 C-N-CA 120.031 -0.668 . . . . 48.96 110.117 168.822 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLU . . . . . 0.502 ' HA ' HG22 ' A' ' 21' ' ' VAL . 51.2 mt-10 -62.9 -14.18 43.44 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 112.856 0.687 . . . . 68.36 112.856 -177.179 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.06 -20.76 60.91 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 112.507 0.558 . . . . 50.24 112.507 174.669 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 61.2 t0 -154.75 73.35 0.89 Allowed 'General case' 0 C--O 1.224 -0.267 0 N-CA-C 106.791 -1.559 . . . . 63.01 106.791 177.785 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' VAL . . . . . 0.502 HG22 ' HA ' ' A' ' 18' ' ' GLU . 18.1 t -65.18 -43.05 95.56 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.407 0 C-N-CA 119.633 -0.827 . . . . 49.51 109.793 -174.316 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.45 -45.67 86.47 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 120.744 -0.382 . . . . 41.87 111.103 -177.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.06 -44.81 94.5 Favored Glycine 0 C--N 1.336 0.571 0 C-N-CA 119.619 -1.277 . . . . 40.57 112.325 177.056 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' HIS . . . . . . . . . . . . . 65.7 m80 -68.82 -45.98 69.79 Favored 'General case' 0 CA--C 1.521 -0.158 0 O-C-N 122.033 -0.686 . . . . 47.89 110.644 -178.56 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -62.89 -42.46 99.67 Favored Glycine 0 C--N 1.334 0.433 0 C-N-CA 120.267 -0.968 . . . . 40.39 111.976 -177.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 63.0 tt0 -58.71 -53.91 53.03 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 120.842 0.354 . . . . 66.11 110.823 175.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -57.78 -41.24 81.63 Favored 'General case' 0 C--O 1.24 0.581 0 C-N-CA 120.478 -0.489 . . . . 48.91 110.747 -179.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ILE . . . . . 0.443 HD13 HG12 ' A' ' 111' ' ' ILE . 45.9 mt -64.62 -47.62 88.21 Favored 'Isoleucine or valine' 0 C--O 1.239 0.527 0 C-N-CA 119.726 -0.79 . . . . 40.46 109.907 -175.245 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 55.9 mt -62.41 -39.52 93.54 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 119.243 -0.983 . . . . 45.33 110.393 179.908 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 69.7 mt -63.02 -45.92 97.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 CA-C-N 116.659 -0.246 . . . . 44.84 110.589 -179.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ARG . . . . . 0.502 ' HD3' ' ND1' ' A' ' 113' ' ' HIS . 22.5 tpp180 -63.48 -46.05 87.93 Favored 'General case' 0 C--O 1.239 0.506 0 C-N-CA 119.912 -0.715 . . . . 57.66 110.914 179.178 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 50.0 tp -51.37 -49.6 61.18 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 120.998 0.428 . . . . 38.45 111.152 173.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 21.9 m-30 -68.87 -31.94 71.25 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-N 116.299 -0.41 . . . . 48.05 111.658 -176.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.9 mtmt -79.71 -39.44 31.16 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 118.804 -1.158 . . . . 94.15 111.345 -179.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 6.2 p -80.68 -24.45 38.89 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 119.656 -0.818 . . . . 60.08 112.415 -179.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' HIS . . . . . 0.431 ' HD2' ' O ' ' A' ' 301' ' ' HOH . 65.0 m80 -138.56 81.22 24.54 Favored Pre-proline 0 C--O 1.239 0.514 0 N-CA-C 108.47 -0.937 . . . . 42.25 108.47 177.875 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_exo -57.83 -32.08 94.04 Favored 'Trans proline' 0 C--O 1.24 0.576 0 CA-C-O 118.922 -0.533 . . . . 62.6 113.336 -179.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLU . . . . . 0.667 ' OE2' ' O ' ' A' ' 301' ' ' HOH . 18.4 pm0 -50.35 -31.36 14.39 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 118.305 0.502 . . . . 68.64 112.27 177.408 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' THR . . . . . 0.516 ' HB ' ' CBC' ' A' ' 201' ' ' HEM . 29.8 p -72.38 -21.42 61.29 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 120.168 -0.613 . . . . 49.56 112.126 179.104 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' LEU . . . . . 0.418 ' HG ' ' HA ' ' A' ' 47' ' ' LYS . 19.3 tp -65.47 -41.07 93.77 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 119.834 -0.746 . . . . 56.34 110.975 178.75 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -67.12 -14.84 63.29 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 118.23 -1.388 . . . . 115.89 112.21 -176.193 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' LYS . . . . . 0.426 ' HD3' ' HA ' ' A' ' 42' ' ' LYS . 20.0 mmtt -62.32 -14.46 39.64 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 113.079 0.77 . . . . 72.27 113.079 169.587 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -113.36 98.01 6.83 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 123.206 0.602 . . . . 58.21 109.627 -172.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -62.63 -26.19 68.5 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 119.585 -0.846 . . . . 101.23 111.224 176.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ARG . . . . . 0.48 ' O ' ' NE2' ' A' ' 48' ' ' HIS . 12.6 mtm180 -67.15 -31.67 72.26 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 112.683 0.624 . . . . 82.83 112.683 176.621 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -120.45 -12.99 8.88 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 115.08 1.511 . . . . 61.11 115.08 -169.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' LYS . . . . . 0.418 ' HA ' ' HG ' ' A' ' 40' ' ' LEU . 0.4 OUTLIER -53.15 -23.38 8.14 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 118.888 0.767 . . . . 100.2 112.319 -173.056 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 48' ' ' HIS . . . . . 0.551 ' H ' ' CD2' ' A' ' 48' ' ' HIS . 3.6 p80 -78.32 -1.01 31.12 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 125.243 1.417 . . . . 97.16 113.339 178.03 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 22.0 mt -97.88 124.95 42.53 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 119.033 0.833 . . . . 84.0 109.041 -179.703 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LYS . . . . . 0.436 ' HE2' ' HB2' ' A' ' 50' ' ' LYS . 0.7 OUTLIER -115.18 -62.88 1.54 Allowed 'General case' 0 C--O 1.235 0.333 0 N-CA-C 112.971 0.73 . . . . 98.26 112.971 -171.732 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 51' ' ' THR . . . . . 0.652 HG23 ' HB2' ' A' ' 54' ' ' GLU . 1.8 t -69.73 153.81 42.85 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 119.054 0.843 . . . . 96.66 110.711 178.063 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -61.9 -37.21 83.76 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.545 -0.752 . . . . 87.57 110.814 175.