data_6e7m_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 6e7m _Structure_validation_residue.Date_analyzed 2019-10-11 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 8.9 t . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.8 0.333 . . . . 50.07 111.139 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 -88.53 -6.05 57.82 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 112.965 0.728 . . . . 37.41 112.965 177.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -82.65 115.0 21.41 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.24 -0.652 . . . . 36.44 109.24 177.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -114.41 14.37 17.88 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 112.712 0.634 . . . . 29.08 112.712 -178.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ASN . . . . . 0.523 ' OD1' ' N ' ' A' ' 44' ' ' GLN . 49.9 m-80 -62.95 153.47 33.55 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.501 0.667 . . . . 30.16 110.774 179.337 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 133.0 179.35 16.23 Favored Glycine 0 N--CA 1.445 -0.717 0 CA-C-O 122.274 0.93 . . . . 31.15 112.892 169.03 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 68.2 m -102.7 110.97 23.08 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 107.992 -1.114 . . . . 34.09 107.992 176.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' TRP . . . . . . . . . . . . . 71.5 m95 -105.66 138.94 41.02 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 122.738 0.415 . . . . 29.44 110.493 -175.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -119.56 135.19 54.89 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.272 -0.64 . . . . 65.19 109.272 177.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 38.0 ttm -67.44 123.57 20.77 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.011 -0.541 . . . . 27.37 110.822 -171.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLU . . . . . 0.553 ' OE1' ' NZ ' ' C' ' 114' ' ' LYS . 14.8 mt-10 -84.76 -55.93 3.85 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.207 -0.451 . . . . 54.64 110.882 174.316 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 55.9 p -134.74 170.13 16.29 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 121.591 0.71 . . . . 29.56 109.59 -178.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -162.35 104.31 1.11 Allowed 'General case' 0 C--O 1.233 0.22 0 N-CA-C 107.295 -1.372 . . . . 30.24 107.295 -177.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -109.24 142.33 40.24 Favored 'General case' 0 C--O 1.236 0.373 0 O-C-N 123.522 0.514 . . . . 46.49 110.408 -177.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 48.6 t30 55.65 41.54 30.41 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.629 -0.714 . . . . 30.05 111.526 178.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -72.73 -41.27 65.36 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.203 -0.599 . . . . 34.08 110.949 174.496 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 -65.86 -39.12 90.42 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.813 -0.355 . . . . 49.93 111.461 -178.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.69 -44.01 90.58 Favored Glycine 0 C--N 1.335 0.49 0 C-N-CA 119.978 -1.106 . . . . 36.79 112.641 178.328 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' TYR . . . . . 0.454 ' OH ' ' O ' ' C' ' 205' ' ' ACT . 56.2 t80 -62.51 -40.76 97.76 Favored 'General case' 0 C--O 1.237 0.396 0 O-C-N 122.286 -0.537 . . . . 36.64 111.186 176.951 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 41.8 mmm -69.02 -33.9 74.39 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 119.938 -0.705 . . . . 42.91 112.064 179.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.0 tttm -75.65 -28.99 58.96 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 119.808 -0.757 . . . . 62.82 110.83 179.432 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.96 -31.65 67.08 Favored 'General case' 0 CA--C 1.52 -0.21 0 O-C-N 122.166 -0.334 . . . . 36.45 111.313 170.102 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 86.9 mt -92.37 12.16 23.58 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 112.838 0.681 . . . . 37.25 112.838 177.955 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ASP . . . . . 0.497 ' OD2' ' NZ ' ' C' ' 101' ' ' LYS . 35.1 m-20 60.79 30.25 19.55 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 123.284 0.634 . . . . 40.88 112.205 177.486 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 30.7 mm -76.55 135.81 25.98 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 N-CA-C 108.918 -0.771 . . . . 35.08 108.918 175.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -67.72 173.77 4.07 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 122.132 0.968 . . . . 45.8 110.929 -172.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 79.3 t80 -75.29 -40.12 58.98 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.057 -0.974 . . . . 34.7 112.673 -166.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 10.8 m -64.96 -51.35 62.27 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 120.415 -0.514 . . . . 37.28 111.443 -172.871 -83.347 -48.497 -74.152 103.967 2.032 103.615 -42.235 -83.628 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -64.48 -27.07 68.73 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.049 -0.661 . . . . 35.7 111.395 177.363 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 11.6 mtp180 -64.63 -41.87 95.85 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.527 -0.469 . . . . 35.1 111.06 173.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.6 ttmt -73.77 -36.59 65.1 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.405 -0.518 . . . . 38.2 111.382 -178.268 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 45.7 mm -77.75 -44.09 29.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 C-N-CA 120.139 -0.624 . . . . 40.77 111.114 -176.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.53 -27.93 68.81 Favored 'General case' 0 C--O 1.236 0.385 0 O-C-N 121.881 -0.512 . . . . 29.52 112.132 -174.636 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 2.1 p -73.44 -16.77 17.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 120.412 -0.515 . . . . 33.82 111.798 -179.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 78.1 mtt180 -95.22 -7.43 39.04 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 113.309 0.855 . . . . 52.96 113.309 -179.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 49.5 mt -100.55 145.15 28.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.444 0.64 . . . . 27.66 110.867 -175.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 25.3 m -82.62 120.95 26.19 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 115.422 -0.808 . . . . 33.61 109.179 176.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 -89.87 139.34 30.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.01 0.433 . . . . 35.34 110.177 -178.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . . 87.2 m -123.86 112.33 17.14 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 107.147 -1.427 . . . . 38.44 107.147 178.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' LYS . . . . . 0.517 ' NZ ' ' OG1' ' A' ' 53' ' ' THR . 19.3 ttmm -102.52 115.07 29.82 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 124.003 0.921 . . . . 31.44 108.801 -177.375 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 84.9 t -95.23 124.78 47.91 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 N-CA-C 107.733 -1.21 . . . . 33.91 107.733 176.389 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 29.6 mt -122.03 122.15 65.89 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 N-CA-C 108.711 -0.848 . . . . 30.89 108.711 -177.686 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -112.36 117.14 31.64 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 108.129 -1.063 . . . . 42.52 108.129 172.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLN . . . . . 0.523 ' N ' ' OD1' ' A' ' 5' ' ' ASN . 39.7 tt0 -126.04 128.16 46.98 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 110.179 -0.304 . . . . 29.94 110.179 -174.058 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 59.4 t0 -124.1 97.71 5.46 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 107.013 -1.477 . . . . 26.7 107.013 173.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 62.15 -100.54 0.3 Allowed Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 116.371 -0.377 . . . . 32.64 112.723 -177.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 95.3 m-20 -112.61 6.11 18.17 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 112.584 0.587 . . . . 40.05 112.584 178.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 27.8 m-20 -99.97 124.4 45.27 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 108.6 -0.889 . . . . 48.92 108.6 177.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -118.45 155.92 29.93 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 121.725 0.774 . . . . 40.76 111.142 -171.973 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 13.5 mttp -147.31 101.86 3.42 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 106.696 -1.594 . . . . 48.6 106.696 175.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -110.77 124.71 52.52 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.008 -0.738 . . . . 36.23 109.008 -175.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 12.4 tttm -133.22 102.15 5.46 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 108.393 -0.966 . . . . 53.94 108.393 178.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' THR . . . . . 0.517 ' OG1' ' NZ ' ' A' ' 40' ' ' LYS . 89.7 m -96.01 125.95 40.91 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 109.133 -0.692 . . . . 34.44 109.133 176.843 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.6 t -128.56 165.34 20.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.472 0.654 . . . . 39.21 109.719 -175.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' SER . . . . . 0.414 ' O ' ' N ' ' C' ' 57' ' ' PHE . 57.9 m -144.13 130.02 19.39 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.669 -0.696 . . . . 31.45 109.535 -179.534 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 54.2 m -88.39 115.14 25.68 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 108.77 -0.826 . . . . 34.91 108.77 178.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 25.0 t80 -76.62 -72.88 0.31 Allowed 'General case' 0 C--O 1.236 0.348 0 CA-C-O 120.873 0.368 . . . . 44.99 110.671 178.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 3.2 mmt85 -140.95 151.38 44.14 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 109.549 -0.537 . . . . 53.81 109.549 179.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 -118.05 139.63 50.93 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 108.949 -0.76 . . . . 48.88 108.949 172.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -130.85 100.99 5.45 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 108.626 -0.879 . . . . 69.67 108.626 -177.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -103.58 125.55 50.18 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.299 -0.63 . . . . 58.31 109.299 176.452 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.9 p -131.62 135.78 58.42 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 N-CA-C 108.359 -0.978 . . . . 44.36 108.359 176.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -119.93 128.52 53.68 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 108.599 -0.889 . . . . 59.33 108.599 178.486 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 54.6 p90 -150.19 160.86 43.36 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 121.605 0.716 . . . . 39.75 110.137 -177.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 37.8 m -122.64 138.19 54.67 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 114.747 -1.115 . . . . 43.29 108.373 173.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' VAL . . . . . . . . . . . . . 54.9 t -61.77 130.83 26.5 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 CA-C-O 121.184 0.516 . . . . 48.72 109.957 -175.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.18 0.26 88.73 Favored Glycine 0 N--CA 1.446 -0.668 0 N-CA-C 115.517 0.967 . . . . 43.02 115.517 178.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 23.7 t -118.42 112.68 39.21 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 N-CA-C 107.595 -1.261 . . . . 48.12 107.595 -179.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' GLU . . . . . . . . . . . . . 20.3 mt-10 -69.45 158.39 35.24 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.767 0.794 . . . . 79.31 110.515 179.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 24.3 p90 -152.95 154.31 34.74 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.536 -0.756 . . . . 47.89 109.924 -178.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ASP . . . . . 0.475 ' OD1' ' NZ ' ' A' ' 83' ' ' LYS . 37.9 m-20 -80.25 101.2 8.74 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 108.322 -0.992 . . . . 57.21 108.322 177.539 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 68.1 tt0 -103.72 120.73 41.53 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 109.455 -0.572 . . . . 44.07 109.455 -178.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 47.7 m-85 -93.7 114.31 26.58 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 107.6 -1.259 . . . . 47.48 107.6 169.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 76.5 p -73.68 55.8 0.52 Allowed 'General case' 0 C--O 1.234 0.279 0 C-N-CA 120.821 -0.351 . . . . 47.79 111.698 -174.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.2 ptmm? -63.26 161.98 12.88 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 109.698 -0.482 . . . . 56.0 109.698 178.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 54.3 m 60.54 30.16 19.55 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 117.844 0.293 . . . . 52.3 111.781 -176.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 10.1 tp -157.54 -94.3 0.03 OUTLIER 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.698 -0.482 . . . . 44.34 109.698 173.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 23.2 p-10 -112.04 -10.6 13.91 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 113.15 0.796 . . . . 42.84 113.15 174.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 30.8 t30 59.26 53.7 5.2 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.707 0.765 . . . . 39.76 111.733 173.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 74.4 mtt85 -110.05 153.48 24.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.734 -0.666 . . . . 35.26 109.684 174.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 16.9 t-160 -91.51 115.25 27.88 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 109.138 -0.69 . . . . 43.51 109.138 178.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 29.6 m -129.39 147.38 33.32 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 N-CA-C 108.641 -0.874 . . . . 35.18 108.641 178.328 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' LYS . . . . . 0.475 ' NZ ' ' OD1' ' A' ' 71' ' ' ASP . 54.7 mttm -93.85 113.42 25.45 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 107.478 -1.305 . . . . 55.4 107.478 171.386 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -103.18 144.75 30.91 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 120.909 0.385 . . . . 42.37 110.797 -171.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' LEU . . . . . . . . . . . . . 47.0 tp -138.85 127.99 24.0 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 108.747 -0.834 . . . . 47.7 108.747 177.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 57.5 t -113.87 129.63 69.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 N-CA-C 108.608 -0.886 . . . . 46.44 108.608 -177.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 73.5 p -136.01 159.58 41.25 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.564 0.697 . . . . 45.68 109.498 -178.967 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' TRP . . . . . . . . . . . . . 85.0 m95 -93.35 120.14 33.29 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.043 -0.98 . . . . 53.26 109.277 176.124 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -105.09 91.56 3.85 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 106.315 -1.735 . . . . 64.69 106.315 171.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' GLY . . . . . 0.459 ' O ' ' NH2' ' C' ' 2' ' ' ARG . . . 64.46 -92.13 0.12 Allowed Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 111.152 -0.779 . . . . 58.8 111.152 -172.699 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -125.07 2.14 7.95 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 113.011 0.745 . . . . 59.71 113.011 174.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 61.3 t -96.9 129.07 47.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 108.749 -0.834 . . . . 42.85 108.749 -178.153 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 13.5 tp -85.51 104.8 15.61 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.692 -0.855 . . . . 41.3 108.692 -179.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 48.2 t -105.34 135.69 42.4 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 N-CA-C 109.018 -0.734 . . . . 47.01 109.018 -175.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' CYS . . . . . . . . . . . . . 8.3 t -130.23 126.22 36.82 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 109.884 -0.413 . . . . 42.32 109.884 -179.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 62.0 t -106.43 126.6 62.14 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 N-CA-C 108.163 -1.051 . . . . 38.46 108.163 176.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -110.16 96.87 6.5 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 107.728 -1.212 . . . . 36.25 107.728 179.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 13.0 mmtm -82.62 123.35 29.16 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 109.717 -0.475 . . . . 56.16 109.717 -177.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -172.98 -138.15 2.54 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 116.354 -0.385 . . . . 38.07 112.805 179.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 79.3 tt0 -66.6 -61.76 1.81 Allowed 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.604 -0.439 . . . . 45.7 110.902 179.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -70.28 134.75 48.29 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.136 0.493 . . . . 38.31 110.358 178.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -96.72 162.75 13.3 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.47 0.652 . . . . 63.23 110.161 177.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ASN . . . . . . . . . . . . . 2.8 t30 52.7 46.93 25.78 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-N 115.249 -0.887 . . . . 71.84 110.29 -173.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 70.1 ttt180 -114.14 128.94 56.6 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.476 -0.784 . . . . 34.15 109.542 -177.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 170.81 -160.19 32.62 Favored Glycine 0 N--CA 1.45 -0.409 0 N-CA-C 109.815 -1.314 . . . . 33.26 109.815 -179.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 34.3 p-90 -158.06 156.87 31.83 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 119.449 -0.901 . . . . 37.75 109.655 175.474 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -122.79 128.43 50.44 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.137 -0.938 . . . . 45.67 108.67 175.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 32.8 ttmt -132.89 113.72 13.21 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 108.662 -0.866 . . . . 40.58 108.662 -172.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 19.5 p90 -143.04 157.86 44.14 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.429 0.633 . . . . 43.29 109.91 -178.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 19.7 mm -99.97 137.28 27.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 CA-C-N 115.416 -0.811 . . . . 50.12 108.814 179.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -130.63 113.4 14.15 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 108.088 -1.079 . . . . 54.92 108.088 173.257 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 60.82 -99.96 0.21 Allowed Glycine 0 N--CA 1.449 -0.467 0 CA-C-N 116.265 -0.425 . . . . 67.15 112.543 -177.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -121.75 11.37 10.44 Favored 'General case' 0 C--O 1.237 0.432 0 N-CA-C 112.416 0.524 . . . . 67.65 112.416 178.772 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -118.42 148.25 42.74 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 118.416 0.553 . . . . 53.68 110.692 -175.361 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' LEU . . . . . . . . . . . . . 17.2 tp -102.06 120.71 40.88 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.24 -0.891 . . . . 40.05 109.006 179.14 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -105.51 126.31 51.98 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 109.429 -0.582 . . . . 48.62 109.429 -179.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 24.6 tp -131.33 122.92 27.23 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 108.691 -0.855 . . . . 35.61 108.691 -179.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -118.72 108.86 15.4 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 108.31 -0.996 . . . . 49.41 108.31 -179.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 3.9 mt -88.17 129.93 35.19 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 108.997 -0.742 . . . . 33.58 108.997 175.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' THR . . . . . . . . . . . . . 3.6 m -125.2 131.35 53.19 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 109.622 -0.51 . . . . 44.77 109.622 -171.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 53.9 t -150.42 113.31 4.79 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 108.091 -1.077 . . . . 38.42 108.091 176.123 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 60.78 -110.22 2.87 Favored Glycine 0 N--CA 1.45 -0.41 0 O-C-N 123.354 0.408 . . . . 37.1 113.138 -179.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 42.1 p-10 -112.44 16.93 19.7 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 112.166 0.432 . . . . 55.0 112.166 177.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -116.46 131.88 56.83 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 109.254 -0.647 . . . . 43.53 109.254 179.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 17.3 t -133.35 122.68 45.22 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 N-CA-C 108.121 -1.066 . . . . 39.17 108.121 -179.305 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -105.51 135.44 46.91 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 123.385 0.674 . . . . 32.38 109.567 177.285 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 22.8 ttp180 -108.74 131.55 54.83 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 109.68 -0.489 . . . . 40.93 109.68 -179.786 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -133.61 120.98 21.39 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 108.247 -1.02 . . . . 37.84 108.247 -179.971 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 46.0 t -111.14 133.85 55.35 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 N-CA-C 108.324 -0.991 . . . . 38.07 108.324 179.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' PHE . . . . . . . . . . . . . 60.8 m-85 -119.49 141.97 48.7 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 123.779 0.832 . . . . 38.43 109.815 -175.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 63.3 pttt -100.96 149.13 24.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.924 -0.58 . . . . 54.67 109.729 173.089 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 21.6 tttm -82.89 135.66 34.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.798 -0.637 . . . . 50.4 110.748 -176.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 20.3 mtmt . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 115.826 -0.625 . . . . 63.04 110.821 177.206 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 1' ' ' THR . . . . . . . . . . . . . 5.2 t . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.858 0.361 . . . . 47.84 111.405 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 86.6 mtt180 -98.38 -17.23 18.95 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 113.046 0.758 . . . . 43.49 113.046 175.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -75.1 121.32 21.86 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 109.224 -0.658 . . . . 54.93 109.224 178.388 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -119.85 20.57 12.2 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.227 -0.442 . . . . 41.97 112.0 -175.532 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 11.0 m-80 -65.3 156.12 33.07 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 121.772 0.796 . . . . 39.53 110.653 179.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . 118.94 -173.62 15.01 Favored Glycine 0 N--CA 1.449 -0.452 0 CA-C-O 122.113 0.84 . . . . 42.93 112.33 170.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 91.6 m -111.65 120.31 41.62 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 108.907 -0.775 . . . . 44.78 108.907 -177.46 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' TRP . . . . . . . . . . . . . 6.7 m95 -118.62 132.53 56.19 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.408 -0.59 . . . . 50.45 109.408 -176.245 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' GLU . . . . . 0.44 ' OE1' ' OG1' ' B' ' 39' ' ' THR . 3.1 mm-40 -107.3 139.28 42.01 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 110.074 -0.343 . . . . 66.26 110.074 178.896 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 29.2 ttm -67.62 135.89 53.56 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.916 -0.584 . . . . 48.65 111.161 -175.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 20.7 mt-10 -104.45 -64.0 1.16 Allowed 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.728 -0.669 . . . . 66.93 111.864 175.595 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 86.2 p -119.28 157.14 28.66 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 121.414 0.626 . . . . 45.32 109.688 178.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 48.9 t30 -154.15 89.45 1.29 Allowed 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 107.521 -1.288 . . . . 42.83 107.521 -176.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -95.23 138.56 32.77 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.729 -0.669 . . . . 53.98 110.573 -177.5 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' ASN . . . . . . . . . . . . . 51.2 t30 58.58 33.14 22.86 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.806 -0.633 . . . . 38.56 111.982 175.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -68.15 -37.1 80.68 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 120.126 -0.629 . . . . 41.31 110.862 174.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' GLU . . . . . 0.482 ' OE2' ' NZ ' ' B' ' 31' ' ' LYS . 87.3 tt0 -69.48 -31.04 69.08 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 120.674 -0.41 . . . . 66.6 111.735 179.146 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.68 -40.52 76.63 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 119.751 -1.214 . . . . 36.47 112.209 174.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -65.64 -41.17 92.93 Favored 'General case' 0 C--O 1.236 0.39 0 O-C-N 122.355 -0.497 . . . . 