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.6 -34.77 74.7 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 111.573 0.212 . . . . 75.76 111.573 177.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLU . . . . . 0.652 ' HB2' HG23 ' A' ' 51' ' ' THR . 1.3 tt0 -67.14 -48.38 68.23 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 120.841 0.353 . . . . 94.96 110.944 177.009 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 59.4 mtt -60.47 -39.49 87.81 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 120.594 -0.442 . . . . 63.67 111.69 179.794 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 4.0 ttpt -68.35 -24.69 64.83 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 119.535 -0.866 . . . . 102.46 111.391 179.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.29 -6.24 59.0 Favored 'General case' 0 C--O 1.238 0.452 0 N-CA-C 112.357 0.503 . . . . 61.24 112.357 178.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.3 t -80.52 107.82 13.64 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.643 -0.873 . . . . 55.68 108.643 -179.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -64.0 -36.23 83.3 Favored 'General case' 0 C--O 1.239 0.543 0 C-N-CA 119.923 -0.711 . . . . 110.1 111.257 174.312 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.89 -32.21 72.54 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 119.174 -1.01 . . . . 93.12 111.792 -179.871 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 9.5 tt -64.41 -44.44 91.25 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 119.474 -0.89 . . . . 54.38 110.37 172.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 27.1 ttpp -58.61 -48.73 80.01 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.226 -0.589 . . . . 79.23 110.662 175.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.4 mtmt -53.5 -42.27 67.14 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 120.395 -0.522 . . . . 95.68 111.084 177.202 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' HIS . . . . . 0.589 ' O ' HG23 ' A' ' 68' ' ' VAL . 3.2 t60 -72.4 -35.18 68.33 Favored 'General case' 0 CA--C 1.515 -0.374 0 C-N-CA 117.563 -1.655 . . . . 68.38 111.68 -176.76 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -50.8 -45.92 48.83 Favored Glycine 0 C--N 1.338 0.64 0 C-N-CA 120.471 -0.871 . . . . 44.29 112.205 169.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 76.9 t -57.96 -48.53 83.86 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 O-C-N 122.209 -0.583 . . . . 47.5 109.868 178.08 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 87.9 m -53.38 -49.22 67.67 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 116.41 -0.359 . . . . 47.04 111.841 178.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' VAL . . . . . 0.589 HG23 ' O ' ' A' ' 64' ' ' HIS . 4.6 t -48.66 -66.04 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.508 -0.646 0 C-N-CA 123.877 0.871 . . . . 57.88 110.063 175.144 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 17.5 mt -65.57 -39.8 92.07 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 113.665 -1.607 . . . . 45.99 111.465 -167.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 51.6 p -61.37 -42.38 98.62 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 118.69 -1.204 . . . . 59.99 110.188 176.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.06 -46.25 85.18 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 119.498 -0.881 . . . . 41.42 110.722 175.289 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 20.1 tp -61.26 -44.35 97.39 Favored 'General case' 0 C--O 1.238 0.453 0 O-C-N 122.059 -0.4 . . . . 43.86 111.593 177.976 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.72 -40.04 97.13 Favored Glycine 0 C--N 1.333 0.385 0 C-N-CA 120.281 -0.961 . . . . 42.11 112.499 -177.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.11 -40.7 74.12 Favored 'General case' 0 C--O 1.236 0.354 0 O-C-N 122.378 -0.484 . . . . 49.32 110.954 172.461 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 20.8 mt -69.26 -47.96 70.85 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 C-N-CA 119.687 -0.805 . . . . 48.14 110.133 179.564 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 54.8 mt -59.62 -39.31 83.85 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 120.572 -0.451 . . . . 49.9 111.026 -176.477 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 9.4 mttt -63.04 -19.32 64.27 Favored 'General case' 0 CA--C 1.52 -0.174 0 N-CA-C 112.33 0.493 . . . . 59.15 112.33 179.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -75.13 -7.24 53.23 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 119.81 -0.756 . . . . 75.06 112.721 176.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 32.7 mtpt 48.06 55.33 8.84 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 122.004 0.907 . . . . 66.75 111.53 179.402 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 87.15 -23.33 11.54 Favored Glycine 0 N--CA 1.439 -1.101 0 CA-C-N 114.902 -1.045 . . . . 59.52 115.28 176.378 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -84.33 59.96 5.7 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 123.07 1.414 . . . . 77.82 110.074 177.278 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 1.1 p-80 -116.06 14.8 16.1 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-N 114.156 -1.384 . . . . 54.91 111.763 -168.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -45.84 -55.3 6.82 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-O 121.076 0.465 . . . . 94.67 111.192 178.389 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -69.93 -30.43 67.83 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 112.066 0.395 . . . . 57.86 112.066 -174.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 45.5 mp0 -77.06 -25.65 52.64 Favored 'General case' 0 CA--C 1.517 -0.297 0 C-N-CA 120.066 -0.654 . . . . 74.68 112.154 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 12.4 mt -78.8 -40.69 32.33 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 112.367 0.506 . . . . 59.81 112.367 -175.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 11.7 mtmm -51.29 -50.54 75.37 Favored Pre-proline 0 C--O 1.241 0.615 0 N-CA-C 113.653 0.982 . . . . 90.41 113.653 -174.458 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -61.12 -37.24 76.65 Favored 'Trans proline' 0 CA--C 1.511 -0.627 0 CA-C-N 121.455 1.555 . . . . 49.24 112.688 178.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LEU . . . . . 0.494 HD11 ' CHB' ' A' ' 201' ' ' HEM . 6.8 tp -67.54 -50.28 59.34 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-O 120.986 0.422 . . . . 55.74 110.558 178.545 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -55.19 -48.04 74.38 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-N 115.994 -0.548 . . . . 39.43 110.827 173.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -56.0 -52.14 65.25 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.085 -0.646 . . . . 68.32 111.069 -179.52 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 47.3 p -72.55 -31.88 65.62 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 118.78 -1.168 . . . . 47.03 111.388 -174.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 42.0 m80 -82.89 -30.4 28.54 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 117.933 -1.507 . . . . 38.54 111.171 -176.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -72.31 -51.66 19.73 Favored 'General case' 0 CA--C 1.528 0.118 0 C-N-CA 119.442 -0.903 . . . . 42.04 111.305 172.821 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' THR . . . . . 0.494 HG22 ' CE2' ' A' ' 151' ' ' TYR . 19.7 p -95.9 -35.84 11.31 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 113.756 1.021 . . . . 62.69 113.756 -162.947 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 9.3 mmtm -98.27 -48.46 5.06 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 118.76 0.709 . . . . 101.74 112.364 -179.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 11.7 m-70 -80.89 -26.26 36.97 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 120.4 -0.52 . . . . 52.47 111.806 179.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 25.8 mmtm 57.58 52.8 7.94 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 121.729 0.775 . . . . 76.47 110.481 -178.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 33.3 mm -92.68 118.23 67.89 Favored Pre-proline 0 C--O 1.239 0.509 0 N-CA-C 107.867 -1.16 . . . . 46.9 107.867 -179.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -67.37 150.48 80.98 Favored 'Trans proline' 0 C--N 1.33 -0.397 0 CA-C-N 119.498 0.856 . . . . 43.92 110.778 172.578 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ILE . . . . . 0.403 HG12 ' OE1' ' A' ' 152' ' ' GLN . 48.1 mm -55.04 -34.63 32.32 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 CA-C-N 114.964 -1.016 . . . . 43.64 110.863 176.383 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -55.27 -36.3 65.97 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 119.823 -0.751 . . . . 79.36 111.055 178.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 8.5 m-30 -64.99 -29.78 70.72 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.319 -0.552 . . . . 48.86 111.715 176.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' LEU . . . . . 0.496 HD21 HG21 ' A' ' 142' ' ' ILE . 2.9 mp -67.66 -31.21 71.04 Favored 'General case' 0 CA--C 1.518 -0.282 0 C-N-CA 120.18 -0.608 . . . . 45.07 111.527 173.422 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 62.9 mt-10 -66.26 -44.63 83.09 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 119.799 -0.76 . . . . 83.05 110.662 174.478 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 22.7 m-30 -57.27 -47.04 82.46 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 120.601 -0.439 . . . . 37.72 110.989 178.057 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 14.8 tt -68.5 -28.0 38.64 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 C-N-CA 117.499 -1.681 . . . . 44.21 110.67 -178.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 45.1 m -63.8 -47.71 79.79 Favored 'General case' 0 CA--C 1.514 -0.43 0 C-N-CA 119.514 -0.874 . . . . 36.25 110.243 176.36 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -55.56 -44.51 76.88 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 120.875 -0.33 . . . . 82.53 111.373 173.129 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.72 -32.56 74.09 Favored 'General case' 0 C--O 1.241 0.633 0 C-N-CA 120.318 -0.553 . . . . 39.15 110.951 -179.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' ILE . . . . . 0.443 HG12 HD13 ' A' ' 28' ' ' ILE . 43.4 mt -66.23 -51.44 59.03 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 C-N-CA 120.154 -0.618 . . . . 36.21 110.274 175.323 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 25.8 mm -57.27 -48.2 82.85 Favored 'Isoleucine or valine' 0 C--O 1.242 0.661 0 CA-C-O 121.682 0.753 . . . . 43.97 110.151 -179.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' HIS . . . . . 0.502 ' ND1' ' HD3' ' A' ' 31' ' ' ARG . 38.6 t-80 -56.37 -48.85 76.0 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 116.107 -0.497 . . . . 57.19 111.05 179.504 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.8 t -66.86 -38.21 80.98 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.355 0 C-N-CA 120.177 -0.609 . . . . 45.81 110.027 -174.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 56.2 mt -61.31 -35.55 77.69 Favored 'General case' 0 CA--C 1.518 -0.25 0 C-N-CA 120.439 -0.505 . . . . 39.64 111.063 177.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 31.5 m-70 -66.83 -45.6 77.75 Favored 'General case' 0 C--N 1.333 -0.139 0 C-N-CA 119.355 -0.938 . . . . 52.22 111.218 175.912 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 88.9 p -75.58 -19.08 59.51 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 118.994 -1.082 . . . . 61.68 112.572 -174.9 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 13.4 mtt-85 -97.69 -16.15 20.07 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 113.2 0.815 . . . . 82.42 113.2 177.309 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' HIS . . . . . 0.499 ' HB3' ' HB2' ' A' ' 122' ' ' ASP . 62.4 m-70 -138.13 63.52 36.98 Favored Pre-proline 0 C--O 1.233 0.229 0 CA-C-N 118.227 0.467 . . . . 66.53 109.88 -178.616 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -60.86 -28.19 86.0 Favored 'Trans proline' 0 C--O 1.238 0.491 0 N-CA-C 114.101 0.77 . . . . 83.28 114.101 -173.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -99.92 -12.62 39.54 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.415 -0.898 . . . . 88.03 113.779 178.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ASP . . . . . 0.499 ' HB2' ' HB3' ' A' ' 119' ' ' HIS . 24.6 m-20 -98.26 -20.6 17.14 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 113.414 0.894 . . . . 84.39 113.414 -175.545 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -109.47 77.58 1.07 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.583 0.706 . . . . 58.19 109.33 -172.069 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -80.1 -172.03 43.76 Favored Glycine 0 CA--C 1.523 0.566 0 CA-C-O 122.651 1.139 . . . . 55.83 113.31 179.067 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -63.37 -44.26 95.28 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 114.537 -0.831 . . . . 62.33 111.62 -176.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -58.19 -56.05 27.09 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.114 0.483 . . . . 84.68 111.458 177.367 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -53.56 -40.71 65.8 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.397 -0.521 . . . . 55.31 110.965 178.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 45.6 tt0 -64.17 -47.76 78.58 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 119.433 -0.907 . . . . 72.98 111.287 178.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . -56.03 -46.5 84.52 Favored Glycine 0 C--N 1.336 0.57 0 C-N-CA 119.528 -1.32 . . . . 39.72 111.525 176.717 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.88 -46.81 89.13 Favored 'General case' 0 C--O 1.238 0.481 0 O-C-N 122.355 -0.497 . . . . 