36.09 111.246 177.523 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 73.2 mtm -68.61 -37.59 79.88 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.013 -0.675 . . . . 49.26 111.186 177.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 20.1 tttt -67.96 -30.44 69.73 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.518 -0.473 . . . . 49.12 111.562 178.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.32 -25.29 65.94 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.102 -0.639 . . . . 32.63 111.477 174.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 65.2 mt -89.77 5.67 45.01 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 112.632 0.605 . . . . 34.14 112.632 176.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 58.75 39.58 24.07 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 121.317 0.58 . . . . 38.01 111.232 -179.313 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 38.7 mm -73.4 148.99 8.35 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 CA-C-O 121.541 0.686 . . . . 40.43 109.883 -178.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -46.1 130.63 10.13 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.63 -0.714 . . . . 57.17 111.362 175.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' PHE . . . . . . . . . . . . . 58.9 t80 -54.47 -58.35 7.81 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.691 -0.686 . . . . 55.07 111.932 -172.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' CYS . . . . . . . . . . . . . 14.3 m -62.07 -30.61 71.11 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.404 -0.519 . . . . 53.29 111.622 -179.785 -82.235 -45.32 -70.379 104.387 2.032 104.247 -54.445 -73.237 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' THR . . . . . . . . . . . . . 88.3 m -64.12 -43.41 95.36 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 120.342 -0.543 . . . . 53.69 111.118 177.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' ARG . . . . . . . . . . . . . 19.6 mtm-85 -61.34 -45.96 92.22 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.089 -0.644 . . . . 45.33 110.742 172.209 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' LYS . . . . . 0.482 ' NZ ' ' OE2' ' B' ' 17' ' ' GLU . 33.9 mmtt -60.76 -32.54 71.84 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 112.136 0.421 . . . . 56.26 112.136 -175.022 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' ILE . . . . . . . . . . . . . 7.3 mm -84.18 -39.36 14.61 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 C-N-CA 120.447 -0.501 . . . . 47.33 111.273 176.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -67.32 -3.13 7.24 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 113.024 0.75 . . . . 48.05 113.024 176.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' VAL . . . . . . . . . . . . . 44.8 t -54.93 -59.04 2.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 CA-C-N 118.605 0.639 . . . . 57.1 110.336 175.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -123.26 86.25 2.55 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 107.768 -1.197 . . . . 69.79 107.768 -177.491 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' LEU . . . . . . . . . . . . . 5.3 mt -131.94 153.52 50.2 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 108.163 -1.051 . . . . 59.58 108.163 174.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' THR . . . . . . . . . . . . . 2.3 m -88.12 123.93 33.28 Favored 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 120.085 -0.646 . . . . 70.05 109.291 -173.938 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -109.01 130.68 55.48 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 109.868 -0.419 . . . . 57.58 109.868 -178.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' THR . . . . . 0.44 ' OG1' ' OE1' ' B' ' 9' ' ' GLU . 27.4 m -123.56 120.39 32.72 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 108.469 -0.937 . . . . 52.22 108.469 175.114 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 13.8 ttmt -114.36 100.68 8.51 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 124.289 1.036 . . . . 56.06 108.545 -172.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 43.1 t -91.75 119.7 39.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 N-CA-C 108.027 -1.101 . . . . 43.25 108.027 173.201 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' ILE . . . . . . . . . . . . . 54.5 mt -116.61 124.23 72.5 Favored 'Isoleucine or valine' 0 C--O 1.24 0.559 0 N-CA-C 108.446 -0.946 . . . . 39.11 108.446 -178.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -114.26 110.08 19.37 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 107.522 -1.288 . . . . 58.12 107.522 175.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -121.95 127.17 50.06 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 122.995 0.518 . . . . 40.9 110.089 -173.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -121.58 100.76 7.2 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 106.74 -1.578 . . . . 69.04 106.74 172.609 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . 63.51 -109.25 2.62 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 121.365 -0.445 . . . . 42.58 112.108 -175.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -103.63 -3.73 24.75 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 112.653 0.612 . . . . 49.71 112.653 175.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -83.78 116.76 22.86 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 109.338 -0.615 . . . . 59.98 109.338 177.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -112.96 140.4 47.8 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 122.86 0.464 . . . . 41.9 110.421 -176.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 12.6 mttp -136.66 108.69 7.17 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 107.664 -1.235 . . . . 55.59 107.664 169.521 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -115.05 123.58 49.41 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 123.505 0.722 . . . . 60.55 109.5 -172.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' LYS . . . . . 0.638 ' NZ ' ' OD2' ' D' ' 61' ' ' ASP . 1.6 mptp? -118.1 123.28 45.21 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 108.389 -0.967 . . . . 60.96 108.389 178.45 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' THR . . . . . . . . . . . . . 1.3 p -125.49 114.23 18.52 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 109.151 -0.685 . . . . 61.25 109.151 -178.676 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' THR . . . . . . . . . . . . . 1.2 t -98.92 129.84 45.27 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 109.68 -0.489 . . . . 56.8 109.68 177.289 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 39.6 t -106.81 88.43 2.75 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 107.785 -1.191 . . . . 58.37 107.785 179.355 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 17.0 m -65.69 127.6 32.58 Favored 'General case' 0 C--O 1.243 0.712 0 CA-C-N 115.786 -0.643 . . . . 71.79 110.646 175.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' PHE . . . . . . . . . . . . . 36.7 t80 -66.06 -108.68 0.0 OUTLIER 'General case' 0 C--O 1.235 0.328 0 C-N-CA 126.034 1.734 . . . . 73.25 110.103 173.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 4.3 mmt85 -103.25 139.98 37.99 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.726 -0.472 . . . . 71.08 109.726 176.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' ASN . . . . . . . . . . . . . 2.4 p30 -130.26 116.29 18.17 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 107.211 -1.403 . . . . 73.93 107.211 166.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -112.72 101.07 9.19 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 108.899 -0.778 . . . . 57.58 108.899 -169.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -92.53 133.13 36.23 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 109.425 -0.583 . . . . 68.58 109.425 175.711 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' VAL . . . . . . . . . . . . . 2.9 p -149.32 126.66 2.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 N-CA-C 108.106 -1.072 . . . . 64.02 108.106 175.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' ASP . . . . . 0.428 ' N ' ' OD1' ' B' ' 63' ' ' ASP . 1.7 p-10 -120.65 141.4 50.4 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.213 -0.662 . . . . 75.27 109.213 179.193 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -158.99 156.32 29.18 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.445 0.64 . . . . 57.96 109.64 -174.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' THR . . . . . . . . . . . . . 61.8 m -107.23 117.71 34.79 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 107.651 -1.24 . . . . 64.28 107.651 169.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 2.3 p -61.36 124.36 15.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 N-CA-C 109.073 -0.714 . . . . 51.61 109.073 -176.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' GLY . . . . . 0.431 ' N ' ' O ' ' B' ' 86' ' ' VAL . . . 105.59 -3.5 39.56 Favored Glycine 0 N--CA 1.449 -0.457 0 CA-C-O 119.023 -0.876 . . . . 53.87 114.616 -174.453 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 34.6 t -120.49 120.98 64.29 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 CA-C-N 118.534 1.167 . . . . 52.41 107.947 -179.948 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -78.62 125.97 30.1 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 110.057 -0.349 . . . . 59.26 110.057 -178.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 27.7 p90 -128.3 150.55 50.02 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.04 -0.527 . . . . 56.94 109.756 -176.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' ASP . . . . . 0.696 ' N ' ' OD1' ' B' ' 71' ' ' ASP . 17.3 t70 -81.81 113.06 19.51 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 108.608 -0.886 . . . . 52.53 108.608 176.968 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -101.95 119.05 38.17 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 109.156 -0.683 . . . . 48.62 109.156 -179.181 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -96.94 106.06 18.31 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 107.575 -1.269 . . . . 42.4 107.575 172.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 69.5 p -77.23 67.14 3.14 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 122.494 1.14 . . . . 38.69 109.938 -173.411 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -60.79 152.01 28.15 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 114.872 -1.058 . . . . 54.85 109.904 173.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 76' ' ' SER . . . . . . . . . . . . . 52.9 m 70.35 -16.88 0.29 Allowed 'General case' 0 C--O 1.235 0.3 0 C-N-CA 123.816 0.846 . . . . 64.32 112.05 178.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 9.5 mt -95.02 -100.95 0.15 Allowed 'General case' 0 C--O 1.235 0.311 0 N-CA-C 110.231 -0.285 . . . . 53.56 110.231 175.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -108.52 -2.69 18.72 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 112.806 0.669 . . . . 43.24 112.806 175.953 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 79' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 55.34 66.64 1.17 Allowed 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 122.519 1.152 . . . . 50.73 110.929 177.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 80' ' ' ARG . . . . . 0.423 ' NH2' ' OD2' ' D' ' 24' ' ' ASP . 75.4 mtt85 -133.22 149.16 52.02 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 114.143 -1.389 . . . . 39.36 109.678 178.76 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 81' ' ' HIS . . . . . . . . . . . . . 56.3 m80 -92.38 126.02 37.28 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.601 -0.727 . . . . 47.09 109.204 173.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 82' ' ' VAL . . . . . 0.94 ' CG1' ' NH2' ' B' ' 104' ' ' ARG . 20.2 m -128.72 154.39 39.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 N-CA-C 108.969 -0.752 . . . . 50.1 108.969 177.569 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 83' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -93.35 96.89 10.23 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 106.614 -1.624 . . . . 50.05 106.614 169.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -98.17 129.08 44.95 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.139 -0.482 . . . . 47.86 109.887 -174.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -129.39 132.76 47.1 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 108.17 -1.048 . . . . 48.17 108.17 178.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 86' ' ' VAL . . . . . 0.431 ' O ' ' N ' ' B' ' 67' ' ' GLY . 43.7 t -115.51 126.31 73.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 N-CA-C 108.628 -0.879 . . . . 54.65 108.628 -176.649 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 1.6 p -118.15 157.08 27.59 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 123.707 0.803 . . . . 51.63 110.108 174.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 88' ' ' TRP . . . . . . . . . . . . . 29.7 m95 -89.55 138.35 31.53 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.722 -1.126 . . . . 52.14 109.414 167.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -133.07 80.16 1.87 Allowed 'General case' 0 C--O 1.235 0.335 0 N-CA-C 106.223 -1.769 . . . . 48.98 106.223 174.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . 58.35 -99.07 0.11 Allowed Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.824 -0.626 . . . . 54.95 112.788 -176.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -87.93 -30.7 19.88 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 112.505 0.558 . . . . 64.06 112.505 178.278 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 10.3 t -93.92 133.62 34.34 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 CA-C-N 118.049 0.386 . . . . 49.67 110.015 -167.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 18.8 tp -93.26 111.05 22.59 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 107.884 -1.154 . . . . 44.97 107.884 172.333 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 94' ' ' VAL . . . . . . . . . . . . . 5.1 t -107.14 142.38 20.04 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 N-CA-C 108.536 -0.912 . . . . 48.56 108.536 -172.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 95' ' ' CYS . . . . . . . . . . . . . 6.8 t -136.86 128.78 29.22 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 109.919 -0.401 . . . . 48.42 109.919 178.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 16.4 t -108.38 127.27 64.86 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 N-CA-C 107.985 -1.117 . . . . 41.36 107.985 175.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 97' ' ' GLN . . . . . 0.526 ' CB ' ' CD ' ' B' ' 104' ' ' ARG . 39.3 mt-30 -110.74 87.68 2.59 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 107.818 -1.178 . . . . 44.34 107.818 -179.266 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 25.1 mmtt -73.58 119.76 18.24 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 116.044 -0.526 . . . . 52.79 109.876 -178.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 99' ' ' GLY . . . . . . . . . . . . . . . -168.62 -136.98 2.15 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.516 -0.85 . . . . 39.14 114.521 -179.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' GLU . . . . . . . . . . . . . 32.7 tp10 -70.03 -38.98 76.01 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.756 -0.377 . . . . 35.8 111.456 -176.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 101' ' ' LYS . . . . . 0.45 ' NZ ' ' OD2' ' D' ' 24' ' ' ASP . 25.5 mmtt -95.34 142.32 27.87 Favored 'General case' 0 C--O 1.235 0.31 0 O-C-N 122.039 -0.413 . . . . 41.52 110.372 -177.469 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -86.04 148.6 25.66 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.87 -0.604 . . . . 76.71 110.564 179.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 53.5 52.29 13.62 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.924 0.869 . . . . 48.13 111.057 177.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 104' ' ' ARG . . . . . 0.94 ' NH2' ' CG1' ' B' ' 82' ' ' VAL . 1.1 tmm_? -114.16 121.67 44.47 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 108.892 -0.781 . . . . 69.75 108.892 -179.338 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -179.03 -161.25 26.3 Favored Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 110.039 -1.224 . . . . 40.94 110.039 -179.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 106' ' ' TRP . . . . . . . . . . . . . 42.6 p-90 -160.66 159.69 30.66 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 119.358 -0.937 . . . . 46.28 110.149 177.046 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 107' ' ' LYS . . . . . . . . . . . . . 98.0 mttt -126.91 141.48 51.8 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 114.998 -1.001 . . . . 51.89 108.461 175.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 17.6 ttmt -139.92 119.44 13.11 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 108.921 -0.77 . . . . 48.12 108.921 -173.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 109' ' ' TRP . . . . . . . . . . . . . 25.4 p90 -147.37 -179.21 6.69 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 121.508 0.67 . . . . 50.83 109.682 -178.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 110' ' ' ILE . . . . . . . . . . . . . 13.5 mm -122.63 139.78 48.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 N-CA-C 108.75 -0.833 . . . . 60.24 108.75 -178.053 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 111' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -128.5 53.12 1.85 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.815 0.817 . . . . 70.69 109.997 174.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 112' ' ' GLY . . . . . . . . . . . . . . . 78.41 89.22 0.4 Allowed Glycine 0 N--CA 1.45 -0.419 0 O-C-N 121.867 -0.521 . . . . 70.6 113.49 -179.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . . . 61.17 4.91 0.95 Allowed 'General case' 0 C--O 1.235 0.332 0 C-N-CA 123.786 0.835 . . . . 67.7 112.893 175.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 114' ' ' LYS . . . . . 0.478 ' NZ ' ' OE1' ' D' ' 11' ' ' GLU . 31.4 mttt -127.59 125.24 39.91 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 108.574 -0.899 . . . . 60.09 108.574 178.233 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 6.1 tt -94.15 139.1 31.43 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.322 -0.622 . . . . 59.58 109.322 178.608 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 116' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -121.67 127.96 51.35 Favored 'General case' 0 C--O 1.239 0.523 0 N-CA-C 108.721 -0.844 . . . . 55.69 108.721 -177.905 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 117' ' ' LEU . . . . . . . . . . . . . 56.4 tp -126.05 118.4 25.22 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.902 -0.777 . . . . 44.74 108.902 -177.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -110.99 99.64 8.48 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.115 -1.068 . . . . 54.96 108.115 -179.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 119' ' ' LEU . . . . . . . . . . . . . 7.2 mt -84.86 143.16 29.22 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 109.549 -0.537 . . . . 41.07 109.549 173.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 120' ' ' THR . . . . . . . . . . . . . 9.0 t -138.36 141.12 39.68 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-O 120.968 0.413 . . . . 47.61 110.259 -178.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 121' ' ' CYS . . . . . . . . . . . . . 49.9 t -154.78 118.32 4.55 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 108.05 -1.092 . . . . 46.15 108.05 175.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . 63.41 -127.18 36.96 Favored Glycine 0 C--O 1.237 0.299 0 N-CA-C 110.406 -1.078 . . . . 46.53 110.406 -176.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 123' ' ' ASP . . . . . . . . . . . . . 43.8 p30 -97.56 8.51 44.5 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 112.304 0.483 . . . . 59.96 112.304 174.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 124' ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 -99.94 129.16 45.98 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 109.859 -0.423 . . . . 47.24 109.859 -177.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 61.2 t -122.29 136.7 58.28 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 N-CA-C 108.457 -0.942 . . . . 49.69 108.457 179.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 126' ' ' CYS . . . . . . . . . . . . . 7.2 t -127.49 127.2 43.62 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.319 -0.993 . . . . 42.21 108.319 177.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 1.1 ttt-85 -117.12 136.56 52.92 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 110.046 -0.353 . . . . 67.28 110.046 179.349 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 128' ' ' GLN . . . . . . . . . . . . . 64.1 mt-30 -128.18 133.56 48.92 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 124.115 0.966 . . . . 45.09 108.601 -173.61 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 129' ' ' VAL . . . . . . . . . . . . . 5.4 m -108.36 146.15 14.53 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 N-CA-C 107.915 -1.142 . . . . 44.82 107.915 171.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 130' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -135.0 122.4 21.79 Favored 'General case' 0 C--O 1.237 0.42 0 N-CA-C 108.489 -0.93 . . . . 53.39 108.489 -178.701 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 131' ' ' LYS . . . . . . . . . . . . . 49.6 mttt -83.35 145.34 29.09 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.306 0.574 . . . . 52.5 109.524 166.513 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 68.7 tttt -88.14 153.66 21.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.804 -0.634 . . . . 63.79 110.356 179.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 23.2 pttt . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 115.66 -0.7 . . . . 70.81 110.881 177.306 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 1' ' ' THR . . . . . . . . . . . . . 1.4 t . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.811 0.338 . . . . 43.52 111.242 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 2' ' ' ARG . . . . . 0.459 ' NH2' ' O ' ' A' ' 90' ' ' GLY . 96.2 mtt180 -95.18 -6.72 41.05 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 113.189 0.811 . . . . 44.0 113.189 178.782 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . 50.7 t0 -78.06 105.34 9.21 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 109.082 -0.711 . . . . 52.32 109.082 -179.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -106.65 18.14 22.3 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 122.83 0.452 . . . . 37.67 112.184 179.013 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 5' ' ' ASN . . . . . . . . . . . . . 10.0 m-80 -63.15 148.48 47.88 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.49 0.662 . . . . 43.31 110.856 -178.834 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 6' ' ' GLY . . . . . . . . . . . . . . . 124.99 -178.68 16.43 Favored Glycine 0 N--CA 1.448 -0.532 0 CA-C-O 122.372 0.985 . . . . 39.43 112.353 167.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 7' ' ' THR . . . . . . . . . . . . . 52.8 m -104.43 120.14 40.56 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 114.215 -0.992 . . . . 36.16 108.928 -179.177 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 8' ' ' TRP . . . . . . . . . . . . . 30.8 m95 -114.24 149.6 35.6 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 123.011 0.525 . . . . 36.16 110.258 -177.049 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 9' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -127.2 131.99 50.54 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 108.952 -0.758 . . . . 60.31 108.952 177.239 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 10' ' ' MET . . . . . . . . . . . . . 36.9 ttm -71.73 131.67 43.45 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.112 -0.494 . . . . 32.06 110.742 -175.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 11' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -118.22 -5.27 10.9 Favored 'General case' 0 C--O 1.237 0.442 0 N-CA-C 113.528 0.936 . . . . 43.79 113.528 175.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 12' ' ' SER . . . . . . . . . . . . . 11.4 p -152.07 143.69 23.54 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 108.594 -0.891 . . . . 38.93 108.594 176.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 13' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -156.18 95.55 1.61 Allowed 'General case' 0 C--O 1.234 0.28 0 N-CA-C 107.419 -1.326 . . . . 35.13 107.419 -177.409 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -111.18 145.21 39.07 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 123.641 0.588 . . . . 40.47 110.333 -176.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 15' ' ' ASN . . . . . . . . . . . . . 49.9 t30 56.62 29.44 15.64 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 123.63 0.772 . . . . 35.39 112.032 -178.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 16' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -64.95 -33.68 76.61 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 119.795 -0.762 . . . . 47.02 110.853 169.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 pm0 -69.45 -31.42 69.73 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 112.056 0.391 . . . . 78.54 112.056 -177.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 18' ' ' GLY . . . . . . . . . . . . . . . -75.56 -51.17 7.45 Favored Glycine 0 C--N 1.333 0.378 0 C-N-CA 121.206 -0.521 . . . . 36.22 112.244 178.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 19' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -54.15 -31.22 51.91 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.77 -0.372 . . . . 35.65 111.308 172.03 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 20' ' ' MET . . . . . . . . . . . . . 55.5 mtm -79.68 -26.51 40.96 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.016 -0.673 . . . . 37.02 112.134 175.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . 38.0 mttp -68.84 -31.82 71.06 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.048 -0.661 . . . . 57.0 111.217 173.24 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.5 -36.64 81.45 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.301 -0.56 . . . . 32.35 111.524 179.579 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 23' ' ' LEU . . . . . . . . . . . . . 92.2 mt -88.93 4.25 48.65 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 113.201 0.815 . . . . 32.23 113.201 -177.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 61.13 40.88 14.34 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 123.127 0.571 . . . . 39.28 111.912 174.159 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 25' ' ' ILE . . . . . . . . . . . . . 2.8 mp -74.85 149.58 7.25 Favored 'Isoleucine or valine' 0 C--O 1.239 0.541 0 CA-C-O 121.491 0.663 . . . . 36.02 109.63 178.425 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 26' ' ' ASP . . . . . 0.475 ' OD1' ' N ' ' C' ' 27' ' ' PHE . 