45.56 110.818 179.411 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 63.0 tpp -64.96 -39.65 93.81 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 120.019 -0.672 . . . . 54.62 111.446 -179.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 7.9 m-20 -60.7 -44.25 96.79 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.638 -0.425 . . . . 69.84 111.245 177.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 7.5 mtpt -63.51 -39.03 93.36 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 120.59 -0.444 . . . . 66.29 110.674 178.429 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -66.22 -44.09 84.81 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 118.844 -1.142 . . . . 41.76 110.719 178.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 74.7 mt -68.04 -35.84 78.91 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 119.528 -0.869 . . . . 46.02 110.407 -179.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -61.29 -51.61 68.15 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 120.537 -0.465 . . . . 73.03 111.214 175.842 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 12.9 tp -53.24 -46.89 69.33 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.003 0.43 . . . . 46.11 110.442 176.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -52.11 -53.71 39.26 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.316 -0.402 . . . . 42.93 111.039 172.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 82.2 mtm-85 -62.73 -42.14 99.52 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.226 -0.589 . . . . 49.99 111.945 -178.6 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 15.2 mttp -63.05 -41.5 99.49 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 122.121 -0.362 . . . . 77.99 111.406 177.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 -69.97 -36.25 75.07 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 119.602 -0.839 . . . . 50.49 111.106 179.117 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' ILE . . . . . 0.496 HG21 HD21 ' A' ' 104' ' ' LEU . 1.9 mm -64.09 -41.91 93.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 C-N-CA 119.787 -0.765 . . . . 61.49 109.67 175.047 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -55.56 -47.47 76.34 Favored 'General case' 0 CA--C 1.518 -0.257 0 C-N-CA 120.745 -0.382 . . . . 39.94 110.272 176.338 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -63.3 -33.51 75.68 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 119.17 -1.012 . . . . 47.92 111.121 -179.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 39.1 mmtm -74.84 -30.55 61.4 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 118.678 -1.209 . . . . 78.97 111.528 179.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -57.08 -52.07 66.75 Favored 'General case' 0 CA--C 1.513 -0.46 0 C-N-CA 120.105 -0.638 . . . . 42.08 110.708 168.574 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 5.4 mttp -55.09 -39.02 68.84 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.664 -0.244 . . . . 99.82 111.157 179.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -67.2 -38.65 85.7 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 111.456 0.169 . . . . 101.02 111.456 -179.36 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 17.2 mt -73.87 1.36 10.83 Favored 'General case' 0 C--O 1.24 0.586 0 N-CA-C 112.964 0.727 . . . . 50.81 112.964 171.91 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . 85.42 28.3 30.52 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-O 119.556 -0.58 . . . . 52.8 113.938 177.933 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' TYR . . . . . 0.494 ' CE2' HG22 ' A' ' 95' ' ' THR . 30.3 m-85 -125.45 143.53 50.95 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 118.279 1.039 . . . . 68.86 112.396 -170.082 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 152' ' ' GLN . . . . . 0.403 ' OE1' HG12 ' A' ' 101' ' ' ILE . 2.8 tt0 68.01 168.07 0.26 Allowed 'General case' 0 C--O 1.234 0.261 0 C-N-CA 127.069 2.148 . . . . 103.5 112.903 161.703 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 0.499 0 N-CA-C 117.34 1.696 . . . . 124.23 117.34 163.371 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' HEM . . . . . 0.516 ' CBC' ' HB ' ' A' ' 39' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 202' ' ' CMO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . 0.667 ' O ' ' OE2' ' A' ' 38' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . 0.542 ' O ' ' N ' ' A' ' 0' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 0' ' ' MET . . . . . 0.542 ' N ' ' O ' ' A' ' 303' ' ' HOH . 17.1 tpp . . . . . 0 CA--C 1.536 0.414 0 N-CA-C 111.273 0.101 . . . . 107.18 111.273 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 59.9 t -130.59 120.65 48.74 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 N-CA-C 107.853 -1.166 . . . . 68.0 107.853 161.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 9.5 mp -89.42 139.62 30.33 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-O 121.039 0.447 . . . . 40.15 110.141 174.739 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' SER . . . . . . . . . . . . . 60.6 p -65.61 161.93 19.38 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 119.42 -0.912 . . . . 47.02 109.661 168.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -58.19 -39.32 78.64 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 115.222 -0.899 . . . . 103.75 111.009 174.202 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' GLY . . . . . . . . . . . . . . . -59.35 -43.18 97.54 Favored Glycine 0 C--N 1.334 0.472 0 C-N-CA 119.919 -1.134 . . . . 52.94 112.373 177.999 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 55.6 mt-10 -65.33 -41.35 94.05 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 119.723 -0.791 . . . . 46.46 110.319 -179.228 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.585 ' O ' ' HG ' ' A' ' 11' ' ' LEU . 24.4 m95 -61.37 -37.09 82.15 Favored 'General case' 0 CA--C 1.517 -0.309 0 C-N-CA 120.043 -0.663 . . . . 43.92 111.057 175.59 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 22.5 mm-40 -65.49 -42.48 92.12 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 119.509 -0.876 . . . . 97.48 110.234 176.773 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 14.4 mt -57.97 -46.16 85.57 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.768 -0.373 . . . . 52.9 110.991 174.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 37.1 t -60.64 -46.84 95.08 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 CA-C-O 121.011 0.434 . . . . 40.04 110.056 -179.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.585 ' HG ' ' O ' ' A' ' 7' ' ' TRP . 44.6 mt -71.43 -34.83 70.64 Favored 'General case' 0 C--O 1.234 0.243 0 C-N-CA 119.37 -0.932 . . . . 54.3 110.482 -176.346 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' HIS . . . . . . . . . . . . . 18.3 t-80 -60.78 -46.19 91.45 Favored 'General case' 0 C--O 1.237 0.412 0 CA-C-O 120.885 0.374 . . . . 88.25 110.24 175.349 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 77.0 t -64.12 -43.93 97.53 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 C-N-CA 120.124 -0.631 . . . . 