2.1 t0 -48.09 146.68 2.48 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.485 -0.78 . . . . 39.83 111.01 -179.024 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 27' ' ' PHE . . . . . 0.475 ' N ' ' OD1' ' C' ' 26' ' ' ASP . 82.9 t80 -57.75 -59.52 5.1 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 114.975 -1.011 . . . . 31.92 111.438 -173.949 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 28' ' ' CYS . . . . . . . . . . . . . 10.0 m -63.63 -31.14 72.22 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.416 -0.514 . . . . 35.32 111.766 -176.984 -83.628 -42.235 -74.152 103.615 2.032 103.967 -48.497 -83.347 1 1 . 1 . 001 ecloud orig full ' C' C ' 29' ' ' THR . . . . . . . . . . . . . 23.2 m -64.14 -34.81 78.92 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.282 -0.567 . . . . 36.33 111.188 174.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 30' ' ' ARG . . . . . . . . . . . . . 41.9 mtm-85 -70.46 -40.69 73.54 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.323 -0.551 . . . . 46.76 111.148 174.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -67.93 -34.73 77.17 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.455 -0.498 . . . . 38.83 111.896 -176.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 15.2 tt -88.38 -23.47 6.39 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 N-CA-C 112.444 0.535 . . . . 45.89 112.444 177.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.85 4.67 3.12 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 112.871 0.693 . . . . 66.92 112.871 178.598 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 34' ' ' VAL . . . . . . . . . . . . . 3.6 p -101.32 1.46 10.51 Favored 'Isoleucine or valine' 0 C--O 1.238 0.496 0 CA-C-N 118.635 0.652 . . . . 73.39 112.157 175.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 35' ' ' ARG . . . . . . . . . . . . . 2.2 mtt180 -135.4 25.91 3.47 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 112.968 0.729 . . . . 66.13 112.968 -177.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 2.9 mp -111.73 166.11 11.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 119.004 0.82 . . . . 59.7 110.941 -174.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 37' ' ' THR . . . . . . . . . . . . . 3.0 m -103.18 133.78 47.7 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 115.086 -0.961 . . . . 48.66 109.703 -177.497 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 38' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -121.3 127.53 51.43 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 110.233 -0.284 . . . . 55.8 110.233 -176.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 58.2 m -119.63 126.94 52.37 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.099 -0.704 . . . . 42.83 109.099 176.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 40' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -120.22 109.62 15.62 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 109.165 -0.68 . . . . 45.85 109.165 -176.811 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 41' ' ' VAL . . . . . . . . . . . . . 98.2 t -95.96 121.36 46.42 Favored 'Isoleucine or valine' 0 C--O 1.238 0.493 0 N-CA-C 107.819 -1.178 . . . . 40.17 107.819 175.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 42' ' ' ILE . . . . . . . . . . . . . 52.0 mt -116.37 118.25 58.16 Favored 'Isoleucine or valine' 0 C--O 1.24 0.556 0 N-CA-C 108.388 -0.967 . . . . 42.89 108.388 -176.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 43' ' ' ASP . . . . . . . . . . . . . 32.9 t0 -107.36 104.33 13.9 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 107.681 -1.229 . . . . 62.49 107.681 177.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 44' ' ' GLN . . . . . . . . . . . . . 55.0 tt0 -113.03 136.1 53.06 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.78 0.324 . . . . 48.03 110.756 -174.076 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 45' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -134.52 94.32 3.18 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 106.993 -1.484 . . . . 83.4 106.993 175.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 46' ' ' GLY . . . . . . . . . . . . . . . 62.87 -87.58 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 116.319 -0.4 . . . . 49.08 112.836 -178.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 47' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -120.24 -10.96 9.27 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 113.415 0.894 . . . . 55.48 113.415 176.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 48' ' ' ASN . . . . . . . . . . . . . 25.2 m-20 -80.95 129.15 34.39 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 118.728 0.695 . . . . 54.01 109.719 176.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 49' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -121.09 130.54 53.8 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 109.892 -0.41 . . . . 45.36 109.892 -177.407 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 50' ' ' LYS . . . . . . . . . . . . . 3.5 mtmt -121.12 98.32 5.93 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 106.371 -1.715 . . . . 47.79 106.371 173.111 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 51' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -102.94 133.13 48.56 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 123.169 0.588 . . . . 49.1 109.681 -174.753 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 52' ' ' LYS . . . . . . . . . . . . . 8.9 mttp -133.53 115.09 14.32 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 108.667 -0.864 . . . . 61.98 108.667 178.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 54.5 m -117.06 127.8 54.52 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.639 -0.504 . . . . 47.57 109.639 -177.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 54' ' ' THR . . . . . . . . . . . . . 13.8 m -119.41 123.85 45.11 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 109.139 -0.689 . . . . 54.13 109.139 -179.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 55' ' ' SER . . . . . . . . . . . . . 3.7 p -95.8 142.02 28.56 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 108.914 -0.773 . . . . 49.76 108.914 170.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 56' ' ' THR . . . . . . . . . . . . . 75.3 m -143.53 129.96 20.01 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.961 -0.563 . . . . 36.91 109.984 -163.631 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 57' ' ' PHE . . . . . 0.414 ' N ' ' O ' ' A' ' 55' ' ' SER . 92.8 t80 -98.55 127.1 44.35 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 109.373 -0.602 . . . . 40.06 109.373 176.63 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 58' ' ' ARG . . . . . . . . . . . . . 1.1 mtp-105 -90.24 104.13 16.74 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 108.385 -0.969 . . . . 70.72 108.385 -179.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 59' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -74.64 -55.84 5.46 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.366 -0.534 . . . . 43.2 110.889 178.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 60' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -164.7 142.64 6.56 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 109.653 -0.499 . . . . 60.96 109.653 178.037 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 61' ' ' ASP . . . . . . . . . . . . . 60.3 t0 -140.45 113.07 8.05 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 107.166 -1.42 . . . . 46.35 107.166 175.124 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 62' ' ' VAL . . . . . . . . . . . . . 8.1 p -142.01 147.91 21.08 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 CA-C-O 121.397 0.617 . . . . 41.21 109.469 -173.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 63' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -126.3 138.31 53.58 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 108.788 -0.819 . . . . 47.64 108.788 171.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 64' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -154.35 173.27 16.43 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 109.097 -0.705 . . . . 33.77 109.097 -175.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 65' ' ' THR . . . . . . . . . . . . . 94.4 m -131.02 134.89 47.09 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.209 -0.905 . . . . 40.81 108.596 177.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 66' ' ' VAL . . . . . . . . . . . . . 3.4 t -67.02 137.99 23.74 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 CA-C-O 121.297 0.57 . . . . 34.5 109.924 -178.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.76 -11.59 59.14 Favored Glycine 0 N--CA 1.445 -0.704 0 N-CA-C 115.493 0.957 . . . . 37.59 115.493 178.83 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 68' ' ' VAL . . . . . . . . . . . . . 14.5 t -112.88 119.96 61.77 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 CA-C-N 118.767 1.284 . . . . 42.16 108.146 -178.608 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 69' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -78.06 151.43 33.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.367 0.603 . . . . 55.28 110.396 177.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 70' ' ' PHE . . . . . . . . . . . . . 33.3 p90 -150.4 158.29 43.98 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.699 -0.682 . . . . 39.96 109.583 -176.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 71' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -92.5 99.35 12.1 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 108.648 -0.871 . . . . 47.13 108.648 -178.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 72' ' ' GLU . . . . . . . . . . . . . 52.5 tt0 -88.41 143.98 26.66 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 123.08 0.552 . . . . 55.71 110.691 -178.351 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 73' ' ' TYR . . . . . . . . . . . . . 62.1 m-85 -123.3 108.55 12.88 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 107.466 -1.309 . . . . 49.09 107.466 175.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 74' ' ' THR . . . . . . . . . . . . . 70.4 p -84.7 53.06 2.56 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 113.288 0.848 . . . . 45.98 113.288 -165.47 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 75' ' ' LYS . . . . . . . . . . . . . 26.5 mttt -66.31 158.41 29.16 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 119.872 -0.731 . . . . 58.22 109.453 166.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 76' ' ' SER . . . . . . . . . . . . . 52.2 p 72.89 -7.29 1.49 Allowed 'General case' 0 C--N 1.333 -0.134 0 C-N-CA 127.575 2.35 . . . . 50.66 111.124 -165.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 77' ' ' LEU . . . . . . . . . . . . . 10.0 tp -122.38 -104.33 0.38 Allowed 'General case' 0 C--O 1.236 0.355 0 CA-C-N 119.083 0.856 . . . . 48.86 110.103 173.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 78' ' ' ASP . . . . . . . . . . . . . 22.8 p-10 -105.07 -4.93 21.34 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 113.468 0.914 . . . . 40.23 113.468 -176.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 79' ' ' ASN . . . . . . . . . . . . . 6.1 t30 57.17 72.64 0.5 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 122.465 1.126 . . . . 52.5 110.892 178.104 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 80' ' ' ARG . . . . . . . . . . . . . 66.0 mtt85 -142.53 144.93 33.16 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 114.19 -1.368 . . . . 44.93 109.225 179.578 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 81' ' ' HIS . . . . . . . . . . . . . 11.4 t-80 -86.9 129.5 34.85 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.305 -0.628 . . . . 48.18 109.305 174.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 82' ' ' VAL . . . . . . . . . . . . . 3.9 m -139.48 145.4 27.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 N-CA-C 108.71 -0.848 . . . . 40.93 108.71 179.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 83' ' ' LYS . . . . . . . . . . . . . 27.8 mtmt -88.46 105.73 17.8 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 107.924 -1.139 . . . . 47.68 107.924 173.209 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 84' ' ' ALA . . . . . . . . . . . . . . . -98.02 141.81 30.51 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 122.76 0.424 . . . . 37.12 110.694 -174.352 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -140.26 124.67 17.87 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.101 -1.074 . . . . 36.28 108.101 178.074 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 86' ' ' VAL . . . . . . . . . . . . . 66.0 t -115.63 127.4 73.23 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 N-CA-C 108.523 -0.918 . . . . 29.15 108.523 -177.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 87' ' ' THR . . . . . . . . . . . . . 1.3 p -136.77 170.19 16.48 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.647 0.737 . . . . 36.95 109.347 -179.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 88' ' ' TRP . . . . . . . . . . . . . 85.5 m95 -102.92 123.12 45.95 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.256 -0.884 . . . . 37.45 109.0 175.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 89' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -109.5 95.1 5.39 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 106.093 -1.817 . . . . 38.19 106.093 169.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 90' ' ' GLY . . . . . . . . . . . . . . . 64.88 -110.36 3.44 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 110.875 -0.89 . . . . 39.76 110.875 -170.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 91' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -110.45 9.51 23.34 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 112.156 0.428 . . . . 50.48 112.156 174.157 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 92' ' ' VAL . . . . . . . . . . . . . 72.2 t -101.53 118.32 48.13 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 N-CA-C 108.485 -0.932 . . . . 36.48 108.485 -177.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 93' ' ' LEU . . . . . . . . . . . . . 15.5 tp -78.23 104.54 8.88 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.455 -0.942 . . . . 32.8 108.455 178.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 81.5 t -99.88 139.87 20.42 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 108.886 -0.783 . . . . 30.24 108.886 -176.889 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 95' ' ' CYS . . . . . . . . . . . . . 27.9 t -136.11 124.23 23.0 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 109.303 -0.628 . . . . 30.54 109.303 -179.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 96' ' ' VAL . . . . . . . . . . . . . 75.0 t -110.55 127.31 67.65 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 N-CA-C 108.16 -1.052 . . . . 26.17 108.16 177.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 97' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 -115.67 99.1 7.09 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 108.047 -1.094 . . . . 40.49 108.047 -179.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 98' ' ' LYS . . . . . . . . . . . . . 4.1 mmtt -82.96 129.28 35.01 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.502 -0.317 . . . . 68.76 110.3 -178.17 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 99' ' ' GLY . . . . . . . . . . . . . . . -176.49 -143.71 4.88 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.685 -0.769 . . . . 32.05 113.553 -179.875 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 100' ' ' GLU . . . . . . . . . . . . . 58.5 tt0 -64.5 -50.11 68.7 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.605 -0.438 . . . . 56.4 111.181 -179.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 101' ' ' LYS . . . . . 0.497 ' NZ ' ' OD2' ' A' ' 24' ' ' ASP . 12.9 mmtm -82.97 139.35 33.38 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.095 0.474 . . . . 43.58 110.597 -179.989 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -92.03 150.32 21.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.784 -0.644 . . . . 62.43 110.634 -177.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 103' ' ' ASN . . . . . 0.423 ' ND2' ' O ' ' C' ' 103' ' ' ASN . 1.2 t30 56.62 49.36 14.74 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.379 -0.828 . . . . 53.43 111.015 -177.951 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 104' ' ' ARG . . . . . . . . . . . . . 62.1 ttt180 -102.83 122.93 45.51 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 108.832 -0.803 . . . . 30.49 108.832 178.944 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 105' ' ' GLY . . . . . . . . . . . . . . . 173.85 -164.65 36.16 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.188 -1.005 . . . . 33.25 110.721 179.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 106' ' ' TRP . . . . . . . . . . . . . 35.5 p-90 -160.55 163.36 32.83 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 119.683 -0.807 . . . . 39.29 110.032 178.298 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 107' ' ' LYS . . . . . . . . . . . . . 97.5 mttt -130.56 125.12 33.39 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.125 -0.943 . . . . 37.6 109.067 177.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 108' ' ' LYS . . . . . . . . . . . . . 27.2 ttmt -123.86 118.67 27.63 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 109.181 -0.674 . . . . 36.4 109.181 -175.542 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 109' ' ' TRP . . . . . 0.41 ' NE1' ' OE2' ' C' ' 111' ' ' GLU . 29.0 p90 -143.83 158.67 43.53 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.378 0.609 . . . . 35.18 109.693 179.03 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 110' ' ' ILE . . . . . . . . . . . . . 12.7 mm -108.91 139.42 31.63 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 N-CA-C 108.914 -0.773 . . . . 39.69 108.914 -177.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 111' ' ' GLU . . . . . 0.41 ' OE2' ' NE1' ' C' ' 109' ' ' TRP . 73.4 mt-10 -129.22 110.32 11.87 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 108.009 -1.108 . . . . 52.18 108.009 174.759 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 112' ' ' GLY . . . . . . . . . . . . . . . 58.1 -93.08 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.41 0 CA-C-N 116.372 -0.376 . . . . 62.15 112.497 -177.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 113' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -105.93 -35.01 7.43 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 113.026 0.75 . . . . 67.51 113.026 175.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 114' ' ' LYS . . . . . 0.553 ' NZ ' ' OE1' ' A' ' 11' ' ' GLU . 75.7 mttt -81.13 150.06 28.89 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.781 0.8 . . . . 50.61 112.285 -167.805 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 115' ' ' LEU . . . . . . . . . . . . . 8.4 tt -101.77 127.3 48.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 114.864 -1.062 . . . . 29.0 108.651 171.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 116' ' ' TYR . . . . . 0.628 ' OH ' ' OD2' ' D' ' 63' ' ' ASP . 85.7 m-85 -115.45 131.13 57.03 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 108.826 -0.805 . . . . 53.46 108.826 178.671 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 117' ' ' LEU . . . . . . . . . . . . . 12.2 tp -136.55 124.44 22.69 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 109.398 -0.593 . . . . 38.57 109.398 177.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 118' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -107.4 101.48 10.84 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 107.854 -1.165 . . . . 53.14 107.854 176.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 119' ' ' LEU . . . . . . . . . . . . . 3.1 mt -78.7 147.41 33.48 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.284 -0.635 . . . . 36.42 109.284 167.401 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 120' ' ' THR . . . . . . . . . . . . . 6.4 m -148.66 134.63 19.09 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 120.025 -0.67 . . . . 43.9 110.207 -177.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 121' ' ' CYS . . . . . . . . . . . . . 43.2 t -140.98 119.44 12.27 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 108.17 -1.048 . . . . 32.6 108.17 175.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 122' ' ' GLY . . . . . . . . . . . . . . . 61.52 -114.01 6.29 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 121.508 -0.377 . . . . 50.84 112.755 -178.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 123' ' ' ASP . . . . . . . . . . . . . 21.4 p-10 -106.73 8.38 30.92 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 112.374 0.509 . . . . 35.79 112.374 176.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 124' ' ' GLN . . . . . . . . . . . . . 86.7 mm-40 -103.56 126.35 50.65 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 109.858 -0.423 . . . . 30.96 109.858 -178.381 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 125' ' ' VAL . . . . . . . . . . . . . 39.6 t -119.77 125.13 74.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.439 0 N-CA-C 108.051 -1.092 . . . . 34.09 108.051 -178.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 126' ' ' CYS . . . . . . . . . . . . . 24.3 t -113.21 124.17 51.91 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 108.514 -0.921 . . . . 32.06 108.514 176.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 127' ' ' ARG . . . . . . . . . . . . . 65.0 ttt-85 -111.1 125.81 54.16 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.473 -0.566 . . . . 54.87 109.473 -178.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 128' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -124.85 136.29 53.67 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 120.951 0.405 . . . . 33.8 110.411 -177.602 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 129' ' ' VAL . . . . . 0.413 ' O ' ' N ' ' A' ' 11' ' ' GLU . 21.7 t -118.12 133.41 65.01 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 N-CA-C 108.337 -0.986 . . . . 31.85 108.337 -179.51 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 130' ' ' PHE . . . . . . . . . . . . . 85.6 m-85 -127.78 147.38 50.42 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 123.52 0.728 . . . . 31.61 109.71 -176.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 131' ' ' LYS . . . . . . . . . . . . . 25.4 tptp -114.8 134.6 54.99 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.494 -0.776 . . . . 53.06 109.098 177.117 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 132' ' ' LYS . . . . . . . . . . . . . 76.1 tttt -71.04 139.5 50.47 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.209 0.528 . . . . 47.16 110.803 -178.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 133' ' ' LYS . . . . . . . . . . . . . 18.2 mtpt . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 115.905 -0.588 . . . . 68.81 110.729 177.024 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 1' ' ' THR . . . . . . . . . . . . . 1.3 t . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.894 0.378 . . . . 48.63 110.945 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 2' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -101.22 -3.75 28.44 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 113.119 0.785 . . . . 57.96 113.119 -177.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 3' ' ' ASP . . . . . . . . . . . . . 50.5 t0 -83.56 104.6 13.81 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 108.596 -0.89 . . . . 63.53 108.596 -179.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -107.02 14.24 26.62 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 112.666 0.617 . . . . 60.83 112.666 -179.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 5' ' ' ASN . . . . . 0.499 ' OD1' ' N ' ' D' ' 44' ' ' GLN . 48.4 m-80 -64.79 149.52 49.19 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.547 0.689 . . . . 65.53 111.297 -175.884 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 6' ' ' GLY . . . . . . . . . . . . . . . 125.14 -166.68 17.75 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.469 -0.872 . . . . 60.14 112.454 167.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 7' ' ' THR . . . . . . . . . . . . . 91.2 m -112.36 125.83 54.62 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 123.774 0.83 . . . . 54.18 109.506 -176.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 8' ' ' TRP . . . . . . . . . . . . . 76.6 m95 -121.71 136.51 54.94 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 123.598 0.759 . . . . 56.8 109.93 -175.125 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 9' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -113.27 133.84 54.9 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 109.213 -0.662 . . . . 63.16 109.213 177.417 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 10' ' ' MET . . . . . . . . . . . . . 56.8 ttm -70.0 139.07 52.7 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.203 0.525 . . . . 45.92 111.223 -172.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 11' ' ' GLU . . . . . 0.478 ' OE1' ' NZ ' ' B' ' 114' ' ' LYS . 6.5 tt0 -107.67 -48.87 3.33 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.838 -0.619 . . . . 45.07 112.572 176.544 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 12' ' ' SER . . . . . . . . . . . . . 5.8 p -135.95 166.51 23.16 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.716 0.769 . . . . 40.94 109.22 175.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 13' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -159.19 102.14 1.59 Allowed 'General case' 0 C--O 1.234 0.245 0 N-CA-C 106.683 -1.599 . . . . 46.68 106.683 -172.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 14' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -106.85 130.89 54.46 Favored 'General case' 0 C--O 1.236 0.348 0 O-C-N 123.593 0.558 . . . . 59.64 110.182 -172.016 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 15' ' ' ASN . . . . . . . . . . . . . 61.9 t30 58.25 49.19 11.52 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.661 0.743 . . . . 36.54 111.518 178.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 16' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -76.25 -38.01 56.86 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 120.2 -0.6 . . . . 42.3 111.32 172.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 17' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -65.8 -33.78 76.65 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.782 -0.367 . . . . 62.84 111.784 179.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 18' ' ' GLY . . . . . . . . . . . . . . . -67.81 -42.99 85.43 Favored Glycine 0 C--N 1.334 0.436 0 C-N-CA 119.945 -1.121 . . . . 41.85 112.558 174.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 19' ' ' TYR . . . . . . . . . . . . . 82.9 t80 -65.02 -41.42 95.3 Favored 'General case' 0 C--O 1.238 0.46 0 O-C-N 122.344 -0.504 . . . . 38.04 111.344 -179.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 20' ' ' MET . . . . . . . . . . . . . 32.2 mtm -78.88 -33.01 46.09 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 119.414 -0.914 . . . . 69.98 112.012 -177.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 21' ' ' LYS . . . . . . . . . . . . . 21.6 ttmt -66.89 -29.84 69.84 Favored 'General case' 0 C--O 1.236 0.342 0 C-N-CA 118.868 -1.133 . . . . 52.72 111.266 172.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.32 -27.16 68.84 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.009 -0.677 . . . . 34.46 111.218 171.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 23' ' ' LEU . . . . . . . . . . . . . 95.8 mt -89.34 9.68 25.18 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 112.6 0.593 . . . . 33.34 112.6 175.305 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 24' ' ' ASP . . . . . 0.45 ' OD2' ' NZ ' ' B' ' 101' ' ' LYS . 12.2 m-20 60.25 28.3 17.89 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 123.559 0.743 . . . . 40.75 111.956 -179.78 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 25' ' ' ILE . . . . . . . . . . . . . 3.5 mt -70.79 134.01 30.81 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 N-CA-C 109.019 -0.734 . . . . 41.23 109.019 176.092 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 26' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -60.71 164.0 5.06 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.839 0.828 . . . . 47.51 110.791 -176.166 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 27' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -64.03 -50.89 66.68 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.314 -0.857 . . . . 57.01 111.7 -171.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 28' ' ' CYS . . . . . . . . . . . . . 64.0 m -57.89 -42.13 84.0 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 120.625 -0.43 . . . . 47.67 111.535 -173.039 -73.237 -54.445 -70.379 104.247 2.032 104.387 -45.32 -82.235 1 1 . 1 . 001 ecloud orig full ' D' D ' 29' ' ' THR . . . . . . . . . . . . . 8.6 m -60.61 -33.39 72.67 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.413 -0.515 . . . . 42.94 111.381 175.26 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 30' ' ' ARG . . . . . . . . . . . . . 72.2 mtm-85 -71.79 -44.21 64.37 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.262 -0.575 . . . . 49.31 111.349 178.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 27.0 tttm -68.11 -35.83 78.76 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.948 -0.301 . . . . 54.74 111.35 -177.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 32' ' ' ILE . . . . . . . . . . . . . 5.6 mt -86.66 -42.18 15.4 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 O-C-N 122.045 -0.409 . . . . 45.75 111.76 -175.996 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -63.36 -22.86 67.14 Favored 'General case' 0 C--O 1.236 0.352 0 O-C-N 121.645 -0.66 . . . . 52.02 112.56 -178.219 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 34' ' ' VAL . . . . . . . . . . . . . 3.4 p -80.29 -14.96 12.99 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 N-CA-C 112.151 0.426 . . . . 55.1 112.151 179.324 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 35' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -81.77 -29.52 32.76 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 112.314 0.487 . . . . 65.83 112.314 -177.313 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 2.3 mt -94.82 147.71 23.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.398 0.618 . . . . 56.6 111.057 -173.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 37' ' ' THR . . . . . . . . . . . . . 4.6 t -88.47 142.28 27.84 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.546 -0.752 . . . . 56.82 109.72 176.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 38' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -101.54 146.33 27.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.462 0.648 . . . . 45.89 111.01 -173.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 39' ' ' THR . . . . . . . . . . . . . 95.6 m -115.96 99.63 7.41 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 107.693 -1.225 . . . . 43.0 107.693 179.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 40' ' ' LYS . . . . . . . . . . . . . 7.6 tppt? -76.54 143.89 40.07 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.946 -0.57 . . . . 58.09 109.729 173.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 41' ' ' VAL . . . . . . . . . . . . . 55.3 t -139.11 117.57 12.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 N-CA-C 107.635 -1.246 . . . . 55.44 107.635 179.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 42' ' ' ILE . . . . . . . . . . . . . 2.9 mp -117.04 121.22 67.29 Favored 'Isoleucine or valine' 0 C--O 1.241 0.606 0 N-CA-C 108.886 -0.783 . . . . 59.94 108.886 -174.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 43' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -111.03 100.97 9.56 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 106.714 -1.588 . . . . 65.79 106.714 170.606 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 44' ' ' GLN . . . . . 0.499 ' N ' ' OD1' ' D' ' 5' ' ' ASN . 41.8 tt0 -111.83 135.42 52.46 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 122.694 0.397 . . . . 57.46 110.54 -173.684 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 45' ' ' ASP . . . . . 0.424 ' O ' ' N ' ' D' ' 47' ' ' ASP . 39.6 t0 -116.31 74.12 0.89 Allowed 'General case' 0 C--O 1.235 0.312 0 N-CA-C 108.236 -1.024 . . . . 76.24 108.236 175.519 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 46' ' ' GLY . . . . . . . . . . . . . . . 65.41 -65.2 0.1 Allowed Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 121.203 -0.522 . . . . 59.11 112.891 -177.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 47' ' ' ASP . . . . . 0.424 ' N ' ' O ' ' D' ' 45' ' ' ASP . 38.2 m-20 -130.09 -23.17 2.77 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 114.189 1.181 . . . . 74.99 114.189 178.611 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 48' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -81.7 127.83 33.33 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 119.382 0.992 . . . . 67.97 109.376 172.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 49' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -113.79 156.31 24.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.673 0.749 . . . . 57.74 111.067 -173.954 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 50' ' ' LYS . . . . . . . . . . . . . 21.3 mttt -140.56 98.64 3.46 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 106.692 -1.595 . . . . 59.99 106.692 173.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 51' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -103.34 134.02 47.43 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 122.82 0.448 . . . . 54.27 109.831 -175.241 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 52' ' ' LYS . . . . . . . . . . . . . 32.3 tttp -147.12 112.03 5.4 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 108.966 -0.753 . . . . 57.36 108.966 -179.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 53' ' ' THR . . . . . . . . . . . . . 32.9 m -103.23 130.2 50.4 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.427 -0.583 . . . . 47.92 109.427 177.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 54' ' ' THR . . . . . . . . . . . . . 4.7 m -124.04 139.56 53.82 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 122.374 0.27 . . . . 61.48 110.334 -178.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 55' ' ' SER . . . . . . . . . . . . . 1.9 t -133.39 137.67 45.93 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 109.341 -0.614 . . . . 56.77 109.341 176.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 56' ' ' THR . . . . . . . . . . . . . 97.9 m -103.43 121.02 41.94 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 109.288 -0.634 . . . . 58.63 109.288 -178.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 57' ' ' PHE . . . . . . . . . . . . . 30.4 t80 -72.4 -76.81 0.11 Allowed 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.357 -0.383 . . . . 62.15 110.564 178.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 58' ' ' ARG . . . . . . . . . . . . . 48.2 mtt180 -139.94 174.13 10.82 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 108.937 -0.764 . . . . 61.38 108.937 177.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 59' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -135.79 130.23 33.73 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 108.609 -0.886 . . . . 62.97 108.609 175.488 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 60' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -110.37 129.94 55.65 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 108.905 -0.776 . . . . 51.75 108.905 172.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 61' ' ' ASP . . . . . 0.638 ' OD2' ' NZ ' ' B' ' 52' ' ' LYS . 0.8 OUTLIER -154.42 138.41 16.37 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.398 -0.521 . . . . 63.22 109.898 177.573 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' D' D ' 62' ' ' VAL . . . . . . . . . . . . . 6.3 p -149.39 144.48 18.02 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 N-CA-C 108.259 -1.015 . . . . 44.36 108.259 -170.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 63' ' ' ASP . . . . . 0.628 ' OD2' ' OH ' ' C' ' 116' ' ' TYR . 15.4 m-20 -114.43 140.94 48.28 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.278 -0.638 . . . . 42.96 109.278 173.484 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 64' ' ' PHE . . . . . . . . . . . . . 51.5 p90 -157.44 152.13 25.36 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 120.054 -0.658 . . . . 36.67 109.808 179.155 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 65' ' ' THR . . . . . . . . . . . . . 84.0 m -109.74 128.46 55.3 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.132 -0.94 . . . . 38.14 108.51 173.766 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 66' ' ' VAL . . . . . . . . . . . . . 46.2 t -69.57 123.47 23.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 N-CA-C 109.249 -0.648 . . . . 35.18 109.249 -175.916 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 67' ' ' GLY . . . . . . . . . . . . . . . 107.53 -4.45 34.86 Favored Glycine 0 N--CA 1.448 -0.513 0 CA-C-O 119.004 -0.887 . . . . 39.9 114.89 177.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 68' ' ' VAL . . . . . . . . . . . . . 92.7 t -122.48 123.96 69.73 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 CA-C-N 118.637 1.219 . . . . 37.41 108.326 -177.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 69' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -69.04 149.77 48.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.446 0.641 . . . . 56.45 110.289 175.905 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 70' ' ' PHE . . . . . . . . . . . . . 24.8 p90 -157.27 143.05 17.58 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.873 -0.603 . . . . 31.7 109.614 -178.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 71' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -82.34 127.81 33.6 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.987 -0.551 . . . . 33.09 110.13 179.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 72' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -104.03 163.53 12.32 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.884 0.85 . . . . 43.52 110.933 -179.744 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 73' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -143.05 90.85 2.23 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 105.77 -1.937 . . . . 34.83 105.77 177.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 74' ' ' THR . . . . . . . . . . . . . 19.8 p -76.02 60.53 1.42 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 122.203 1.001 . . . . 41.56 111.735 -166.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 75' ' ' LYS . . . . . 0.539 ' NZ ' ' O ' ' D' ' 302' ' ' HOH . 69.4 mmtt -63.09 154.5 30.75 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.293 -0.867 . . . . 51.1 109.428 167.943 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 76' ' ' SER . . . . . 0.417 ' OG ' ' O ' ' D' ' 75' ' ' LYS . 60.5 p 64.92 7.28 3.87 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 125.065 1.346 . . . . 54.03 112.317 -170.743 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 77' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -125.53 -116.78 0.28 Allowed 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.101 0.56 . . . . 46.2 109.753 175.551 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 78' ' ' ASP . . . . . . . . . . . . . 20.9 p-10 -94.16 -8.52 39.18 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 112.918 0.711 . . . . 34.34 112.918 175.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 79' ' ' ASN . . . . . . . . . . . . . 34.6 t30 52.46 70.56 0.55 Allowed 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 122.784 1.278 . . . . 52.73 110.662 -177.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 80' ' ' ARG . . . . . . . . . . . . . 76.2 mtt85 -133.17 162.06 32.77 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 113.88 -1.509 . . . . 38.01 108.757 174.583 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 81' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -101.33 123.47 45.48 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.983 -0.747 . . . . 35.81 108.983 177.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 82' ' ' VAL . . . . . . . . . . . . . 18.8 m -133.58 162.16 40.04 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 N-CA-C 107.936 -1.135 . . . . 29.47 107.936 175.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 83' ' ' LYS . . . . . . . . . . . . . 25.7 mttt -110.1 112.59 24.68 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 106.981 -1.489 . . . . 48.73 106.981 171.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 84' ' ' ALA . . . . . . . . . . . . . . . -102.26 140.91 35.91 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 115.971 -0.559 . . . . 31.69 110.561 -173.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 85' ' ' LEU . . . . . . . . . . . . . 61.6 tp -132.41 129.02 38.78 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 108.137 -1.06 . . . . 35.86 108.137 173.87 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 86' ' ' VAL . . . . . . . . . . . . . 60.9 t -115.19 121.08 66.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 107.752 -1.203 . . . . 31.7 107.752 -178.894 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 87' ' ' THR . . . . . . . . . . . . . 30.7 p -129.81 161.37 30.9 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.423 0.63 . . . . 34.85 109.548 179.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 88' ' ' TRP . . . . . . . . . . . . . 76.0 m95 -92.12 126.51 37.23 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 115.37 -0.832 . . . . 38.02 109.494 175.05 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 89' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -118.11 97.31 5.74 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 106.29 -1.744 . . . . 41.91 106.29 171.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 90' ' ' GLY . . . . . . . . . . . . . . . 66.44 -126.49 27.9 Favored Glycine 0 C--O 1.235 0.209 0 N-CA-C 109.074 -1.61 . . . . 37.3 109.074 -168.672 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 91' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -99.79 17.69 20.1 Favored 'General case' 0 C--O 1.236 0.365 0 O-C-N 122.53 -0.394 . . . . 50.97 111.945 170.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 92' ' ' VAL . . . . . . . . . . . . . 62.1 t -108.39 106.13 20.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 N-CA-C 108.045 -1.095 . . . . 36.88 108.045 -175.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 93' ' ' LEU . . . . . . . . . . . . . 13.1 tp -67.1 109.07 2.88 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 123.169 0.588 . . . . 38.61 109.471 173.027 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 22.1 t -108.03 141.13 24.06 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 N-CA-C 108.667 -0.864 . . . . 34.94 108.667 -179.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 95' ' ' CYS . . . . . . . . . . . . . 1.6 t -133.37 125.03 28.27 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-N 116.354 -0.385 . . . . 30.54 110.086 -178.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 96' ' ' VAL . . . . . . . . . . . . . 2.6 t -101.2 135.43 37.64 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 C-N-CA 124.34 1.056 . . . . 39.1 108.318 175.718 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 97' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -122.98 91.79 3.56 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 107.928 -1.138 . . . . 37.49 107.928 178.527 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 98' ' ' LYS . . . . . . . . . . . . . 64.7 mttt -75.96 122.19 23.81 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.279 -0.419 . . . . 52.37 110.047 -178.409 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 99' ' ' GLY . . . . . . . . . . . . . . . -170.48 -143.25 3.88 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.545 -0.836 . . . . 38.34 114.667 -179.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 100' ' ' GLU . . . . . . . . . . . . . 56.0 tt0 -66.99 -31.55 72.19 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.777 -0.369 . . . . 46.63 111.777 -178.394 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 101' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -94.03 157.49 16.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.748 0.785 . . . . 46.46 110.738 -178.502 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -102.97 144.6 31.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.264 -0.88 . . . . 69.03 109.93 178.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 103' ' ' ASN . . . . . . . . . . . . . 29.8 m120 55.66 35.48 25.33 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.326 0.584 . . . . 68.4 111.406 -179.721 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 104' ' ' ARG . . . . . . . . . . . . . 74.4 ttt180 -89.53 129.77 35.95 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 109.603 -0.517 . . . . 42.62 109.603 178.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 105' ' ' GLY . . . . . . . . . . . . . . . 165.76 -161.42 34.95 Favored Glycine 0 N--CA 1.451 -0.358 0 N-CA-C 110.173 -1.171 . . . . 37.67 110.173 -179.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 106' ' ' TRP . . . . . . . . . . . . . 51.6 p-90 -159.1 167.6 28.8 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 119.081 -1.048 . . . . 38.92 109.906 179.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 107' ' ' LYS . . . . . . . . . . . . . 39.6 mttp -138.42 137.52 37.31 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 114.875 -1.057 . . . . 44.7 108.695 179.232 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 108' ' ' LYS . . . . . . . . . . . . . 9.7 ttmm -143.02 133.99 25.57 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 107.917 -1.142 . . . . 53.69 107.917 -171.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 109' ' ' TRP . . . . . . . . . . . . . 30.4 p90 -159.67 144.57 15.28 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 119.843 -0.743 . . . . 42.46 109.625 178.333 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 110' ' ' ILE . . . . . . . . . . . . . 24.8 mm -89.58 138.92 18.34 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 N-CA-C 109.111 -0.7 . . . . 45.0 109.111 179.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 111' ' ' GLU . . . . . . . . . . . . . 20.9 tp10 -130.18 112.73 13.67 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 107.841 -1.17 . . . . 51.39 107.841 171.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 112' ' ' GLY . . . . . . . . . . . . . . . 58.27 -96.07 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.485 0 CA-C-N 116.239 -0.437 . . . . 52.14 113.034 -178.378 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 113' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -118.09 4.2 12.04 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 113.366 0.876 . . . . 69.35 113.366 -178.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 114' ' ' LYS . . . . . . . . . . . . . 12.2 mtmm -119.21 154.33 33.55 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 118.832 0.742 . . . . 60.26 110.774 -174.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 115' ' ' LEU . . . . . . . . . . . . . 8.3 tt -107.31 110.67 22.74 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 108.037 -1.098 . . . . 44.68 108.037 178.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 116' ' ' TYR . . . . . . . . . . . . . 34.2 m-85 -91.45 126.89 36.69 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 109.388 -0.597 . . . . 59.78 109.388 177.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 117' ' ' LEU . . . . . . . . . . . . . 30.8 tp -131.15 143.25 50.48 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 109.373 -0.603 . . . . 43.59 109.373 -178.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 118' ' ' GLU . . . . . . . . . . . . . 78.8 mt-10 -140.94 110.81 6.51 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 108.217 -1.031 . . . . 43.6 108.217 179.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 119' ' ' LEU . . . . . . . . . . . . . 4.5 mt -97.24 133.8 41.4 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.111 -0.7 . . . . 41.04 109.111 178.141 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 120' ' ' THR . . . . . . . . . . . . . 72.4 p -126.74 136.07 51.93 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 120.793 0.33 . . . . 37.74 110.532 -175.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 121' ' ' CYS . . . . . . . . . . . . . 43.0 t -149.67 121.14 7.94 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 108.413 -0.958 . . . . 36.99 108.413 173.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 122' ' ' GLY . . . . . . . . . . . . . . . 64.47 -122.92 26.22 Favored Glycine 0 C--O 1.237 0.314 0 N-CA-C 110.165 -1.174 . . . . 50.71 110.165 -177.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 123' ' ' ASP . . . . . . . . . . . . . 46.6 p-10 -96.09 -5.27 41.24 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 112.813 0.671 . . . . 63.58 112.813 173.585 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 124' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -87.94 133.08 34.01 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 118.115 0.416 . . . . 42.66 110.589 -173.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 125' ' ' VAL . . . . . . . . . . . . . 94.2 t -125.59 127.14 71.38 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 N-CA-C 108.199 -1.037 . . . . 36.14 108.199 178.192 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 126' ' ' CYS . . . . . . . . . . . . . 2.5 t -114.23 127.05 55.7 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 123.524 0.729 . . . . 35.18 109.038 177.882 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 127' ' ' ARG . . . . . . . . . . . . . 63.9 mtt-85 -110.09 116.46 31.6 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 109.16 -0.681 . . . . 40.51 109.16 -176.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 128' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -116.1 141.96 47.44 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 123.524 0.73 . . . . 37.47 109.879 -179.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 129' ' ' VAL . . . . . . . . . . . . . 85.5 t -124.76 128.25 73.21 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 N-CA-C 108.231 -1.026 . . . . 42.07 108.231 178.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 130' ' ' PHE . . . . . . . . . . . . . 48.6 m-85 -117.0 153.22 33.04 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 123.162 0.585 . . . . 51.68 109.672 178.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 131' ' ' LYS . . . . . . . . . . . . . 2.2 ttpp -117.37 141.18 48.64 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.004 -0.544 . . . . 61.57 109.865 174.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 132' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -74.57 144.76 43.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.772 -0.649 . . . . 53.93 110.518 178.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 133' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 115.988 -0.551 . . . . 66.64 110.621 176.909 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 201' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 202' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 201' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 202' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 203' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 204' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 205' ' ' ACT . . . . . 0.454 ' O ' ' OH ' ' A' ' 19' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 206' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 201' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 202' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 203' ' ' RET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' B' B ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 302' ' ' HOH . . . . . 0.539 ' O ' ' NZ ' ' D' ' 75' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 8.9 t . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.8 0.333 . . . . 50.07 111.139 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 -88.53 -6.05 57.82 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 112.965 0.728 . . . . 37.41 112.965 177.429 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -82.65 115.0 21.41 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.24 -0.652 . . . . 36.44 109.24 177.383 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -114.41 14.37 17.88 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 112.712 0.634 . . . . 29.08 112.712 -178.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -62.95 153.47 33.55 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.501 0.667 . . . . 30.16 110.774 179.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 133.0 179.35 16.23 Favored Glycine 0 N--CA 1.445 -0.717 0 CA-C-O 122.274 0.93 . . . . 31.15 112.892 169.03 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 68.2 m -102.7 110.97 23.08 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 107.992 -1.114 . . . . 34.09 107.992 176.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' TRP . . . . . 0.595 ' HB3' ' HB3' ' C' ' 130' ' ' PHE . 71.5 m95 -105.66 138.94 41.02 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 122.738 0.415 . . . . 29.44 110.493 -175.014 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -119.56 135.19 54.89 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.272 -0.64 . . . . 65.19 109.272 177.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 38.0 ttm -67.44 123.57 20.77 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.011 -0.541 . . . . 27.37 110.822 -171.561 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLU . . . . . 0.513 ' OE1' ' NZ ' ' C' ' 114' ' ' LYS . 14.8 mt-10 -84.76 -55.93 3.85 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.207 -0.451 . . . . 54.64 110.882 174.316 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 55.9 p -134.74 170.13 16.29 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 121.591 0.71 . . . . 29.56 109.59 -178.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -162.35 104.31 1.11 Allowed 'General case' 0 C--O 1.233 0.22 0 N-CA-C 107.295 -1.372 . . . . 30.24 107.295 -177.