56.51 110.391 174.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' TRP . . . . . . . . . . . . . 28.4 t-105 -61.22 -32.22 72.0 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 118.8 -1.16 . . . . 46.22 112.424 -176.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ALA . . . . . . . . . . . . . . . -60.85 -25.52 66.71 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 119.946 -0.701 . . . . 51.52 111.178 176.564 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' LYS . . . . . . . . . . . . . 18.1 mttm -81.2 -25.29 36.85 Favored 'General case' 0 C--O 1.236 0.368 0 C-N-CA 120.384 -0.526 . . . . 93.69 111.87 175.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 47.3 t -66.95 -48.61 79.04 Favored 'Isoleucine or valine' 0 C--O 1.233 0.216 0 C-N-CA 120.031 -0.668 . . . . 48.96 110.117 168.822 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLU . . . . . 0.502 ' HA ' HG22 ' A' ' 21' ' ' VAL . 51.2 mt-10 -62.9 -14.18 43.44 Favored 'General case' 0 CA--C 1.514 -0.417 0 N-CA-C 112.856 0.687 . . . . 68.36 112.856 -177.179 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ALA . . . . . . . . . . . . . . . -73.06 -20.76 60.91 Favored 'General case' 0 C--O 1.233 0.21 0 N-CA-C 112.507 0.558 . . . . 50.24 112.507 174.669 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 61.2 t0 -154.75 73.35 0.89 Allowed 'General case' 0 C--O 1.224 -0.267 0 N-CA-C 106.791 -1.559 . . . . 63.01 106.791 177.785 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' VAL . . . . . 0.502 HG22 ' HA ' ' A' ' 18' ' ' GLU . 18.1 t -65.18 -43.05 95.56 Favored 'Isoleucine or valine' 0 CA--C 1.514 -0.407 0 C-N-CA 119.633 -0.827 . . . . 49.51 109.793 -174.316 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.45 -45.67 86.47 Favored 'General case' 0 C--O 1.235 0.307 0 C-N-CA 120.744 -0.382 . . . . 41.87 111.103 -177.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -58.06 -44.81 94.5 Favored Glycine 0 C--N 1.336 0.571 0 C-N-CA 119.619 -1.277 . . . . 40.57 112.325 177.056 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' HIS . . . . . 0.417 ' NE2' ' NE2' ' A' ' 119' ' ' HIS . 65.7 m80 -68.82 -45.98 69.79 Favored 'General case' 0 CA--C 1.521 -0.158 0 O-C-N 122.033 -0.686 . . . . 47.89 110.644 -178.56 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' GLY . . . . . . . . . . . . . . . -62.89 -42.46 99.67 Favored Glycine 0 C--N 1.334 0.433 0 C-N-CA 120.267 -0.968 . . . . 40.39 111.976 -177.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 63.0 tt0 -58.71 -53.91 53.03 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-O 120.842 0.354 . . . . 66.11 110.823 175.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ASP . . . . . . . . . . . . . 80.6 m-20 -57.78 -41.24 81.63 Favored 'General case' 0 C--O 1.24 0.581 0 C-N-CA 120.478 -0.489 . . . . 48.91 110.747 -179.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.443 HD13 HG12 ' A' ' 111' ' ' ILE . 45.9 mt -64.62 -47.62 88.21 Favored 'Isoleucine or valine' 0 C--O 1.239 0.527 0 C-N-CA 119.726 -0.79 . . . . 40.46 109.907 -175.245 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 55.9 mt -62.41 -39.52 93.54 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 119.243 -0.983 . . . . 45.33 110.393 179.908 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 69.7 mt -63.02 -45.92 97.6 Favored 'Isoleucine or valine' 0 C--O 1.236 0.362 0 CA-C-N 116.659 -0.246 . . . . 44.84 110.589 -179.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ARG . . . . . 0.502 ' HD3' ' ND1' ' A' ' 113' ' ' HIS . 22.5 tpp180 -63.48 -46.05 87.93 Favored 'General case' 0 C--O 1.239 0.506 0 C-N-CA 119.912 -0.715 . . . . 57.66 110.914 179.178 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 50.0 tp -51.37 -49.6 61.18 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 120.998 0.428 . . . . 38.45 111.152 173.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 21.9 m-30 -68.87 -31.94 71.25 Favored 'General case' 0 CA--C 1.513 -0.472 0 CA-C-N 116.299 -0.41 . . . . 48.05 111.658 -176.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.9 mtmt -79.71 -39.44 31.16 Favored 'General case' 0 CA--C 1.518 -0.254 0 C-N-CA 118.804 -1.158 . . . . 94.15 111.345 -179.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 6.2 p -80.68 -24.45 38.89 Favored 'General case' 0 C--N 1.324 -0.516 0 C-N-CA 119.656 -0.818 . . . . 60.08 112.415 -179.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.431 ' HD2' ' O ' ' A' ' 301' ' ' HOH . 65.0 m80 -138.56 81.22 24.54 Favored Pre-proline 0 C--O 1.239 0.514 0 N-CA-C 108.47 -0.937 . . . . 42.25 108.47 177.875 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_exo -57.83 -32.08 94.04 Favored 'Trans proline' 0 C--O 1.24 0.576 0 CA-C-O 118.922 -0.533 . . . . 62.6 113.336 -179.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.667 ' OE2' ' O ' ' A' ' 301' ' ' HOH . 18.4 pm0 -50.35 -31.36 14.39 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 118.305 0.502 . . . . 68.64 112.27 177.408 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' THR . . . . . 0.516 ' HB ' ' CBC' ' A' ' 201' ' ' HEM . 29.8 p -72.38 -21.42 61.29 Favored 'General case' 0 C--O 1.233 0.201 0 C-N-CA 120.168 -0.613 . . . . 49.56 112.126 179.104 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.418 ' HG ' ' HA ' ' A' ' 47' ' ' LYS . 19.3 tp -65.47 -41.07 93.77 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 119.834 -0.746 . . . . 56.34 110.975 178.75 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -67.12 -14.84 63.29 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 118.23 -1.388 . . . . 115.89 112.21 -176.193 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.426 ' HD3' ' HA ' ' A' ' 42' ' ' LYS . 20.0 mmtt -62.32 -14.46 39.64 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 113.079 0.77 . . . . 72.27 113.079 169.587 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -113.36 98.01 6.83 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 123.206 0.602 . . . . 58.21 109.627 -172.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 10.2 m-20 -62.63 -26.19 68.5 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 119.585 -0.846 . . . . 101.23 111.224 176.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ARG . . . . . 0.48 ' O ' ' NE2' ' A' ' 48' ' ' HIS . 12.6 mtm180 -67.15 -31.67 72.26 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 112.683 0.624 . . . . 82.83 112.683 176.621 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' PHE . . . . . . . . . . . . . 11.9 m-85 -120.45 -12.99 8.88 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 115.08 1.511 . . . . 61.11 115.08 -169.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.418 ' HA ' ' HG ' ' A' ' 40' ' ' LEU . 0.4 OUTLIER -53.15 -23.38 8.14 Favored 'General case' 0 C--O 1.237 0.405 0 CA-C-N 118.888 0.767 . . . . 100.2 112.319 -173.056 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.551 ' H ' ' CD2' ' A' ' 48' ' ' HIS . 3.6 p80 -78.32 -1.01 31.12 Favored 'General case' 0 C--N 1.328 -0.336 0 C-N-CA 125.243 1.417 . . . . 