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -109.24 142.33 40.24 Favored 'General case' 0 C--O 1.236 0.373 0 O-C-N 123.522 0.514 . . . . 46.49 110.408 -177.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 48.6 t30 55.65 41.54 30.41 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.629 -0.714 . . . . 30.05 111.526 178.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -72.73 -41.27 65.36 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.203 -0.599 . . . . 34.08 110.949 174.496 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 -65.86 -39.12 90.42 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.813 -0.355 . . . . 49.93 111.461 -178.056 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.69 -44.01 90.58 Favored Glycine 0 C--N 1.335 0.49 0 C-N-CA 119.978 -1.106 . . . . 36.79 112.641 178.328 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' TYR . . . . . 0.454 ' OH ' ' O ' ' C' ' 205' ' ' ACT . 56.2 t80 -62.51 -40.76 97.76 Favored 'General case' 0 C--O 1.237 0.396 0 O-C-N 122.286 -0.537 . . . . 36.64 111.186 176.951 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 41.8 mmm -69.02 -33.9 74.39 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 119.938 -0.705 . . . . 42.91 112.064 179.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.0 tttm -75.65 -28.99 58.96 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 119.808 -0.757 . . . . 62.82 110.83 179.432 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.96 -31.65 67.08 Favored 'General case' 0 CA--C 1.52 -0.21 0 O-C-N 122.166 -0.334 . . . . 36.45 111.313 170.102 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 86.9 mt -92.37 12.16 23.58 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 112.838 0.681 . . . . 37.25 112.838 177.955 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ASP . . . . . 0.431 ' OD2' ' NZ ' ' C' ' 101' ' ' LYS . 35.1 m-20 60.79 30.25 19.55 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 123.284 0.634 . . . . 40.88 112.205 177.486 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 30.7 mm -76.55 135.81 25.98 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 N-CA-C 108.918 -0.771 . . . . 35.08 108.918 175.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -67.72 173.77 4.07 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 122.132 0.968 . . . . 45.8 110.929 -172.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 79.3 t80 -75.29 -40.12 58.98 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.057 -0.974 . . . . 34.7 112.673 -166.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 10.8 m -64.96 -51.35 62.27 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 120.415 -0.514 . . . . 37.28 111.443 -172.871 -83.347 -48.497 -74.152 103.967 2.032 103.615 -42.235 -83.628 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -64.48 -27.07 68.73 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.049 -0.661 . . . . 35.7 111.395 177.363 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 11.6 mtp180 -64.63 -41.87 95.85 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.527 -0.469 . . . . 35.1 111.06 173.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.6 ttmt -73.77 -36.59 65.1 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.405 -0.518 . . . . 38.2 111.382 -178.268 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 45.7 mm -77.75 -44.09 29.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 C-N-CA 120.139 -0.624 . . . . 40.77 111.114 -176.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.53 -27.93 68.81 Favored 'General case' 0 C--O 1.236 0.385 0 O-C-N 121.881 -0.512 . . . . 29.52 112.132 -174.636 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 2.1 p -73.44 -16.77 17.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 120.412 -0.515 . . . . 33.82 111.798 -179.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 78.1 mtt180 -95.22 -7.43 39.04 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 113.309 0.855 . . . . 52.96 113.309 -179.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 49.5 mt -100.55 145.15 28.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.444 0.64 . . . . 27.66 110.867 -175.679 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 25.3 m -82.62 120.95 26.19 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 115.422 -0.808 . . . . 33.61 109.179 176.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 69.2 mt-30 -89.87 139.34 30.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.01 0.433 . . . . 35.34 110.177 -178.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' THR . . . . . 0.4 ' HA ' ' O ' ' A' ' 8' ' ' TRP . 87.2 m -123.86 112.33 17.14 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 107.147 -1.427 . . . . 38.44 107.147 178.185 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 19.3 ttmm -102.52 115.07 29.82 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 124.003 0.921 . . . . 31.44 108.801 -177.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 84.9 t -95.23 124.78 47.91 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 N-CA-C 107.733 -1.21 . . . . 33.91 107.733 176.389 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 29.6 mt -122.03 122.15 65.89 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 N-CA-C 108.711 -0.848 . . . . 30.89 108.711 -177.686 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -112.36 117.14 31.64 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 108.129 -1.063 . . . . 42.52 108.129 172.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.7 tt0 -126.04 128.16 46.98 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 110.179 -0.304 . . . . 29.94 110.179 -174.058 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 59.4 t0 -124.1 97.71 5.46 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 107.013 -1.477 . . . . 26.7 107.013 173.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 62.15 -100.54 0.3 Allowed Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 116.371 -0.377 . . . . 32.64 112.723 -177.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 95.3 m-20 -112.61 6.11 18.17 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 112.584 0.587 . . . . 40.05 112.584 178.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 27.8 m-20 -99.97 124.4 45.27 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 108.6 -0.889 . . . . 48.92 108.6 177.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -118.45 155.92 29.93 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 121.725 0.774 . . . . 40.76 111.142 -171.973 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 13.5 mttp -147.31 101.86 3.42 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 106.696 -1.594 . . . . 48.6 106.696 175.308 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -110.77 124.71 52.52 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.008 -0.738 . . . . 36.23 109.008 -175.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 12.4 tttm -133.22 102.15 5.46 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 108.393 -0.966 . . . . 53.94 108.393 178.167 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.7 m -96.01 125.95 40.91 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 109.133 -0.692 . . . . 34.44 109.133 176.843 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.6 t -128.56 165.34 20.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.472 0.654 . . . . 39.21 109.719 -175.461 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 57.9 m -144.13 130.02 19.39 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.669 -0.696 . . . . 31.45 109.535 -179.534 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 54.2 m -88.39 115.14 25.68 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 108.77 -0.826 . . . . 34.91 108.77 178.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 25.0 t80 -76.62 -72.88 0.31 Allowed 'General case' 0 C--O 1.236 0.348 0 CA-C-O 120.873 0.368 . . . . 44.99 110.671 178.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 3.2 mmt85 -140.95 151.38 44.14 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 109.549 -0.537 . . . . 53.81 109.549 179.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 -118.05 139.63 50.93 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 108.949 -0.76 . . . . 48.88 108.949 172.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -130.85 100.99 5.45 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 108.626 -0.879 . . . . 69.67 108.626 -177.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -103.58 125.55 50.18 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.299 -0.63 . . . . 58.31 109.299 176.452 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.9 p -131.62 135.78 58.42 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 N-CA-C 108.359 -0.978 . . . . 44.36 108.359 176.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -119.93 128.52 53.68 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 108.599 -0.889 . . . . 59.33 108.599 178.486 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 54.6 p90 -150.19 160.86 43.36 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 121.605 0.716 . . . . 39.75 110.137 -177.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 37.8 m -122.64 138.19 54.67 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 114.747 -1.115 . . . . 43.29 108.373 173.163 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' VAL . . . . . 0.514 HG11 ' CD1' ' A' ' 88' ' ' TRP . 54.9 t -61.77 130.83 26.5 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 CA-C-O 121.184 0.516 . . . . 48.72 109.957 -175.416 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.18 0.26 88.73 Favored Glycine 0 N--CA 1.446 -0.668 0 N-CA-C 115.517 0.967 . . . . 43.02 115.517 178.44 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 23.7 t -118.42 112.68 39.21 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 N-CA-C 107.595 -1.261 . . . . 48.12 107.595 -179.365 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' GLU . . . . . 0.488 ' HG2' HD13 ' A' ' 85' ' ' LEU . 20.3 mt-10 -69.45 158.39 35.24 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.767 0.794 . . . . 79.31 110.515 179.079 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 24.3 p90 -152.95 154.31 34.74 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.536 -0.756 . . . . 47.89 109.924 -178.518 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 -80.25 101.2 8.74 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 108.322 -0.992 . . . . 57.21 108.322 177.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 68.1 tt0 -103.72 120.73 41.53 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 109.455 -0.572 . . . . 44.07 109.455 -178.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 47.7 m-85 -93.7 114.31 26.58 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 107.6 -1.259 . . . . 47.48 107.6 169.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 76.5 p -73.68 55.8 0.52 Allowed 'General case' 0 C--O 1.234 0.279 0 C-N-CA 120.821 -0.351 . . . . 47.79 111.698 -174.228 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.2 ptmm? -63.26 161.98 12.88 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 109.698 -0.482 . . . . 56.0 109.698 178.314 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 54.3 m 60.54 30.16 19.55 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 117.844 0.293 . . . . 52.3 111.781 -176.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 10.1 tp -157.54 -94.3 0.03 OUTLIER 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.698 -0.482 . . . . 44.34 109.698 173.669 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 23.2 p-10 -112.04 -10.6 13.91 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 113.15 0.796 . . . . 42.84 113.15 174.909 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 30.8 t30 59.26 53.7 5.2 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.707 0.765 . . . . 39.76 111.733 173.694 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 74.4 mtt85 -110.05 153.48 24.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.734 -0.666 . . . . 35.26 109.684 174.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 16.9 t-160 -91.51 115.25 27.88 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 109.138 -0.69 . . . . 43.51 109.138 178.097 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 29.6 m -129.39 147.38 33.32 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 N-CA-C 108.641 -0.874 . . . . 35.18 108.641 178.328 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 54.7 mttm -93.85 113.42 25.45 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 107.478 -1.305 . . . . 55.4 107.478 171.386 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ALA . . . . . 0.425 ' O ' ' HA ' ' A' ' 69' ' ' GLU . . . -103.18 144.75 30.91 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 120.909 0.385 . . . . 42.37 110.797 -171.472 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' LEU . . . . . 0.488 HD13 ' HG2' ' A' ' 69' ' ' GLU . 47.0 tp -138.85 127.99 24.0 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 108.747 -0.834 . . . . 47.7 108.747 177.554 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 86' ' ' VAL . . . . . 0.474 HG22 ' HB2' ' A' ' 95' ' ' CYS . 57.5 t -113.87 129.63 69.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 N-CA-C 108.608 -0.886 . . . . 46.44 108.608 -177.99 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 73.5 p -136.01 159.58 41.25 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.564 0.697 . . . . 45.68 109.498 -178.967 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' TRP . . . . . 0.514 ' CD1' HG11 ' A' ' 66' ' ' VAL . 85.0 m95 -93.35 120.14 33.29 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.043 -0.98 . . . . 53.26 109.277 176.124 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -105.09 91.56 3.85 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 106.315 -1.735 . . . . 64.69 106.315 171.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 64.46 -92.13 0.12 Allowed Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 111.152 -0.779 . . . . 58.8 111.152 -172.699 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -125.07 2.14 7.95 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 113.011 0.745 . . . . 59.71 113.011 174.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 61.3 t -96.9 129.07 47.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 108.749 -0.834 . . . . 42.85 108.749 -178.153 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 13.5 tp -85.51 104.8 15.61 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.692 -0.855 . . . . 41.3 108.692 -179.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 48.2 t -105.34 135.69 42.4 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 N-CA-C 109.018 -0.734 . . . . 47.01 109.018 -175.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' CYS . . . . . 0.474 ' HB2' HG22 ' A' ' 86' ' ' VAL . 8.3 t -130.23 126.22 36.82 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 109.884 -0.413 . . . . 42.32 109.884 -179.286 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 62.0 t -106.43 126.6 62.14 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 N-CA-C 108.163 -1.051 . . . . 38.46 108.163 176.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -110.16 96.87 6.5 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 107.728 -1.212 . . . . 36.25 107.728 179.378 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 13.0 mmtm -82.62 123.35 29.16 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 109.717 -0.475 . . . . 56.16 109.717 -177.633 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -172.98 -138.15 2.54 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 116.354 -0.385 . . . . 38.07 112.805 179.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 79.3 tt0 -66.6 -61.76 1.81 Allowed 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.604 -0.439 . . . . 45.7 110.902 179.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -70.28 134.75 48.29 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.136 0.493 . . . . 38.31 110.358 178.303 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -96.72 162.75 13.3 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.47 0.652 . . . . 63.23 110.161 177.289 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ASN . . . . . 0.471 ' O ' HG22 ' A' ' 120' ' ' THR . 2.8 t30 52.7 46.93 25.78 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-N 115.249 -0.887 . . . . 71.84 110.29 -173.378 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 70.1 ttt180 -114.14 128.94 56.6 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.476 -0.784 . . . . 34.15 109.542 -177.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 170.81 -160.19 32.62 Favored Glycine 0 N--CA 1.45 -0.409 0 N-CA-C 109.815 -1.314 . . . . 33.26 109.815 -179.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 34.3 p-90 -158.06 156.87 31.83 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 119.449 -0.901 . . . . 37.75 109.655 175.474 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -122.79 128.43 50.44 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.137 -0.938 . . . . 45.67 108.67 175.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 32.8 ttmt -132.89 113.72 13.21 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 108.662 -0.866 . . . . 40.58 108.662 -172.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 19.5 p90 -143.04 157.86 44.14 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.429 0.633 . . . . 43.29 109.91 -178.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 19.7 mm -99.97 137.28 27.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 CA-C-N 115.416 -0.811 . . . . 50.12 108.814 179.383 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -130.63 113.4 14.15 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 108.088 -1.079 . . . . 54.92 108.088 173.257 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 60.82 -99.96 0.21 Allowed Glycine 0 N--CA 1.449 -0.467 0 CA-C-N 116.265 -0.425 . . . . 67.15 112.543 -177.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -121.75 11.37 10.44 Favored 'General case' 0 C--O 1.237 0.432 0 N-CA-C 112.416 0.524 . . . . 67.65 112.416 178.772 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -118.42 148.25 42.74 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 118.416 0.553 . . . . 53.68 110.692 -175.361 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' LEU . . . . . 0.572 ' HB3' ' HB2' ' A' ' 130' ' ' PHE . 17.2 tp -102.06 120.71 40.88 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.24 -0.891 . . . . 40.05 109.006 179.14 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -105.51 126.31 51.98 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 109.429 -0.582 . . . . 48.62 109.429 -179.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 24.6 tp -131.33 122.92 27.23 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 108.691 -0.855 . . . . 35.61 108.691 -179.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -118.72 108.86 15.4 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 108.31 -0.996 . . . . 49.41 108.31 -179.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 3.9 mt -88.17 129.93 35.19 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 108.997 -0.742 . . . . 33.58 108.997 175.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' THR . . . . . 0.471 HG22 ' O ' ' A' ' 103' ' ' ASN . 3.6 m -125.2 131.35 53.19 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 109.622 -0.51 . . . . 44.77 109.622 -171.26 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 53.9 t -150.42 113.31 4.79 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 108.091 -1.077 . . . . 38.42 108.091 176.123 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 60.78 -110.22 2.87 Favored Glycine 0 N--CA 1.45 -0.41 0 O-C-N 123.354 0.408 . . . . 37.1 113.138 -179.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 42.1 p-10 -112.44 16.93 19.7 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 112.166 0.432 . . . . 55.0 112.166 177.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -116.46 131.88 56.83 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 109.254 -0.647 . . . . 43.53 109.254 179.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 17.3 t -133.35 122.68 45.22 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 N-CA-C 108.121 -1.066 . . . . 39.17 108.121 -179.305 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -105.51 135.44 46.91 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 123.385 0.674 . . . . 32.38 109.567 177.285 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 22.8 ttp180 -108.74 131.55 54.83 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 109.68 -0.489 . . . . 40.93 109.68 -179.786 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -133.61 120.98 21.39 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 108.247 -1.02 . . . . 37.84 108.247 -179.971 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 46.0 t -111.14 133.85 55.35 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 N-CA-C 108.324 -0.991 . . . . 38.07 108.324 179.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' PHE . . . . . 0.594 ' HB3' ' HB3' ' C' ' 8' ' ' TRP . 60.8 m-85 -119.49 141.97 48.7 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 123.779 0.832 . . . . 38.43 109.815 -175.721 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 63.3 pttt -100.96 149.13 24.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.924 -0.58 . . . . 54.67 109.729 173.089 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 21.6 tttm -82.89 135.66 34.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.798 -0.637 . . . . 50.4 110.748 -176.821 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 20.3 mtmt . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 115.826 -0.625 . . . . 63.04 110.821 177.206 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 1' ' ' THR . . . . . . . . . . . . . 5.2 t . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.858 0.361 . . . . 47.84 111.405 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 86.6 mtt180 -98.38 -17.23 18.95 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 113.046 0.758 . . . . 43.49 113.046 175.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -75.1 121.32 21.86 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 109.224 -0.658 . . . . 54.93 109.224 178.388 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -119.85 20.57 12.2 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.227 -0.442 . . . . 41.97 112.0 -175.532 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 11.0 m-80 -65.3 156.12 33.07 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 121.772 0.796 . . . . 39.53 110.653 179.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . 118.94 -173.62 15.01 Favored Glycine 0 N--CA 1.449 -0.452 0 CA-C-O 122.113 0.84 . . . . 42.93 112.33 170.016 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 91.6 m -111.65 120.31 41.62 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 108.907 -0.775 . . . . 44.78 108.907 -177.46 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 8' ' ' TRP . . . . . 0.415 ' HB3' ' HB3' ' D' ' 130' ' ' PHE . 6.7 m95 -118.62 132.53 56.19 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.408 -0.59 . . . . 50.45 109.408 -176.245 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -107.3 139.28 42.01 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 110.074 -0.343 . . . . 66.26 110.074 178.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 29.2 ttm -67.62 135.89 53.56 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.916 -0.584 . . . . 48.65 111.161 -175.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' GLU . . . . . 0.488 ' OE2' ' HB2' ' D' ' 131' ' ' LYS . 20.7 mt-10 -104.45 -64.0 1.16 Allowed 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.728 -0.669 . . . . 66.93 111.864 175.595 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 86.2 p -119.28 157.14 28.66 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 121.414 0.626 . . . . 45.32 109.688 178.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 48.9 t30 -154.15 89.45 1.29 Allowed 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 107.521 -1.288 . . . . 42.83 107.521 -176.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -95.23 138.56 32.77 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.729 -0.669 . . . . 53.98 110.573 -177.5 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' ASN . . . . . . . . . . . . . 51.2 t30 58.58 33.14 22.86 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.806 -0.633 . . . . 38.56 111.982 175.265 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -68.15 -37.1 80.68 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 120.126 -0.629 . . . . 41.31 110.862 174.8 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 87.3 tt0 -69.48 -31.04 69.08 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 120.674 -0.41 . . . . 66.6 111.735 179.146 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.68 -40.52 76.63 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 119.751 -1.214 . . . . 36.47 112.209 174.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -65.64 -41.17 92.93 Favored 'General case' 0 C--O 1.236 0.39 0 O-C-N 122.355 -0.497 . . . . 36.09 111.246 177.523 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 73.2 mtm -68.61 -37.59 79.88 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.013 -0.675 . . . . 49.26 111.186 177.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 20.1 tttt -67.96 -30.44 69.73 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.518 -0.473 . . . . 49.12 111.562 178.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.32 -25.29 65.94 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.102 -0.639 . . . . 32.63 111.477 174.718 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 65.2 mt -89.77 5.67 45.01 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 112.632 0.605 . . . . 34.14 112.632 176.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 58.75 39.58 24.07 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 121.317 0.58 . . . . 38.01 111.232 -179.313 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 38.7 mm -73.4 148.99 8.35 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 CA-C-O 121.541 0.686 . . . . 40.43 109.883 -178.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -46.1 130.63 10.13 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.63 -0.714 . . . . 57.17 111.362 175.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' PHE . . . . . . . . . . . . . 58.9 t80 -54.47 -58.35 7.81 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.691 -0.686 . . . . 55.07 111.932 -172.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' CYS . . . . . . . . . . . . . 14.3 m -62.07 -30.61 71.11 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.404 -0.519 . . . . 53.29 111.622 -179.785 -82.235 -45.32 -70.379 104.387 2.032 104.247 -54.445 -73.237 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' THR . . . . . 0.494 HG23 ' HZ ' ' D' ' 57' ' ' PHE . 88.3 m -64.12 -43.41 95.36 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 120.342 -0.543 . . . . 53.69 111.118 177.308 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 30' ' ' ARG . . . . . 0.412 ' O ' HG23 ' B' ' 34' ' ' VAL . 19.6 mtm-85 -61.34 -45.96 92.22 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.089 -0.644 . . . . 45.33 110.742 172.209 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 33.9 mmtt -60.76 -32.54 71.84 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 112.136 0.421 . . . . 56.26 112.136 -175.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' ILE . . . . . . . . . . . . . 7.3 mm -84.18 -39.36 14.61 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 C-N-CA 120.447 -0.501 . . . . 47.33 111.273 176.758 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -67.32 -3.13 7.24 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 113.024 0.75 . . . . 48.05 113.024 176.367 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' VAL . . . . . 0.412 HG23 ' O ' ' B' ' 30' ' ' ARG . 44.8 t -54.93 -59.04 2.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 CA-C-N 118.605 0.639 . . . . 57.1 110.336 175.094 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 35' ' ' ARG . . . . . 0.4 ' O ' HD23 ' B' ' 36' ' ' LEU . 0.6 OUTLIER -123.26 86.25 2.55 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 107.768 -1.197 . . . . 69.79 107.768 -177.491 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 36' ' ' LEU . . . . . 0.467 HD22 ' HA ' ' B' ' 57' ' ' PHE . 5.3 mt -131.94 153.52 50.2 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 108.163 -1.051 . . . . 59.58 108.163 174.119 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 37' ' ' THR . . . . . . . . . . . . . 2.3 m -88.12 123.93 33.28 Favored 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 120.085 -0.646 . . . . 70.05 109.291 -173.938 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -109.01 130.68 55.48 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 109.868 -0.419 . . . . 57.58 109.868 -178.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 27.4 m -123.56 120.39 32.72 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 108.469 -0.937 . . . . 52.22 108.469 175.114 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' LYS . . . . . 0.547 ' HZ3' ' H12' ' D' ' 203' ' ' RET . 13.8 ttmt -114.36 100.68 8.51 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 124.289 1.036 . . . . 56.06 108.545 -172.192 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 43.1 t -91.75 119.7 39.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 N-CA-C 108.027 -1.101 . . . . 43.25 108.027 173.201 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' ILE . . . . . . . . . . . . . 54.5 mt -116.61 124.23 72.5 Favored 'Isoleucine or valine' 0 C--O 1.24 0.559 0 N-CA-C 108.446 -0.946 . . . . 39.11 108.446 -178.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -114.26 110.08 19.37 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 107.522 -1.288 . . . . 58.12 107.522 175.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -121.95 127.17 50.06 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 122.995 0.518 . . . . 40.9 110.089 -173.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -121.58 100.76 7.2 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 106.74 -1.578 . . . . 69.04 106.74 172.609 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . 63.51 -109.25 2.62 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 121.365 -0.445 . . . . 42.58 112.108 -175.546 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -103.63 -3.73 24.75 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 112.653 0.612 . . . . 49.71 112.653 175.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -83.78 116.76 22.86 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 109.338 -0.615 . . . . 59.98 109.338 177.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -112.96 140.4 47.8 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 122.86 0.464 . . . . 41.9 110.421 -176.31 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 12.6 mttp -136.66 108.69 7.17 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 107.664 -1.235 . . . . 55.59 107.664 169.521 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -115.05 123.58 49.41 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 123.505 0.722 . . . . 60.55 109.5 -172.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' LYS . . . . . 0.68 ' HG3' ' OD2' ' D' ' 61' ' ' ASP . 1.6 mptp? -118.1 123.28 45.21 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 108.389 -0.967 . . . . 60.96 108.389 178.45 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 53' ' ' THR . . . . . 0.452 ' OG1' H182 ' D' ' 203' ' ' RET . 1.3 p -125.49 114.23 18.52 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 109.151 -0.685 . . . . 61.25 109.151 -178.676 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 54' ' ' THR . . . . . . . . . . . . . 1.2 t -98.92 129.84 45.27 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 109.68 -0.489 . . . . 56.8 109.68 177.289 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 39.6 t -106.81 88.43 2.75 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 107.785 -1.191 . . . . 58.37 107.785 179.355 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 17.0 m -65.69 127.6 32.58 Favored 'General case' 0 C--O 1.243 0.712 0 CA-C-N 115.786 -0.643 . . . . 71.79 110.646 175.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' PHE . . . . . 0.467 ' HA ' HD22 ' B' ' 36' ' ' LEU . 36.7 t80 -66.06 -108.68 0.0 OUTLIER 'General case' 0 C--O 1.235 0.328 0 C-N-CA 126.034 1.734 . . . . 73.25 110.103 173.909 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 4.3 mmt85 -103.25 139.98 37.99 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.726 -0.472 . . . . 71.08 109.726 176.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' ASN . . . . . 0.443 ' HA ' ' O ' ' D' ' 53' ' ' THR . 2.4 p30 -130.26 116.29 18.17 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 107.211 -1.403 . . . . 73.93 107.211 166.866 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 60' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -112.72 101.07 9.19 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 108.899 -0.778 . . . . 57.58 108.899 -169.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -92.53 133.13 36.23 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 109.425 -0.583 . . . . 68.58 109.425 175.711 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' VAL . . . . . . . . . . . . . 2.9 p -149.32 126.66 2.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 N-CA-C 108.106 -1.072 . . . . 64.02 108.106 175.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' ASP . . . . . 0.428 ' N ' ' OD1' ' B' ' 63' ' ' ASP . 1.7 p-10 -120.65 141.4 50.4 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.213 -0.662 . . . . 75.27 109.213 179.193 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -158.99 156.32 29.18 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.445 0.64 . . . . 57.96 109.64 -174.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 65' ' ' THR . . . . . . . . . . . . . 61.8 m -107.23 117.71 34.79 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 107.651 -1.24 . . . . 64.28 107.651 169.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 2.3 p -61.36 124.36 15.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 N-CA-C 109.073 -0.714 . . . . 51.61 109.073 -176.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' GLY . . . . . 0.431 ' N ' ' O ' ' B' ' 86' ' ' VAL . . . 105.59 -3.5 39.56 Favored Glycine 0 N--CA 1.449 -0.457 0 CA-C-O 119.023 -0.876 . . . . 53.87 114.616 -174.453 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 34.6 t -120.49 120.98 64.29 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 CA-C-N 118.534 1.167 . . . . 52.41 107.947 -179.948 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -78.62 125.97 30.1 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 110.057 -0.349 . . . . 59.26 110.057 -178.067 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 27.7 p90 -128.3 150.55 50.02 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.04 -0.527 . . . . 56.94 109.756 -176.809 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 71' ' ' ASP . . . . . 0.696 ' OD1' ' N ' ' B' ' 71' ' ' ASP . 17.3 t70 -81.81 113.06 19.51 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 108.608 -0.886 . . . . 52.53 108.608 176.968 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -101.95 119.05 38.17 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 109.156 -0.683 . . . . 48.62 109.156 -179.181 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -96.94 106.06 18.31 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 107.575 -1.269 . . . . 42.4 107.575 172.101 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 69.5 p -77.23 67.14 3.14 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 122.494 1.14 . . . . 38.69 109.938 -173.411 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -60.79 152.01 28.15 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 114.872 -1.058 . . . . 54.85 109.904 173.848 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 76' ' ' SER . . . . . . . . . . . . . 52.9 m 70.35 -16.88 0.29 Allowed 'General case' 0 C--O 1.235 0.3 0 C-N-CA 123.816 0.846 . . . . 64.32 112.05 178.228 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 9.5 mt -95.02 -100.95 0.15 Allowed 'General case' 0 C--O 1.235 0.311 0 N-CA-C 110.231 -0.285 . . . . 53.56 110.231 175.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -108.52 -2.69 18.72 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 112.806 0.669 . . . . 43.24 112.806 175.953 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 79' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 55.34 66.64 1.17 Allowed 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 122.519 1.152 . . . . 50.73 110.929 177.475 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 80' ' ' ARG . . . . . 0.409 ' NH2' ' OD2' ' D' ' 24' ' ' ASP . 75.4 mtt85 -133.22 149.16 52.02 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 114.143 -1.389 . . . . 39.36 109.678 178.76 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 81' ' ' HIS . . . . . 0.589 ' H ' ' H32' ' B' ' 202' ' ' GOL . 56.3 m80 -92.38 126.02 37.28 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.601 -0.727 . . . . 47.09 109.204 173.757 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 82' ' ' VAL . . . . . 1.038 HG11 ' NH2' ' B' ' 104' ' ' ARG . 20.2 m -128.72 154.39 39.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 N-CA-C 108.969 -0.752 . . . . 50.1 108.969 177.569 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 83' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -93.35 96.89 10.23 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 106.614 -1.624 . . . . 50.05 106.614 169.454 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -98.17 129.08 44.95 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.139 -0.482 . . . . 47.86 109.887 -174.199 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -129.39 132.76 47.1 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 108.17 -1.048 . . . . 48.17 108.17 178.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 86' ' ' VAL . . . . . 0.432 HG22 ' HB2' ' B' ' 95' ' ' CYS . 43.7 t -115.51 126.31 73.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 N-CA-C 108.628 -0.879 . . . . 54.65 108.628 -176.649 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 1.6 p -118.15 157.08 27.59 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 123.707 0.803 . . . . 51.63 110.108 174.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 88' ' ' TRP . . . . . . . . . . . . . 29.7 m95 -89.55 138.35 31.53 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.722 -1.126 . . . . 52.14 109.414 167.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -133.07 80.16 1.87 Allowed 'General case' 0 C--O 1.235 0.335 0 N-CA-C 106.223 -1.769 . . . . 48.98 106.223 174.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . 58.35 -99.07 0.11 Allowed Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.824 -0.626 . . . . 54.95 112.788 -176.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -87.93 -30.7 19.88 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 112.505 0.558 . . . . 64.06 112.505 178.278 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 10.3 t -93.92 133.62 34.34 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 CA-C-N 118.049 0.386 . . . . 49.67 110.015 -167.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 18.8 tp -93.26 111.05 22.59 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 107.884 -1.154 . . . . 44.97 107.884 172.333 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 94' ' ' VAL . . . . . 0.797 HG22 ' HG2' ' B' ' 107' ' ' LYS . 5.1 t -107.14 142.38 20.04 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 N-CA-C 108.536 -0.912 . . . . 48.56 108.536 -172.284 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 95' ' ' CYS . . . . . 0.432 ' HB2' HG22 ' B' ' 86' ' ' VAL . 6.8 t -136.86 128.78 29.22 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 109.919 -0.401 . . . . 48.42 109.919 178.888 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 16.4 t -108.38 127.27 64.86 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 N-CA-C 107.985 -1.117 . . . . 41.36 107.985 175.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 97' ' ' GLN . . . . . 0.992 ' HB2' ' HD2' ' B' ' 104' ' ' ARG . 39.3 mt-30 -110.74 87.68 2.59 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 107.818 -1.178 . . . . 44.34 107.818 -179.266 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 25.1 mmtt -73.58 119.76 18.24 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 116.044 -0.526 . . . . 52.79 109.876 -178.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 99' ' ' GLY . . . . . . . . . . . . . . . -168.62 -136.98 2.15 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.516 -0.85 . . . . 39.14 114.521 -179.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 100' ' ' GLU . . . . . . . . . . . . . 32.7 tp10 -70.03 -38.98 76.01 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.756 -0.377 . . . . 35.8 111.456 -176.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 25.5 mmtt -95.34 142.32 27.87 Favored 'General case' 0 C--O 1.235 0.31 0 O-C-N 122.039 -0.413 . . . . 41.52 110.372 -177.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -86.04 148.6 25.66 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.87 -0.604 . . . . 76.71 110.564 179.215 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 53.5 52.29 13.62 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.924 0.869 . . . . 48.13 111.057 177.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 104' ' ' ARG . . . . . 1.038 ' NH2' HG11 ' B' ' 82' ' ' VAL . 1.1 tmm_? -114.16 121.67 44.47 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 108.892 -0.781 . . . . 69.75 108.892 -179.338 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -179.03 -161.25 26.3 Favored Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 110.039 -1.224 . . . . 40.94 110.039 -179.393 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 106' ' ' TRP . . . . . 0.576 ' HB3' HD23 ' B' ' 119' ' ' LEU . 42.6 p-90 -160.66 159.69 30.66 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 119.358 -0.937 . . . . 46.28 110.149 177.046 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 107' ' ' LYS . . . . . 0.797 ' HG2' HG22 ' B' ' 94' ' ' VAL . 98.0 mttt -126.91 141.48 51.8 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 114.998 -1.001 . . . . 51.89 108.461 175.439 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 17.6 ttmt -139.92 119.44 13.11 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 108.921 -0.77 . . . . 48.12 108.921 -173.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 109' ' ' TRP . . . . . . . . . . . . . 25.4 p90 -147.37 -179.21 6.69 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 121.508 0.67 . . . . 50.83 109.682 -178.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 110' ' ' ILE . . . . . . . . . . . . . 13.5 mm -122.63 139.78 48.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 N-CA-C 108.75 -0.833 . . . . 60.24 108.75 -178.053 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 111' ' ' GLU . . . . . 0.599 ' HB2' ' CE1' ' B' ' 116' ' ' TYR . 23.6 mt-10 -128.5 53.12 1.85 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.815 0.817 . . . . 70.69 109.997 174.423 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 112' ' ' GLY . . . . . . . . . . . . . . . 78.41 89.22 0.4 Allowed Glycine 0 N--CA 1.45 -0.419 0 O-C-N 121.867 -0.521 . . . . 70.6 113.49 -179.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . . . 61.17 4.91 0.95 Allowed 'General case' 0 C--O 1.235 0.332 0 C-N-CA 123.786 0.835 . . . . 67.7 112.893 175.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 31.4 mttt -127.59 125.24 39.91 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 108.574 -0.899 . . . . 60.09 108.574 178.233 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 6.1 tt -94.15 139.1 31.43 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.322 -0.622 . . . . 59.58 109.322 178.608 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 116' ' ' TYR . . . . . 0.599 ' CE1' ' HB2' ' B' ' 111' ' ' GLU . 13.5 m-85 -121.67 127.96 51.35 Favored 'General case' 0 C--O 1.239 0.523 0 N-CA-C 108.721 -0.844 . . . . 55.69 108.721 -177.905 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 117' ' ' LEU . . . . . . . . . . . . . 56.4 tp -126.05 118.4 25.22 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.902 -0.777 . . . . 44.74 108.902 -177.944 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -110.99 99.64 8.48 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.115 -1.068 . . . . 54.96 108.115 -179.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 119' ' ' LEU . . . . . 0.576 HD23 ' HB3' ' B' ' 106' ' ' TRP . 7.2 mt -84.86 143.16 29.22 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 109.549 -0.537 . . . . 41.07 109.549 173.705 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 120' ' ' THR . . . . . 0.422 ' O ' ' HA ' ' B' ' 104' ' ' ARG . 9.0 t -138.36 141.12 39.68 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-O 120.968 0.413 . . . . 47.61 110.259 -178.301 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 121' ' ' CYS . . . . . . . . . . . . . 49.9 t -154.78 118.32 4.55 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 108.05 -1.092 . . . . 46.15 108.05 175.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . 63.41 -127.18 36.96 Favored Glycine 0 C--O 1.237 0.299 0 N-CA-C 110.406 -1.078 . . . . 46.53 110.406 -176.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 123' ' ' ASP . . . . . . . . . . . . . 43.8 p30 -97.56 8.51 44.5 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 112.304 0.483 . . . . 59.96 112.304 174.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 124' ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 -99.94 129.16 45.98 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 109.859 -0.423 . . . . 47.24 109.859 -177.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 61.2 t -122.29 136.7 58.28 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 N-CA-C 108.457 -0.942 . . . . 49.69 108.457 179.007 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 126' ' ' CYS . . . . . . . . . . . . . 7.2 t -127.49 127.2 43.62 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.319 -0.993 . . . . 42.21 108.319 177.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 1.1 ttt-85 -117.12 136.56 52.92 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 110.046 -0.353 . . . . 67.28 110.046 179.349 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 128' ' ' GLN . . . . . . . . . . . . . 64.1 mt-30 -128.18 133.56 48.92 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 124.115 0.966 . . . . 45.09 108.601 -173.61 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 129' ' ' VAL . . . . . . . . . . . . . 5.4 m -108.36 146.15 14.53 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 N-CA-C 107.915 -1.142 . . . . 44.82 107.915 171.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 130' ' ' PHE . . . . . 0.712 ' HB3' ' HB3' ' D' ' 8' ' ' TRP . 75.8 m-85 -135.0 122.4 21.79 Favored 'General case' 0 C--O 1.237 0.42 0 N-CA-C 108.489 -0.93 . . . . 53.39 108.489 -178.701 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 131' ' ' LYS . . . . . 0.4 ' HE2' ' OE1' ' D' ' 11' ' ' GLU . 49.6 mttt -83.35 145.34 29.09 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.306 0.574 . . . . 52.5 109.524 166.513 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 68.7 tttt -88.14 153.66 21.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.804 -0.634 . . . . 63.79 110.356 179.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 23.2 pttt . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 115.66 -0.7 . . . . 70.81 110.881 177.306 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 1' ' ' THR . . . . . . . . . . . . . 1.4 t . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.811 0.338 . . . . 43.52 111.242 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 2' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -95.18 -6.72 41.05 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 113.189 0.811 . . . . 44.0 113.189 178.782 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . 50.7 t0 -78.06 105.34 9.21 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 109.082 -0.711 . . . . 52.32 109.082 -179.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -106.65 18.14 22.3 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 122.83 0.452 . . . . 37.67 112.184 179.013 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 5' ' ' ASN . . . . . 0.411 ' ND2' ' HB3' ' C' ' 44' ' ' GLN . 10.0 m-80 -63.15 148.48 47.88 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.49 0.662 . . . . 43.31 110.856 -178.834 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 6' ' ' GLY . . . . . . . . . . . . . . . 124.99 -178.68 16.43 Favored Glycine 0 N--CA 1.448 -0.532 0 CA-C-O 122.372 0.985 . . . . 39.43 112.353 167.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 7' ' ' THR . . . . . . . . . . . . . 52.8 m -104.43 120.14 40.56 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 114.215 -0.992 . . . . 36.16 108.928 -179.177 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 8' ' ' TRP . . . . . 0.594 ' HB3' ' HB3' ' A' ' 130' ' ' PHE . 30.8 m95 -114.24 149.6 35.6 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 123.011 0.525 . . . . 36.16 110.258 -177.049 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 9' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -127.2 131.99 50.54 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 108.952 -0.758 . . . . 60.31 108.952 177.239 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 10' ' ' MET . . . . . . . . . . . . . 36.9 ttm -71.73 131.67 43.45 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.112 -0.494 . . . . 32.06 110.742 -175.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 11' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -118.22 -5.27 10.9 Favored 'General case' 0 C--O 1.237 0.442 0 N-CA-C 113.528 0.936 . . . . 43.79 113.528 175.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 12' ' ' SER . . . . . . . . . . . . . 11.4 p -152.07 143.69 23.54 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 108.594 -0.891 . . . . 38.93 108.594 176.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 13' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -156.18 95.55 1.61 Allowed 'General case' 0 C--O 1.234 0.28 0 N-CA-C 107.419 -1.326 . . . . 35.13 107.419 -177.409 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -111.18 145.21 39.07 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 123.641 0.588 . . . . 40.47 110.333 -176.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 15' ' ' ASN . . . . . . . . . . . . . 49.9 t30 56.62 29.44 15.64 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 123.63 0.772 . . . . 35.39 112.032 -178.243 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 16' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -64.95 -33.68 76.61 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 119.795 -0.762 . . . . 47.02 110.853 169.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 pm0 -69.45 -31.42 69.73 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 112.056 0.391 . . . . 78.54 112.056 -177.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 18' ' ' GLY . . . . . . . . . . . . . . . -75.56 -51.17 7.45 Favored Glycine 0 C--N 1.333 0.378 0 C-N-CA 121.206 -0.521 . . . . 36.22 112.244 178.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 19' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -54.15 -31.22 51.91 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.77 -0.372 . . . . 35.65 111.308 172.03 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 20' ' ' MET . . . . . 0.401 ' HG2' HD13 ' C' ' 25' ' ' ILE . 55.5 mtm -79.68 -26.51 40.96 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.016 -0.673 . . . . 37.02 112.134 175.957 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . 38.0 mttp -68.84 -31.82 71.06 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.048 -0.661 . . . . 57.0 111.217 173.24 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.5 -36.64 81.45 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.301 -0.56 . . . . 32.35 111.524 179.579 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 23' ' ' LEU . . . . . . . . . . . . . 92.2 mt -88.93 4.25 48.65 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 113.201 0.815 . . . . 32.23 113.201 -177.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 61.13 40.88 14.34 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 123.127 0.571 . . . . 39.28 111.912 174.159 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 25' ' ' ILE . . . . . 0.401 HD13 ' HG2' ' C' ' 20' ' ' MET . 2.8 mp -74.85 149.58 7.25 Favored 'Isoleucine or valine' 0 C--O 1.239 0.541 0 CA-C-O 121.491 0.663 . . . . 36.02 109.63 178.425 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 26' ' ' ASP . . . . . 0.475 ' OD1' ' N ' ' C' ' 27' ' ' PHE . 2.1 t0 -48.09 146.68 2.48 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.485 -0.78 . . . . 39.83 111.01 -179.024 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 27' ' ' PHE . . . . . 0.475 ' N ' ' OD1' ' C' ' 26' ' ' ASP . 82.9 t80 -57.75 -59.52 5.1 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 114.975 -1.011 . . . . 31.92 111.438 -173.949 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 28' ' ' CYS . . . . . . . . . . . . . 10.0 m -63.63 -31.14 72.22 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.416 -0.514 . . . . 35.32 111.766 -176.984 -83.628 -42.235 -74.152 103.615 2.032 103.967 -48.497 -83.347 1 1 . 1 . 001 ecloud build full ' C' C ' 29' ' ' THR . . . . . . . . . . . . . 23.2 m -64.14 -34.81 78.92 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.282 -0.567 . . . . 36.33 111.188 174.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 30' ' ' ARG . . . . . . . . . . . . . 41.9 mtm-85 -70.46 -40.69 73.54 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.323 -0.551 . . . . 46.76 111.148 174.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -67.93 -34.73 77.17 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.455 -0.498 . . . . 38.83 111.896 -176.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 15.2 tt -88.38 -23.47 6.39 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 N-CA-C 112.444 0.535 . . . . 45.89 112.444 177.414 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.85 4.67 3.12 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 112.871 0.693 . . . . 66.92 112.871 178.598 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 34' ' ' VAL . . . . . 0.533 HG13 ' HG3' ' C' ' 35' ' ' ARG . 3.6 p -101.32 1.46 10.51 Favored 'Isoleucine or valine' 0 C--O 1.238 0.496 0 CA-C-N 118.635 0.652 . . . . 