97.16 113.339 178.03 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 22.0 mt -97.88 124.95 42.53 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 119.033 0.833 . . . . 84.0 109.041 -179.703 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LYS . . . . . 0.436 ' HE2' ' HB2' ' A' ' 50' ' ' LYS . 0.7 OUTLIER -115.18 -62.88 1.54 Allowed 'General case' 0 C--O 1.235 0.333 0 N-CA-C 112.971 0.73 . . . . 98.26 112.971 -171.732 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' THR . . . . . 0.652 HG23 ' HB2' ' A' ' 54' ' ' GLU . 1.8 t -69.73 153.81 42.85 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 119.054 0.843 . . . . 96.66 110.711 178.063 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -61.9 -37.21 83.76 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.545 -0.752 . . . . 87.57 110.814 175.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -60.6 -34.77 74.7 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 111.573 0.212 . . . . 75.76 111.573 177.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.652 ' HB2' HG23 ' A' ' 51' ' ' THR . 1.3 tt0 -67.14 -48.38 68.23 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 120.841 0.353 . . . . 94.96 110.944 177.009 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' MET . . . . . . . . . . . . . 59.4 mtt -60.47 -39.49 87.81 Favored 'General case' 0 C--O 1.235 0.335 0 C-N-CA 120.594 -0.442 . . . . 63.67 111.69 179.794 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 4.0 ttpt -68.35 -24.69 64.83 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 119.535 -0.866 . . . . 102.46 111.391 179.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ALA . . . . . . . . . . . . . . . -86.29 -6.24 59.0 Favored 'General case' 0 C--O 1.238 0.452 0 N-CA-C 112.357 0.503 . . . . 61.24 112.357 178.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' SER . . . . . . . . . . . . . 5.3 t -80.52 107.82 13.64 Favored 'General case' 0 C--N 1.33 -0.241 0 N-CA-C 108.643 -0.873 . . . . 55.68 108.643 -179.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.7 tp10 -64.0 -36.23 83.3 Favored 'General case' 0 C--O 1.239 0.543 0 C-N-CA 119.923 -0.711 . . . . 110.1 111.257 174.312 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -67.89 -32.21 72.54 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 119.174 -1.01 . . . . 93.12 111.792 -179.871 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 9.5 tt -64.41 -44.44 91.25 Favored 'General case' 0 C--O 1.237 0.439 0 C-N-CA 119.474 -0.89 . . . . 54.38 110.37 172.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 27.1 ttpp -58.61 -48.73 80.01 Favored 'General case' 0 C--O 1.237 0.399 0 C-N-CA 120.226 -0.589 . . . . 79.23 110.662 175.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 5.4 mtmt -53.5 -42.27 67.14 Favored 'General case' 0 C--O 1.238 0.479 0 C-N-CA 120.395 -0.522 . . . . 95.68 111.084 177.202 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' HIS . . . . . 0.589 ' O ' HG23 ' A' ' 68' ' ' VAL . 3.2 t60 -72.4 -35.18 68.33 Favored 'General case' 0 CA--C 1.515 -0.374 0 C-N-CA 117.563 -1.655 . . . . 68.38 111.68 -176.76 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLY . . . . . . . . . . . . . . . -50.8 -45.92 48.83 Favored Glycine 0 C--N 1.338 0.64 0 C-N-CA 120.471 -0.871 . . . . 44.29 112.205 169.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 76.9 t -57.96 -48.53 83.86 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 O-C-N 122.209 -0.583 . . . . 47.5 109.868 178.08 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 87.9 m -53.38 -49.22 67.67 Favored 'General case' 0 C--O 1.238 0.455 0 CA-C-N 116.41 -0.359 . . . . 47.04 111.841 178.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' VAL . . . . . 0.589 HG23 ' O ' ' A' ' 64' ' ' HIS . 4.6 t -48.66 -66.04 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.508 -0.646 0 C-N-CA 123.877 0.871 . . . . 57.88 110.063 175.144 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LEU . . . . . . . . . . . . . 17.5 mt -65.57 -39.8 92.07 Favored 'General case' 0 N--CA 1.453 -0.323 0 CA-C-N 113.665 -1.607 . . . . 45.99 111.465 -167.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' THR . . . . . . . . . . . . . 51.6 p -61.37 -42.38 98.62 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 118.69 -1.204 . . . . 59.99 110.188 176.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ALA . . . . . . . . . . . . . . . -64.06 -46.25 85.18 Favored 'General case' 0 C--O 1.234 0.273 0 C-N-CA 119.498 -0.881 . . . . 41.42 110.722 175.289 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' LEU . . . . . . . . . . . . . 20.1 tp -61.26 -44.35 97.39 Favored 'General case' 0 C--O 1.238 0.453 0 O-C-N 122.059 -0.4 . . . . 43.86 111.593 177.976 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' GLY . . . . . . . . . . . . . . . -64.72 -40.04 97.13 Favored Glycine 0 C--N 1.333 0.385 0 C-N-CA 120.281 -0.961 . . . . 42.11 112.499 -177.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' ALA . . . . . . . . . . . . . . . -56.11 -40.7 74.12 Favored 'General case' 0 C--O 1.236 0.354 0 O-C-N 122.378 -0.484 . . . . 49.32 110.954 172.461 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 20.8 mt -69.26 -47.96 70.85 Favored 'Isoleucine or valine' 0 C--O 1.238 0.472 0 C-N-CA 119.687 -0.805 . . . . 48.14 110.133 179.564 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 54.8 mt -59.62 -39.31 83.85 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 120.572 -0.451 . . . . 49.9 111.026 -176.477 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 9.4 mttt -63.04 -19.32 64.27 Favored 'General case' 0 CA--C 1.52 -0.174 0 N-CA-C 112.33 0.493 . . . . 59.15 112.33 179.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 14.4 mmmm -75.13 -7.24 53.23 Favored 'General case' 0 C--N 1.33 -0.281 0 C-N-CA 119.81 -0.756 . . . . 75.06 112.721 176.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 32.7 mtpt 48.06 55.33 8.84 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-O 122.004 0.907 . . . . 66.75 111.53 179.402 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 87.15 -23.33 11.54 Favored Glycine 0 N--CA 1.439 -1.101 0 CA-C-N 114.902 -1.045 . . . . 59.52 115.28 176.378 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -84.33 59.96 5.7 Favored 'General case' 0 N--CA 1.466 0.348 0 CA-C-O 123.07 1.414 . . . . 77.82 110.074 177.278 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' HIS . . . . . . . . . . . . . 1.1 p-80 -116.06 14.8 16.1 Favored 'General case' 0 C--O 1.239 0.527 0 CA-C-N 114.156 -1.384 . . . . 54.91 111.763 -168.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -45.84 -55.3 6.82 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-O 121.076 0.465 . . . . 94.67 111.192 178.389 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -69.93 -30.43 67.83 Favored 'General case' 0 C--O 1.234 0.257 0 N-CA-C 112.066 0.395 . . . . 57.86 112.066 -174.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLU . . . . . . . . . . . . . 45.5 mp0 -77.06 -25.65 52.64 Favored 'General case' 0 CA--C 1.517 -0.297 0 C-N-CA 120.066 -0.654 . . . . 