73.39 112.157 175.961 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 35' ' ' ARG . . . . . 0.533 ' HG3' HG13 ' C' ' 34' ' ' VAL . 2.2 mtt180 -135.4 25.91 3.47 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 112.968 0.729 . . . . 66.13 112.968 -177.662 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 2.9 mp -111.73 166.11 11.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 119.004 0.82 . . . . 59.7 110.941 -174.028 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 37' ' ' THR . . . . . . . . . . . . . 3.0 m -103.18 133.78 47.7 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 115.086 -0.961 . . . . 48.66 109.703 -177.497 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 38' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -121.3 127.53 51.43 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 110.233 -0.284 . . . . 55.8 110.233 -176.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 58.2 m -119.63 126.94 52.37 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.099 -0.704 . . . . 42.83 109.099 176.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 40' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -120.22 109.62 15.62 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 109.165 -0.68 . . . . 45.85 109.165 -176.811 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 41' ' ' VAL . . . . . . . . . . . . . 98.2 t -95.96 121.36 46.42 Favored 'Isoleucine or valine' 0 C--O 1.238 0.493 0 N-CA-C 107.819 -1.178 . . . . 40.17 107.819 175.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 42' ' ' ILE . . . . . . . . . . . . . 52.0 mt -116.37 118.25 58.16 Favored 'Isoleucine or valine' 0 C--O 1.24 0.556 0 N-CA-C 108.388 -0.967 . . . . 42.89 108.388 -176.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 43' ' ' ASP . . . . . 0.431 ' HB3' ' HB2' ' C' ' 50' ' ' LYS . 32.9 t0 -107.36 104.33 13.9 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 107.681 -1.229 . . . . 62.49 107.681 177.051 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 44' ' ' GLN . . . . . 0.411 ' HB3' ' ND2' ' C' ' 5' ' ' ASN . 55.0 tt0 -113.03 136.1 53.06 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.78 0.324 . . . . 48.03 110.756 -174.076 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 45' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -134.52 94.32 3.18 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 106.993 -1.484 . . . . 83.4 106.993 175.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 46' ' ' GLY . . . . . . . . . . . . . . . 62.87 -87.58 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 116.319 -0.4 . . . . 49.08 112.836 -178.228 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 47' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -120.24 -10.96 9.27 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 113.415 0.894 . . . . 55.48 113.415 176.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 48' ' ' ASN . . . . . . . . . . . . . 25.2 m-20 -80.95 129.15 34.39 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 118.728 0.695 . . . . 54.01 109.719 176.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 49' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -121.09 130.54 53.8 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 109.892 -0.41 . . . . 45.36 109.892 -177.407 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 50' ' ' LYS . . . . . 0.431 ' HB2' ' HB3' ' C' ' 43' ' ' ASP . 3.5 mtmt -121.12 98.32 5.93 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 106.371 -1.715 . . . . 47.79 106.371 173.111 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 51' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -102.94 133.13 48.56 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 123.169 0.588 . . . . 49.1 109.681 -174.753 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 52' ' ' LYS . . . . . . . . . . . . . 8.9 mttp -133.53 115.09 14.32 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 108.667 -0.864 . . . . 61.98 108.667 178.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 54.5 m -117.06 127.8 54.52 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.639 -0.504 . . . . 47.57 109.639 -177.429 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 54' ' ' THR . . . . . . . . . . . . . 13.8 m -119.41 123.85 45.11 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 109.139 -0.689 . . . . 54.13 109.139 -179.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 55' ' ' SER . . . . . . . . . . . . . 3.7 p -95.8 142.02 28.56 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 108.914 -0.773 . . . . 49.76 108.914 170.314 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 56' ' ' THR . . . . . . . . . . . . . 75.3 m -143.53 129.96 20.01 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.961 -0.563 . . . . 36.91 109.984 -163.631 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 57' ' ' PHE . . . . . . . . . . . . . 92.8 t80 -98.55 127.1 44.35 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 109.373 -0.602 . . . . 40.06 109.373 176.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 58' ' ' ARG . . . . . . . . . . . . . 1.1 mtp-105 -90.24 104.13 16.74 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 108.385 -0.969 . . . . 70.72 108.385 -179.518 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 59' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -74.64 -55.84 5.46 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.366 -0.534 . . . . 43.2 110.889 178.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 60' ' ' TYR . . . . . 0.486 ' HE2' ' H1 ' ' C' ' 205' ' ' ACT . 0.2 OUTLIER -164.7 142.64 6.56 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 109.653 -0.499 . . . . 60.96 109.653 178.037 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 61' ' ' ASP . . . . . . . . . . . . . 60.3 t0 -140.45 113.07 8.05 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 107.166 -1.42 . . . . 46.35 107.166 175.124 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 62' ' ' VAL . . . . . . . . . . . . . 8.1 p -142.01 147.91 21.08 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 CA-C-O 121.397 0.617 . . . . 41.21 109.469 -173.821 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 63' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -126.3 138.31 53.58 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 108.788 -0.819 . . . . 47.64 108.788 171.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 64' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -154.35 173.27 16.43 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 109.097 -0.705 . . . . 33.77 109.097 -175.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 65' ' ' THR . . . . . . . . . . . . . 94.4 m -131.02 134.89 47.09 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.209 -0.905 . . . . 40.81 108.596 177.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 66' ' ' VAL . . . . . 0.459 HG11 ' CD1' ' C' ' 88' ' ' TRP . 3.4 t -67.02 137.99 23.74 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 CA-C-O 121.297 0.57 . . . . 34.5 109.924 -178.144 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.76 -11.59 59.14 Favored Glycine 0 N--CA 1.445 -0.704 0 N-CA-C 115.493 0.957 . . . . 37.59 115.493 178.83 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 68' ' ' VAL . . . . . . . . . . . . . 14.5 t -112.88 119.96 61.77 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 CA-C-N 118.767 1.284 . . . . 42.16 108.146 -178.608 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 69' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -78.06 151.43 33.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.367 0.603 . . . . 55.28 110.396 177.703 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 70' ' ' PHE . . . . . . . . . . . . . 33.3 p90 -150.4 158.29 43.98 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.699 -0.682 . . . . 39.96 109.583 -176.391 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 71' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -92.5 99.35 12.1 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 108.648 -0.871 . . . . 47.13 108.648 -178.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 72' ' ' GLU . . . . . . . . . . . . . 52.5 tt0 -88.41 143.98 26.66 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 123.08 0.552 . . . . 55.71 110.691 -178.351 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 73' ' ' TYR . . . . . . . . . . . . . 62.1 m-85 -123.3 108.55 12.88 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 107.466 -1.309 . . . . 49.09 107.466 175.648 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 74' ' ' THR . . . . . . . . . . . . . 70.4 p -84.7 53.06 2.56 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 113.288 0.848 . . . . 45.98 113.288 -165.47 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 75' ' ' LYS . . . . . . . . . . . . . 26.5 mttt -66.31 158.41 29.16 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 119.872 -0.731 . . . . 58.22 109.453 166.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 76' ' ' SER . . . . . . . . . . . . . 52.2 p 72.89 -7.29 1.49 Allowed 'General case' 0 C--N 1.333 -0.134 0 C-N-CA 127.575 2.35 . . . . 50.66 111.124 -165.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 77' ' ' LEU . . . . . . . . . . . . . 10.0 tp -122.38 -104.33 0.38 Allowed 'General case' 0 C--O 1.236 0.355 0 CA-C-N 119.083 0.856 . . . . 48.86 110.103 173.703 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 78' ' ' ASP . . . . . . . . . . . . . 22.8 p-10 -105.07 -4.93 21.34 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 113.468 0.914 . . . . 40.23 113.468 -176.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 79' ' ' ASN . . . . . . . . . . . . . 6.1 t30 57.17 72.64 0.5 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 122.465 1.126 . . . . 52.5 110.892 178.104 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 80' ' ' ARG . . . . . . . . . . . . . 66.0 mtt85 -142.53 144.93 33.16 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 114.19 -1.368 . . . . 44.93 109.225 179.578 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 81' ' ' HIS . . . . . . . . . . . . . 11.4 t-80 -86.9 129.5 34.85 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.305 -0.628 . . . . 48.18 109.305 174.386 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 82' ' ' VAL . . . . . . . . . . . . . 3.9 m -139.48 145.4 27.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 N-CA-C 108.71 -0.848 . . . . 40.93 108.71 179.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 83' ' ' LYS . . . . . . . . . . . . . 27.8 mtmt -88.46 105.73 17.8 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 107.924 -1.139 . . . . 47.68 107.924 173.209 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 84' ' ' ALA . . . . . . . . . . . . . . . -98.02 141.81 30.51 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 122.76 0.424 . . . . 37.12 110.694 -174.352 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -140.26 124.67 17.87 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.101 -1.074 . . . . 36.28 108.101 178.074 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 86' ' ' VAL . . . . . . . . . . . . . 66.0 t -115.63 127.4 73.23 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 N-CA-C 108.523 -0.918 . . . . 29.15 108.523 -177.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 87' ' ' THR . . . . . . . . . . . . . 1.3 p -136.77 170.19 16.48 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.647 0.737 . . . . 36.95 109.347 -179.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 88' ' ' TRP . . . . . 0.459 ' CD1' HG11 ' C' ' 66' ' ' VAL . 85.5 m95 -102.92 123.12 45.95 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.256 -0.884 . . . . 37.45 109.0 175.916 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 89' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -109.5 95.1 5.39 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 106.093 -1.817 . . . . 38.19 106.093 169.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 90' ' ' GLY . . . . . . . . . . . . . . . 64.88 -110.36 3.44 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 110.875 -0.89 . . . . 39.76 110.875 -170.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 91' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -110.45 9.51 23.34 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 112.156 0.428 . . . . 50.48 112.156 174.157 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 92' ' ' VAL . . . . . . . . . . . . . 72.2 t -101.53 118.32 48.13 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 N-CA-C 108.485 -0.932 . . . . 36.48 108.485 -177.717 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 93' ' ' LEU . . . . . . . . . . . . . 15.5 tp -78.23 104.54 8.88 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.455 -0.942 . . . . 32.8 108.455 178.108 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 81.5 t -99.88 139.87 20.42 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 108.886 -0.783 . . . . 30.24 108.886 -176.889 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 95' ' ' CYS . . . . . . . . . . . . . 27.9 t -136.11 124.23 23.0 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 109.303 -0.628 . . . . 30.54 109.303 -179.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 96' ' ' VAL . . . . . . . . . . . . . 75.0 t -110.55 127.31 67.65 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 N-CA-C 108.16 -1.052 . . . . 26.17 108.16 177.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 97' ' ' GLN . . . . . 0.434 ' HB2' ' HG2' ' C' ' 104' ' ' ARG . 73.1 mt-30 -115.67 99.1 7.09 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 108.047 -1.094 . . . . 40.49 108.047 -179.715 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 98' ' ' LYS . . . . . . . . . . . . . 4.1 mmtt -82.96 129.28 35.01 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.502 -0.317 . . . . 68.76 110.3 -178.17 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 99' ' ' GLY . . . . . . . . . . . . . . . -176.49 -143.71 4.88 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.685 -0.769 . . . . 32.05 113.553 -179.875 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 100' ' ' GLU . . . . . . . . . . . . . 58.5 tt0 -64.5 -50.11 68.7 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.605 -0.438 . . . . 56.4 111.181 -179.036 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 101' ' ' LYS . . . . . 0.431 ' NZ ' ' OD2' ' A' ' 24' ' ' ASP . 12.9 mmtm -82.97 139.35 33.38 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.095 0.474 . . . . 43.58 110.597 -179.989 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -92.03 150.32 21.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.784 -0.644 . . . . 62.43 110.634 -177.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 103' ' ' ASN . . . . . . . . . . . . . 1.2 t30 56.62 49.36 14.74 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.379 -0.828 . . . . 53.43 111.015 -177.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 104' ' ' ARG . . . . . 0.434 ' HG2' ' HB2' ' C' ' 97' ' ' GLN . 62.1 ttt180 -102.83 122.93 45.51 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 108.832 -0.803 . . . . 30.49 108.832 178.944 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 105' ' ' GLY . . . . . . . . . . . . . . . 173.85 -164.65 36.16 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.188 -1.005 . . . . 33.25 110.721 179.468 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 106' ' ' TRP . . . . . 0.451 ' HB2' HD11 ' C' ' 117' ' ' LEU . 35.5 p-90 -160.55 163.36 32.83 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 119.683 -0.807 . . . . 39.29 110.032 178.298 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 107' ' ' LYS . . . . . 0.422 ' O ' ' HA ' ' C' ' 117' ' ' LEU . 97.5 mttt -130.56 125.12 33.39 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.125 -0.943 . . . . 37.6 109.067 177.022 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 108' ' ' LYS . . . . . . . . . . . . . 27.2 ttmt -123.86 118.67 27.63 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 109.181 -0.674 . . . . 36.4 109.181 -175.542 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 109' ' ' TRP . . . . . . . . . . . . . 29.0 p90 -143.83 158.67 43.53 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.378 0.609 . . . . 35.18 109.693 179.03 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 110' ' ' ILE . . . . . . . . . . . . . 12.7 mm -108.91 139.42 31.63 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 N-CA-C 108.914 -0.773 . . . . 39.69 108.914 -177.654 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 111' ' ' GLU . . . . . . . . . . . . . 73.4 mt-10 -129.22 110.32 11.87 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 108.009 -1.108 . . . . 52.18 108.009 174.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 112' ' ' GLY . . . . . . . . . . . . . . . 58.1 -93.08 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.41 0 CA-C-N 116.372 -0.376 . . . . 62.15 112.497 -177.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 113' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -105.93 -35.01 7.43 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 113.026 0.75 . . . . 67.51 113.026 175.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 114' ' ' LYS . . . . . 0.547 ' HZ2' ' CG ' ' D' ' 63' ' ' ASP . 75.7 mttt -81.13 150.06 28.89 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.781 0.8 . . . . 50.61 112.285 -167.805 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 115' ' ' LEU . . . . . 0.415 ' HB3' ' HB2' ' C' ' 130' ' ' PHE . 8.4 tt -101.77 127.3 48.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 114.864 -1.062 . . . . 29.0 108.651 171.383 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 116' ' ' TYR . . . . . 0.585 ' OH ' ' OD2' ' D' ' 63' ' ' ASP . 85.7 m-85 -115.45 131.13 57.03 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 108.826 -0.805 . . . . 53.46 108.826 178.671 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 117' ' ' LEU . . . . . 0.472 HD21 ' H2 ' ' A' ' 203' ' ' ACT . 12.2 tp -136.55 124.44 22.69 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 109.398 -0.593 . . . . 38.57 109.398 177.359 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 118' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -107.4 101.48 10.84 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 107.854 -1.165 . . . . 53.14 107.854 176.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 119' ' ' LEU . . . . . . . . . . . . . 3.1 mt -78.7 147.41 33.48 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.284 -0.635 . . . . 36.42 109.284 167.401 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 120' ' ' THR . . . . . 0.529 HG23 HG22 ' C' ' 125' ' ' VAL . 6.4 m -148.66 134.63 19.09 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 120.025 -0.67 . . . . 43.9 110.207 -177.669 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 121' ' ' CYS . . . . . . . . . . . . . 43.2 t -140.98 119.44 12.27 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 108.17 -1.048 . . . . 32.6 108.17 175.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 122' ' ' GLY . . . . . . . . . . . . . . . 61.52 -114.01 6.29 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 121.508 -0.377 . . . . 50.84 112.755 -178.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 123' ' ' ASP . . . . . . . . . . . . . 21.4 p-10 -106.73 8.38 30.92 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 112.374 0.509 . . . . 35.79 112.374 176.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 124' ' ' GLN . . . . . . . . . . . . . 86.7 mm-40 -103.56 126.35 50.65 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 109.858 -0.423 . . . . 30.96 109.858 -178.381 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 125' ' ' VAL . . . . . 0.529 HG22 HG23 ' C' ' 120' ' ' THR . 39.6 t -119.77 125.13 74.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.439 0 N-CA-C 108.051 -1.092 . . . . 34.09 108.051 -178.954 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 126' ' ' CYS . . . . . . . . . . . . . 24.3 t -113.21 124.17 51.91 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 108.514 -0.921 . . . . 32.06 108.514 176.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 127' ' ' ARG . . . . . . . . . . . . . 65.0 ttt-85 -111.1 125.81 54.16 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.473 -0.566 . . . . 54.87 109.473 -178.334 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 128' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -124.85 136.29 53.67 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 120.951 0.405 . . . . 33.8 110.411 -177.602 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 129' ' ' VAL . . . . . . . . . . . . . 21.7 t -118.12 133.41 65.01 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 N-CA-C 108.337 -0.986 . . . . 31.85 108.337 -179.51 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 130' ' ' PHE . . . . . 0.595 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 85.6 m-85 -127.78 147.38 50.42 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 123.52 0.728 . . . . 31.61 109.71 -176.797 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 131' ' ' LYS . . . . . . . . . . . . . 25.4 tptp -114.8 134.6 54.99 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.494 -0.776 . . . . 53.06 109.098 177.117 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 132' ' ' LYS . . . . . . . . . . . . . 76.1 tttt -71.04 139.5 50.47 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.209 0.528 . . . . 47.16 110.803 -178.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 133' ' ' LYS . . . . . . . . . . . . . 18.2 mtpt . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 115.905 -0.588 . . . . 68.81 110.729 177.024 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 1' ' ' THR . . . . . . . . . . . . . 1.3 t . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.894 0.378 . . . . 48.63 110.945 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 2' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -101.22 -3.75 28.44 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 113.119 0.785 . . . . 57.96 113.119 -177.781 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 3' ' ' ASP . . . . . . . . . . . . . 50.5 t0 -83.56 104.6 13.81 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 108.596 -0.89 . . . . 63.53 108.596 -179.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -107.02 14.24 26.62 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 112.666 0.617 . . . . 60.83 112.666 -179.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 5' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 -64.79 149.52 49.19 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.547 0.689 . . . . 65.53 111.297 -175.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 6' ' ' GLY . . . . . . . . . . . . . . . 125.14 -166.68 17.75 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.469 -0.872 . . . . 60.14 112.454 167.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 7' ' ' THR . . . . . . . . . . . . . 91.2 m -112.36 125.83 54.62 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 123.774 0.83 . . . . 54.18 109.506 -176.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 8' ' ' TRP . . . . . 0.712 ' HB3' ' HB3' ' B' ' 130' ' ' PHE . 76.6 m95 -121.71 136.51 54.94 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 123.598 0.759 . . . . 56.8 109.93 -175.125 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 9' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -113.27 133.84 54.9 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 109.213 -0.662 . . . . 63.16 109.213 177.417 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 10' ' ' MET . . . . . . . . . . . . . 56.8 ttm -70.0 139.07 52.7 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.203 0.525 . . . . 45.92 111.223 -172.878 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 11' ' ' GLU . . . . . 0.4 ' OE1' ' HE2' ' B' ' 131' ' ' LYS . 6.5 tt0 -107.67 -48.87 3.33 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.838 -0.619 . . . . 45.07 112.572 176.544 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 12' ' ' SER . . . . . . . . . . . . . 5.8 p -135.95 166.51 23.16 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.716 0.769 . . . . 40.94 109.22 175.194 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 13' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -159.19 102.14 1.59 Allowed 'General case' 0 C--O 1.234 0.245 0 N-CA-C 106.683 -1.599 . . . . 46.68 106.683 -172.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 14' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -106.85 130.89 54.46 Favored 'General case' 0 C--O 1.236 0.348 0 O-C-N 123.593 0.558 . . . . 59.64 110.182 -172.016 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 15' ' ' ASN . . . . . . . . . . . . . 61.9 t30 58.25 49.19 11.52 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.661 0.743 . . . . 36.54 111.518 178.096 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 16' ' ' PHE . . . . . 0.47 ' O ' ' HG3' ' D' ' 20' ' ' MET . 1.1 t80 -76.25 -38.01 56.86 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 120.2 -0.6 . . . . 42.3 111.32 172.539 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 17' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -65.8 -33.78 76.65 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.782 -0.367 . . . . 62.84 111.784 179.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 18' ' ' GLY . . . . . . . . . . . . . . . -67.81 -42.99 85.43 Favored Glycine 0 C--N 1.334 0.436 0 C-N-CA 119.945 -1.121 . . . . 41.85 112.558 174.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 19' ' ' TYR . . . . . . . . . . . . . 82.9 t80 -65.02 -41.42 95.3 Favored 'General case' 0 C--O 1.238 0.46 0 O-C-N 122.344 -0.504 . . . . 38.04 111.344 -179.505 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 20' ' ' MET . . . . . 0.594 ' HE3' ' HA ' ' D' ' 30' ' ' ARG . 32.2 mtm -78.88 -33.01 46.09 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 119.414 -0.914 . . . . 69.98 112.012 -177.872 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 21' ' ' LYS . . . . . . . . . . . . . 21.6 ttmt -66.89 -29.84 69.84 Favored 'General case' 0 C--O 1.236 0.342 0 C-N-CA 118.868 -1.133 . . . . 52.72 111.266 172.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.32 -27.16 68.84 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.009 -0.677 . . . . 34.46 111.218 171.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 23' ' ' LEU . . . . . . . . . . . . . 95.8 mt -89.34 9.68 25.18 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 112.6 0.593 . . . . 33.34 112.6 175.305 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 24' ' ' ASP . . . . . 0.409 ' OD2' ' NH2' ' B' ' 80' ' ' ARG . 12.2 m-20 60.25 28.3 17.89 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 123.559 0.743 . . . . 40.75 111.956 -179.78 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 25' ' ' ILE . . . . . . . . . . . . . 3.5 mt -70.79 134.01 30.81 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 N-CA-C 109.019 -0.734 . . . . 41.23 109.019 176.092 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 26' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -60.71 164.0 5.06 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.839 0.828 . . . . 47.51 110.791 -176.166 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 27' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -64.03 -50.89 66.68 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.314 -0.857 . . . . 