74.68 112.154 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 12.4 mt -78.8 -40.69 32.33 Favored 'General case' 0 C--O 1.238 0.498 0 N-CA-C 112.367 0.506 . . . . 59.81 112.367 -175.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' LYS . . . . . . . . . . . . . 11.7 mtmm -51.29 -50.54 75.37 Favored Pre-proline 0 C--O 1.241 0.615 0 N-CA-C 113.653 0.982 . . . . 90.41 113.653 -174.458 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' PRO . . . . . . . . . . . . . 20.6 Cg_exo -61.12 -37.24 76.65 Favored 'Trans proline' 0 CA--C 1.511 -0.627 0 CA-C-N 121.455 1.555 . . . . 49.24 112.688 178.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.494 HD11 ' CHB' ' A' ' 201' ' ' HEM . 6.8 tp -67.54 -50.28 59.34 Favored 'General case' 0 C--O 1.238 0.485 0 CA-C-O 120.986 0.422 . . . . 55.74 110.558 178.545 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' ALA . . . . . . . . . . . . . . . -55.19 -48.04 74.38 Favored 'General case' 0 C--O 1.239 0.522 0 CA-C-N 115.994 -0.548 . . . . 39.43 110.827 173.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 45.8 tt0 -56.0 -52.14 65.25 Favored 'General case' 0 C--N 1.329 -0.297 0 C-N-CA 120.085 -0.646 . . . . 68.32 111.069 -179.52 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 47.3 p -72.55 -31.88 65.62 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 118.78 -1.168 . . . . 47.03 111.388 -174.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' HIS . . . . . . . . . . . . . 42.0 m80 -82.89 -30.4 28.54 Favored 'General case' 0 N--CA 1.449 -0.483 0 C-N-CA 117.933 -1.507 . . . . 38.54 111.171 -176.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -72.31 -51.66 19.73 Favored 'General case' 0 CA--C 1.528 0.118 0 C-N-CA 119.442 -0.903 . . . . 42.04 111.305 172.821 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' THR . . . . . 0.494 HG22 ' CE2' ' A' ' 151' ' ' TYR . 19.7 p -95.9 -35.84 11.31 Favored 'General case' 0 C--N 1.325 -0.463 0 N-CA-C 113.756 1.021 . . . . 62.69 113.756 -162.947 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 9.3 mmtm -98.27 -48.46 5.06 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-N 118.76 0.709 . . . . 101.74 112.364 -179.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' HIS . . . . . . . . . . . . . 11.7 m-70 -80.89 -26.26 36.97 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 120.4 -0.52 . . . . 52.47 111.806 179.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 25.8 mmtm 57.58 52.8 7.94 Favored 'General case' 0 N--CA 1.463 0.179 0 CA-C-O 121.729 0.775 . . . . 76.47 110.481 -178.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' ILE . . . . . . . . . . . . . 33.3 mm -92.68 118.23 67.89 Favored Pre-proline 0 C--O 1.239 0.509 0 N-CA-C 107.867 -1.16 . . . . 46.9 107.867 -179.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_endo -67.37 150.48 80.98 Favored 'Trans proline' 0 C--N 1.33 -0.397 0 CA-C-N 119.498 0.856 . . . . 43.92 110.778 172.578 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.403 HG12 ' OE1' ' A' ' 152' ' ' GLN . 48.1 mm -55.04 -34.63 32.32 Favored 'Isoleucine or valine' 0 C--O 1.236 0.389 0 CA-C-N 114.964 -1.016 . . . . 43.64 110.863 176.383 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -55.27 -36.3 65.97 Favored 'General case' 0 N--CA 1.455 -0.188 0 C-N-CA 119.823 -0.751 . . . . 79.36 111.055 178.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' TYR . . . . . . . . . . . . . 8.5 m-30 -64.99 -29.78 70.72 Favored 'General case' 0 C--O 1.237 0.433 0 C-N-CA 120.319 -0.552 . . . . 48.86 111.715 176.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.496 HD21 HG21 ' A' ' 142' ' ' ILE . 2.9 mp -67.66 -31.21 71.04 Favored 'General case' 0 CA--C 1.518 -0.282 0 C-N-CA 120.18 -0.608 . . . . 45.07 111.527 173.422 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' GLU . . . . . . . . . . . . . 62.9 mt-10 -66.26 -44.63 83.09 Favored 'General case' 0 C--O 1.238 0.462 0 C-N-CA 119.799 -0.76 . . . . 83.05 110.662 174.478 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' PHE . . . . . . . . . . . . . 22.7 m-30 -57.27 -47.04 82.46 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 120.601 -0.439 . . . . 37.72 110.989 178.057 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' ILE . . . . . . . . . . . . . 14.8 tt -68.5 -28.0 38.64 Favored 'Isoleucine or valine' 0 C--O 1.235 0.341 0 C-N-CA 117.499 -1.681 . . . . 44.21 110.67 -178.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' SER . . . . . . . . . . . . . 45.1 m -63.8 -47.71 79.79 Favored 'General case' 0 CA--C 1.514 -0.43 0 C-N-CA 119.514 -0.874 . . . . 36.25 110.243 176.36 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 61.8 mt-10 -55.56 -44.51 76.88 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 120.875 -0.33 . . . . 82.53 111.373 173.129 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -63.72 -32.56 74.09 Favored 'General case' 0 C--O 1.241 0.633 0 C-N-CA 120.318 -0.553 . . . . 39.15 110.951 -179.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' ILE . . . . . 0.443 HG12 HD13 ' A' ' 28' ' ' ILE . 43.4 mt -66.23 -51.44 59.03 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 C-N-CA 120.154 -0.618 . . . . 36.21 110.274 175.323 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' ILE . . . . . . . . . . . . . 25.8 mm -57.27 -48.2 82.85 Favored 'Isoleucine or valine' 0 C--O 1.242 0.661 0 CA-C-O 121.682 0.753 . . . . 43.97 110.151 -179.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' HIS . . . . . 0.502 ' ND1' ' HD3' ' A' ' 31' ' ' ARG . 38.6 t-80 -56.37 -48.85 76.0 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 116.107 -0.497 . . . . 57.19 111.05 179.504 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' VAL . . . . . . . . . . . . . 3.8 t -66.86 -38.21 80.98 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.355 0 C-N-CA 120.177 -0.609 . . . . 45.81 110.027 -174.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 56.2 mt -61.31 -35.55 77.69 Favored 'General case' 0 CA--C 1.518 -0.25 0 C-N-CA 120.439 -0.505 . . . . 39.64 111.063 177.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' HIS . . . . . . . . . . . . . 31.5 m-70 -66.83 -45.6 77.75 Favored 'General case' 0 C--N 1.333 -0.139 0 C-N-CA 119.355 -0.938 . . . . 52.22 111.218 175.912 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' SER . . . . . . . . . . . . . 88.9 p -75.58 -19.08 59.51 Favored 'General case' 0 C--O 1.233 0.225 0 C-N-CA 118.994 -1.082 . . . . 61.68 112.572 -174.9 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' ARG . . . . . . . . . . . . . 13.4 mtt-85 -97.69 -16.15 20.07 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 113.2 0.815 . . . . 82.42 113.2 177.309 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' HIS . . . . . 0.499 ' HB3' ' HB2' ' A' ' 122' ' ' ASP . 62.4 m-70 -138.13 63.52 36.98 Favored Pre-proline 0 C--O 1.233 0.229 0 CA-C-N 118.227 0.467 . . . . 66.53 109.88 -178.616 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' PRO . . . . . . . . . . . . . 31.9 Cg_exo -60.86 -28.19 86.0 Favored 'Trans proline' 0 C--O 1.238 0.491 0 N-CA-C 114.101 0.77 . . . . 83.28 114.101 -173.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' GLY . . . . . . . . . . . . . . . -99.92 -12.62 39.54 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.415 -0.898 . . . . 88.03 113.779 178.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ASP . . . . . 0.499 ' HB2' ' HB3' ' A' ' 119' ' ' HIS . 24.6 m-20 -98.26 -20.6 17.14 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 113.414 0.894 . . . . 84.39 113.414 -175.545 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -109.47 77.58 1.07 Allowed 'General case' 0 C--N 1.326 -0.454 0 CA-C-O 121.583 0.706 . . . . 58.19 109.33 -172.069 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' GLY . . . . . . . . . . . . . . . -80.1 -172.03 43.76 Favored Glycine 0 CA--C 1.523 0.566 0 CA-C-O 122.651 1.139 . . . . 55.83 113.31 179.067 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' ALA . . . . . . . . . . . . . . . -63.37 -44.26 95.28 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 114.537 -0.831 . . . . 62.33 111.62 -176.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -58.19 -56.05 27.09 Favored 'General case' 0 C--O 1.235 0.334 0 CA-C-O 121.114 0.483 . . . . 84.68 111.458 177.367 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' ALA . . . . . . . . . . . . . . . -53.56 -40.71 65.8 Favored 'General case' 0 C--O 1.235 0.341 0 C-N-CA 120.397 -0.521 . . . . 55.31 110.965 178.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 45.6 tt0 -64.17 -47.76 78.58 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 119.433 -0.907 . . . . 72.98 111.287 178.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' GLY . . . . . . . . . . . . . . . -56.03 -46.5 84.52 Favored Glycine 0 C--N 1.336 0.57 0 C-N-CA 119.528 -1.32 . . . . 39.72 111.525 176.717 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ALA . . . . . . . . . . . . . . . -60.88 -46.81 89.13 Favored 'General case' 0 C--O 1.238 0.481 0 O-C-N 122.355 -0.497 . . . . 45.56 110.818 179.411 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' MET . . . . . . . . . . . . . 63.0 tpp -64.96 -39.65 93.81 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 120.019 -0.672 . . . . 54.62 111.446 -179.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' ASN . . . . . . . . . . . . . 7.9 m-20 -60.7 -44.25 96.79 Favored 'General case' 0 C--O 1.236 0.366 0 C-N-CA 120.638 -0.425 . . . . 69.84 111.245 177.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 7.5 mtpt -63.51 -39.03 93.36 Favored 'General case' 0 N--CA 1.45 -0.459 0 C-N-CA 120.59 -0.444 . . . . 66.29 110.674 178.429 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' ALA . . . . . . . . . . . . . . . -66.22 -44.09 84.81 Favored 'General case' 0 C--N 1.328 -0.354 0 C-N-CA 118.844 -1.142 . . . . 41.76 110.719 178.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 74.7 mt -68.04 -35.84 78.91 Favored 'General case' 0 C--O 1.234 0.245 0 C-N-CA 119.528 -0.869 . . . . 46.02 110.407 -179.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -61.29 -51.61 68.15 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 120.537 -0.465 . . . . 73.03 111.214 175.842 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' LEU . . . . . . . . . . . . . 12.9 tp -53.24 -46.89 69.33 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-O 121.003 0.43 . . . . 46.11 110.442 176.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' PHE . . . . . . . . . . . . . 40.5 t80 -52.11 -53.71 39.26 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.316 -0.402 . . . . 42.93 111.039 172.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' ARG . . . . . . . . . . . . . 82.2 mtm-85 -62.73 -42.14 99.52 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.226 -0.589 . . . . 49.99 111.945 -178.6 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' LYS . . . . . . . . . . . . . 15.2 mttp -63.05 -41.5 99.49 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 122.121 -0.362 . . . . 77.99 111.406 177.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 -69.97 -36.25 75.07 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 119.602 -0.839 . . . . 50.49 111.106 179.117 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' ILE . . . . . 0.496 HG21 HD21 ' A' ' 104' ' ' LEU . 1.9 mm -64.09 -41.91 93.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 C-N-CA 119.787 -0.765 . . . . 61.49 109.67 175.047 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' ALA . . . . . . . . . . . . . . . -55.56 -47.47 76.34 Favored 'General case' 0 CA--C 1.518 -0.257 0 C-N-CA 120.745 -0.382 . . . . 39.94 110.272 176.338 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' ALA . . . . . . . . . . . . . . . -63.3 -33.51 75.68 Favored 'General case' 0 C--O 1.235 0.31 0 C-N-CA 119.17 -1.012 . . . . 47.92 111.121 -179.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' LYS . . . . . . . . . . . . . 39.1 mmtm -74.84 -30.55 61.4 Favored 'General case' 0 C--O 1.238 0.498 0 C-N-CA 118.678 -1.209 . . . . 78.97 111.528 179.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' TYR . . . . . . . . . . . . . 3.3 m-85 -57.08 -52.07 66.75 Favored 'General case' 0 CA--C 1.513 -0.46 0 C-N-CA 120.105 -0.638 . . . . 42.08 110.708 168.574 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' LYS . . . . . . . . . . . . . 5.4 mttp -55.09 -39.02 68.84 Favored 'General case' 0 C--O 1.232 0.174 0 CA-C-N 116.664 -0.244 . . . . 99.82 111.157 179.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' GLU . . . . . . . . . . . . . 17.2 mt-10 -67.2 -38.65 85.7 Favored 'General case' 0 C--O 1.239 0.517 0 N-CA-C 111.456 0.169 . . . . 101.02 111.456 -179.36 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' LEU . . . . . . . . . . . . . 17.2 mt -73.87 1.36 10.83 Favored 'General case' 0 C--O 1.24 0.586 0 N-CA-C 112.964 0.727 . . . . 50.81 112.964 171.91 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' GLY . . . . . . . . . . . . . . . 85.42 28.3 30.52 Favored Glycine 0 N--CA 1.448 -0.525 0 CA-C-O 119.556 -0.58 . . . . 52.8 113.938 177.933 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' TYR . . . . . 0.494 ' CE2' HG22 ' A' ' 95' ' ' THR . 30.3 m-85 -125.45 143.53 50.95 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 118.279 1.039 . . . . 68.86 112.396 -170.082 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' GLN . . . . . 0.403 ' OE1' HG12 ' A' ' 101' ' ' ILE . 2.8 tt0 68.01 168.07 0.26 Allowed 'General case' 0 C--O 1.234 0.261 0 C-N-CA 127.069 2.148 . . . . 103.5 112.903 161.703 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 0.499 0 N-CA-C 117.34 1.696 . . . . 124.23 117.34 163.371 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' HEM . . . . . 0.516 ' CBC' ' HB ' ' A' ' 39' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' CMO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . 0.667 ' O ' ' OE2' ' A' ' 38' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . 0.542 ' O ' ' N ' ' A' ' 0' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 325' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_