57.01 111.7 -171.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 28' ' ' CYS . . . . . . . . . . . . . 64.0 m -57.89 -42.13 84.0 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 120.625 -0.43 . . . . 47.67 111.535 -173.039 -73.237 -54.445 -70.379 104.247 2.032 104.387 -45.32 -82.235 1 1 . 1 . 001 ecloud build full ' D' D ' 29' ' ' THR . . . . . . . . . . . . . 8.6 m -60.61 -33.39 72.67 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.413 -0.515 . . . . 42.94 111.381 175.26 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 30' ' ' ARG . . . . . 0.594 ' HA ' ' HE3' ' D' ' 20' ' ' MET . 72.2 mtm-85 -71.79 -44.21 64.37 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.262 -0.575 . . . . 49.31 111.349 178.511 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 27.0 tttm -68.11 -35.83 78.76 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.948 -0.301 . . . . 54.74 111.35 -177.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 32' ' ' ILE . . . . . . . . . . . . . 5.6 mt -86.66 -42.18 15.4 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 O-C-N 122.045 -0.409 . . . . 45.75 111.76 -175.996 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -63.36 -22.86 67.14 Favored 'General case' 0 C--O 1.236 0.352 0 O-C-N 121.645 -0.66 . . . . 52.02 112.56 -178.219 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 34' ' ' VAL . . . . . . . . . . . . . 3.4 p -80.29 -14.96 12.99 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 N-CA-C 112.151 0.426 . . . . 55.1 112.151 179.324 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 35' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -81.77 -29.52 32.76 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 112.314 0.487 . . . . 65.83 112.314 -177.313 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 2.3 mt -94.82 147.71 23.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.398 0.618 . . . . 56.6 111.057 -173.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 37' ' ' THR . . . . . . . . . . . . . 4.6 t -88.47 142.28 27.84 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.546 -0.752 . . . . 56.82 109.72 176.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 38' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -101.54 146.33 27.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.462 0.648 . . . . 45.89 111.01 -173.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 39' ' ' THR . . . . . . . . . . . . . 95.6 m -115.96 99.63 7.41 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 107.693 -1.225 . . . . 43.0 107.693 179.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 40' ' ' LYS . . . . . . . . . . . . . 7.6 tppt? -76.54 143.89 40.07 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.946 -0.57 . . . . 58.09 109.729 173.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 41' ' ' VAL . . . . . . . . . . . . . 55.3 t -139.11 117.57 12.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 N-CA-C 107.635 -1.246 . . . . 55.44 107.635 179.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 42' ' ' ILE . . . . . . . . . . . . . 2.9 mp -117.04 121.22 67.29 Favored 'Isoleucine or valine' 0 C--O 1.241 0.606 0 N-CA-C 108.886 -0.783 . . . . 59.94 108.886 -174.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 43' ' ' ASP . . . . . 0.563 ' HB2' ' HB2' ' D' ' 50' ' ' LYS . 0.8 OUTLIER -111.03 100.97 9.56 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 106.714 -1.588 . . . . 65.79 106.714 170.606 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 44' ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -111.83 135.42 52.46 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 122.694 0.397 . . . . 57.46 110.54 -173.684 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 45' ' ' ASP . . . . . 0.424 ' O ' ' N ' ' D' ' 47' ' ' ASP . 39.6 t0 -116.31 74.12 0.89 Allowed 'General case' 0 C--O 1.235 0.312 0 N-CA-C 108.236 -1.024 . . . . 76.24 108.236 175.519 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 46' ' ' GLY . . . . . . . . . . . . . . . 65.41 -65.2 0.1 Allowed Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 121.203 -0.522 . . . . 59.11 112.891 -177.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 47' ' ' ASP . . . . . 0.424 ' N ' ' O ' ' D' ' 45' ' ' ASP . 38.2 m-20 -130.09 -23.17 2.77 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 114.189 1.181 . . . . 74.99 114.189 178.611 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 48' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -81.7 127.83 33.33 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 119.382 0.992 . . . . 67.97 109.376 172.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 49' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -113.79 156.31 24.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.673 0.749 . . . . 57.74 111.067 -173.954 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 50' ' ' LYS . . . . . 0.563 ' HB2' ' HB2' ' D' ' 43' ' ' ASP . 21.3 mttt -140.56 98.64 3.46 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 106.692 -1.595 . . . . 59.99 106.692 173.379 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 51' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -103.34 134.02 47.43 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 122.82 0.448 . . . . 54.27 109.831 -175.241 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 52' ' ' LYS . . . . . . . . . . . . . 32.3 tttp -147.12 112.03 5.4 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 108.966 -0.753 . . . . 57.36 108.966 -179.451 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 53' ' ' THR . . . . . 0.443 ' O ' ' HA ' ' B' ' 59' ' ' ASN . 32.9 m -103.23 130.2 50.4 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.427 -0.583 . . . . 47.92 109.427 177.694 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 54' ' ' THR . . . . . . . . . . . . . 4.7 m -124.04 139.56 53.82 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 122.374 0.27 . . . . 61.48 110.334 -178.657 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 55' ' ' SER . . . . . . . . . . . . . 1.9 t -133.39 137.67 45.93 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 109.341 -0.614 . . . . 56.77 109.341 176.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 56' ' ' THR . . . . . . . . . . . . . 97.9 m -103.43 121.02 41.94 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 109.288 -0.634 . . . . 58.63 109.288 -178.067 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 57' ' ' PHE . . . . . 0.494 ' HZ ' HG23 ' B' ' 29' ' ' THR . 30.4 t80 -72.4 -76.81 0.11 Allowed 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.357 -0.383 . . . . 62.15 110.564 178.406 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 58' ' ' ARG . . . . . 0.55 ' HB2' ' H32' ' D' ' 203' ' ' RET . 48.2 mtt180 -139.94 174.13 10.82 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 108.937 -0.764 . . . . 61.38 108.937 177.493 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 59' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -135.79 130.23 33.73 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 108.609 -0.886 . . . . 62.97 108.609 175.488 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 60' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -110.37 129.94 55.65 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 108.905 -0.776 . . . . 51.75 108.905 172.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 61' ' ' ASP . . . . . 0.68 ' OD2' ' HG3' ' B' ' 52' ' ' LYS . 0.8 OUTLIER -154.42 138.41 16.37 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.398 -0.521 . . . . 63.22 109.898 177.573 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 62' ' ' VAL . . . . . . . . . . . . . 6.3 p -149.39 144.48 18.02 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 N-CA-C 108.259 -1.015 . . . . 44.36 108.259 -170.121 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 63' ' ' ASP . . . . . 0.585 ' OD2' ' OH ' ' C' ' 116' ' ' TYR . 15.4 m-20 -114.43 140.94 48.28 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.278 -0.638 . . . . 42.96 109.278 173.484 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 64' ' ' PHE . . . . . . . . . . . . . 51.5 p90 -157.44 152.13 25.36 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 120.054 -0.658 . . . . 36.67 109.808 179.155 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 65' ' ' THR . . . . . . . . . . . . . 84.0 m -109.74 128.46 55.3 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.132 -0.94 . . . . 38.14 108.51 173.766 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 66' ' ' VAL . . . . . . . . . . . . . 46.2 t -69.57 123.47 23.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 N-CA-C 109.249 -0.648 . . . . 35.18 109.249 -175.916 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 67' ' ' GLY . . . . . . . . . . . . . . . 107.53 -4.45 34.86 Favored Glycine 0 N--CA 1.448 -0.513 0 CA-C-O 119.004 -0.887 . . . . 39.9 114.89 177.8 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 68' ' ' VAL . . . . . . . . . . . . . 92.7 t -122.48 123.96 69.73 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 CA-C-N 118.637 1.219 . . . . 37.41 108.326 -177.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 69' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -69.04 149.77 48.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.446 0.641 . . . . 56.45 110.289 175.905 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 70' ' ' PHE . . . . . . . . . . . . . 24.8 p90 -157.27 143.05 17.58 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.873 -0.603 . . . . 31.7 109.614 -178.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 71' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -82.34 127.81 33.6 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.987 -0.551 . . . . 33.09 110.13 179.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 72' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -104.03 163.53 12.32 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.884 0.85 . . . . 43.52 110.933 -179.744 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 73' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -143.05 90.85 2.23 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 105.77 -1.937 . . . . 34.83 105.77 177.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 74' ' ' THR . . . . . . . . . . . . . 19.8 p -76.02 60.53 1.42 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 122.203 1.001 . . . . 41.56 111.735 -166.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 75' ' ' LYS . . . . . 0.539 ' NZ ' ' O ' ' D' ' 302' ' ' HOH . 69.4 mmtt -63.09 154.5 30.75 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.293 -0.867 . . . . 51.1 109.428 167.943 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 76' ' ' SER . . . . . . . . . . . . . 60.5 p 64.92 7.28 3.87 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 125.065 1.346 . . . . 54.03 112.317 -170.743 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 77' ' ' LEU . . . . . 0.437 ' HB3' ' H ' ' D' ' 78' ' ' ASP . 0.9 OUTLIER -125.53 -116.78 0.28 Allowed 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.101 0.56 . . . . 46.2 109.753 175.551 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' D' D ' 78' ' ' ASP . . . . . 0.437 ' H ' ' HB3' ' D' ' 77' ' ' LEU . 20.9 p-10 -94.16 -8.52 39.18 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 112.918 0.711 . . . . 34.34 112.918 175.427 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 79' ' ' ASN . . . . . . . . . . . . . 34.6 t30 52.46 70.56 0.55 Allowed 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 122.784 1.278 . . . . 52.73 110.662 -177.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 80' ' ' ARG . . . . . . . . . . . . . 76.2 mtt85 -133.17 162.06 32.77 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 113.88 -1.509 . . . . 38.01 108.757 174.583 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 81' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -101.33 123.47 45.48 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.983 -0.747 . . . . 35.81 108.983 177.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 82' ' ' VAL . . . . . 0.54 HG12 ' HA3' ' D' ' 99' ' ' GLY . 18.8 m -133.58 162.16 40.04 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 N-CA-C 107.936 -1.135 . . . . 29.47 107.936 175.836 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 83' ' ' LYS . . . . . . . . . . . . . 25.7 mttt -110.1 112.59 24.68 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 106.981 -1.489 . . . . 48.73 106.981 171.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 84' ' ' ALA . . . . . 0.464 ' HA ' ' O ' ' D' ' 96' ' ' VAL . . . -102.26 140.91 35.91 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 115.971 -0.559 . . . . 31.69 110.561 -173.525 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 85' ' ' LEU . . . . . . . . . . . . . 61.6 tp -132.41 129.02 38.78 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 108.137 -1.06 . . . . 35.86 108.137 173.87 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 86' ' ' VAL . . . . . 0.495 HG22 ' HB2' ' D' ' 95' ' ' CYS . 60.9 t -115.19 121.08 66.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 107.752 -1.203 . . . . 31.7 107.752 -178.894 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 87' ' ' THR . . . . . . . . . . . . . 30.7 p -129.81 161.37 30.9 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.423 0.63 . . . . 34.85 109.548 179.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 88' ' ' TRP . . . . . . . . . . . . . 76.0 m95 -92.12 126.51 37.23 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 115.37 -0.832 . . . . 38.02 109.494 175.05 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 89' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -118.11 97.31 5.74 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 106.29 -1.744 . . . . 41.91 106.29 171.378 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 90' ' ' GLY . . . . . . . . . . . . . . . 66.44 -126.49 27.9 Favored Glycine 0 C--O 1.235 0.209 0 N-CA-C 109.074 -1.61 . . . . 37.3 109.074 -168.672 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 91' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -99.79 17.69 20.1 Favored 'General case' 0 C--O 1.236 0.365 0 O-C-N 122.53 -0.394 . . . . 50.97 111.945 170.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 92' ' ' VAL . . . . . . . . . . . . . 62.1 t -108.39 106.13 20.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 N-CA-C 108.045 -1.095 . . . . 36.88 108.045 -175.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 93' ' ' LEU . . . . . . . . . . . . . 13.1 tp -67.1 109.07 2.88 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 123.169 0.588 . . . . 38.61 109.471 173.027 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 22.1 t -108.03 141.13 24.06 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 N-CA-C 108.667 -0.864 . . . . 34.94 108.667 -179.188 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 95' ' ' CYS . . . . . 0.495 ' HB2' HG22 ' D' ' 86' ' ' VAL . 1.6 t -133.37 125.03 28.27 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-N 116.354 -0.385 . . . . 30.54 110.086 -178.0 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 96' ' ' VAL . . . . . 0.464 ' O ' ' HA ' ' D' ' 84' ' ' ALA . 2.6 t -101.2 135.43 37.64 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 C-N-CA 124.34 1.056 . . . . 39.1 108.318 175.718 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 97' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -122.98 91.79 3.56 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 107.928 -1.138 . . . . 37.49 107.928 178.527 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 98' ' ' LYS . . . . . . . . . . . . . 64.7 mttt -75.96 122.19 23.81 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.279 -0.419 . . . . 52.37 110.047 -178.409 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 99' ' ' GLY . . . . . 0.54 ' HA3' HG12 ' D' ' 82' ' ' VAL . . . -170.48 -143.25 3.88 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.545 -0.836 . . . . 38.34 114.667 -179.726 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 100' ' ' GLU . . . . . . . . . . . . . 56.0 tt0 -66.99 -31.55 72.19 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.777 -0.369 . . . . 46.63 111.777 -178.394 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 101' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -94.03 157.49 16.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.748 0.785 . . . . 46.46 110.738 -178.502 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -102.97 144.6 31.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.264 -0.88 . . . . 69.03 109.93 178.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 103' ' ' ASN . . . . . . . . . . . . . 29.8 m120 55.66 35.48 25.33 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.326 0.584 . . . . 68.4 111.406 -179.721 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 104' ' ' ARG . . . . . . . . . . . . . 74.4 ttt180 -89.53 129.77 35.95 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 109.603 -0.517 . . . . 42.62 109.603 178.588 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 105' ' ' GLY . . . . . . . . . . . . . . . 165.76 -161.42 34.95 Favored Glycine 0 N--CA 1.451 -0.358 0 N-CA-C 110.173 -1.171 . . . . 37.67 110.173 -179.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 106' ' ' TRP . . . . . 0.46 ' HB3' HD23 ' D' ' 119' ' ' LEU . 51.6 p-90 -159.1 167.6 28.8 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 119.081 -1.048 . . . . 38.92 109.906 179.256 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 107' ' ' LYS . . . . . . . . . . . . . 39.6 mttp -138.42 137.52 37.31 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 114.875 -1.057 . . . . 44.7 108.695 179.232 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 108' ' ' LYS . . . . . . . . . . . . . 9.7 ttmm -143.02 133.99 25.57 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 107.917 -1.142 . . . . 53.69 107.917 -171.957 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 109' ' ' TRP . . . . . . . . . . . . . 30.4 p90 -159.67 144.57 15.28 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 119.843 -0.743 . . . . 42.46 109.625 178.333 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 110' ' ' ILE . . . . . . . . . . . . . 24.8 mm -89.58 138.92 18.34 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 N-CA-C 109.111 -0.7 . . . . 45.0 109.111 179.098 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 111' ' ' GLU . . . . . . . . . . . . . 20.9 tp10 -130.18 112.73 13.67 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 107.841 -1.17 . . . . 51.39 107.841 171.561 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 112' ' ' GLY . . . . . . . . . . . . . . . 58.27 -96.07 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.485 0 CA-C-N 116.239 -0.437 . . . . 52.14 113.034 -178.378 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 113' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -118.09 4.2 12.04 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 113.366 0.876 . . . . 69.35 113.366 -178.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 114' ' ' LYS . . . . . . . . . . . . . 12.2 mtmm -119.21 154.33 33.55 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 118.832 0.742 . . . . 60.26 110.774 -174.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 115' ' ' LEU . . . . . 0.615 ' HB3' ' HB2' ' D' ' 130' ' ' PHE . 8.3 tt -107.31 110.67 22.74 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 108.037 -1.098 . . . . 44.68 108.037 178.175 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 116' ' ' TYR . . . . . . . . . . . . . 34.2 m-85 -91.45 126.89 36.69 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 109.388 -0.597 . . . . 59.78 109.388 177.001 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 117' ' ' LEU . . . . . . . . . . . . . 30.8 tp -131.15 143.25 50.48 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 109.373 -0.603 . . . . 43.59 109.373 -178.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 118' ' ' GLU . . . . . . . . . . . . . 78.8 mt-10 -140.94 110.81 6.51 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 108.217 -1.031 . . . . 43.6 108.217 179.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 119' ' ' LEU . . . . . 0.46 HD23 ' HB3' ' D' ' 106' ' ' TRP . 4.5 mt -97.24 133.8 41.4 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.111 -0.7 . . . . 41.04 109.111 178.141 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 120' ' ' THR . . . . . . . . . . . . . 72.4 p -126.74 136.07 51.93 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 120.793 0.33 . . . . 37.74 110.532 -175.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 121' ' ' CYS . . . . . . . . . . . . . 43.0 t -149.67 121.14 7.94 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 108.413 -0.958 . . . . 36.99 108.413 173.656 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 122' ' ' GLY . . . . . . . . . . . . . . . 64.47 -122.92 26.22 Favored Glycine 0 C--O 1.237 0.314 0 N-CA-C 110.165 -1.174 . . . . 50.71 110.165 -177.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 123' ' ' ASP . . . . . . . . . . . . . 46.6 p-10 -96.09 -5.27 41.24 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 112.813 0.671 . . . . 63.58 112.813 173.585 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 124' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -87.94 133.08 34.01 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 118.115 0.416 . . . . 42.66 110.589 -173.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 125' ' ' VAL . . . . . . . . . . . . . 94.2 t -125.59 127.14 71.38 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 N-CA-C 108.199 -1.037 . . . . 36.14 108.199 178.192 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 126' ' ' CYS . . . . . . . . . . . . . 2.5 t -114.23 127.05 55.7 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 123.524 0.729 . . . . 35.18 109.038 177.882 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 127' ' ' ARG . . . . . . . . . . . . . 63.9 mtt-85 -110.09 116.46 31.6 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 109.16 -0.681 . . . . 40.51 109.16 -176.255 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 128' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -116.1 141.96 47.44 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 123.524 0.73 . . . . 37.47 109.879 -179.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 129' ' ' VAL . . . . . . . . . . . . . 85.5 t -124.76 128.25 73.21 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 N-CA-C 108.231 -1.026 . . . . 42.07 108.231 178.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 130' ' ' PHE . . . . . 0.615 ' HB2' ' HB3' ' D' ' 115' ' ' LEU . 48.6 m-85 -117.0 153.22 33.04 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 123.162 0.585 . . . . 51.68 109.672 178.942 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 131' ' ' LYS . . . . . 0.488 ' HB2' ' OE2' ' B' ' 11' ' ' GLU . 2.2 ttpp -117.37 141.18 48.64 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.004 -0.544 . . . . 61.57 109.865 174.037 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' D' D ' 132' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -74.57 144.76 43.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.772 -0.649 . . . . 53.93 110.518 178.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 133' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 115.988 -0.551 . . . . 66.64 110.621 176.909 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 201' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' ACT . . . . . 0.472 ' H2 ' HD21 ' C' ' 117' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 204' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 201' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 202' ' ' GOL . . . . . 0.589 ' H32' ' H ' ' B' ' 81' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 201' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 202' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 203' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 204' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 205' ' ' ACT . . . . . 0.486 ' H1 ' ' HE2' ' C' ' 60' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 206' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 201' ' ' ACT . . . . . 0.456 ' C ' ' HE1' ' D' ' 106' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 202' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 203' ' ' RET . . . . . 0.55 ' H32' ' HB2' ' D' ' 58' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' B' B ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 302' ' ' HOH . . . . . 0.539 ' O ' ' NZ ' ' D' ' 75' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' THR . . . . . . . . . . . . . 8.9 t . . . . . 0 C--O 1.231 0.121 0 CA-C-O 120.8 0.333 . . . . 50.07 111.139 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 89.4 mtt180 -88.53 -6.05 57.82 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 112.965 0.728 . . . . 37.41 112.965 177.429 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -82.65 115.0 21.41 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 109.24 -0.652 . . . . 36.44 109.24 177.383 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 -114.41 14.37 17.88 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 112.712 0.634 . . . . 29.08 112.712 -178.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -62.95 153.47 33.55 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.501 0.667 . . . . 30.16 110.774 179.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 133.0 179.35 16.23 Favored Glycine 0 N--CA 1.445 -0.717 0 CA-C-O 122.274 0.93 . . . . 31.15 112.892 169.03 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 68.2 m -102.7 110.97 23.08 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 107.992 -1.114 . . . . 34.09 107.992 176.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' TRP . . . . . 0.595 ' HB3' ' HB3' ' C' ' 130' ' ' PHE . 71.5 m95 -105.66 138.94 41.02 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 122.738 0.415 . . . . 29.44 110.493 -175.014 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 9.3 tt0 -119.56 135.19 54.89 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.272 -0.64 . . . . 65.19 109.272 177.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' MET . . . . . . . . . . . . . 38.0 ttm -67.44 123.57 20.77 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.011 -0.541 . . . . 27.37 110.822 -171.561 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLU . . . . . 0.513 ' OE1' ' NZ ' ' C' ' 114' ' ' LYS . 14.8 mt-10 -84.76 -55.93 3.85 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 116.207 -0.451 . . . . 54.64 110.882 174.316 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 55.9 p -134.74 170.13 16.29 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-O 121.591 0.71 . . . . 29.56 109.59 -178.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ASN . . . . . . . . . . . . . 49.1 t30 -162.35 104.31 1.11 Allowed 'General case' 0 C--O 1.233 0.22 0 N-CA-C 107.295 -1.372 . . . . 30.24 107.295 -177.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.9 pt-20 -109.24 142.33 40.24 Favored 'General case' 0 C--O 1.236 0.373 0 O-C-N 123.522 0.514 . . . . 46.49 110.408 -177.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 48.6 t30 55.65 41.54 30.41 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 115.629 -0.714 . . . . 30.05 111.526 178.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' PHE . . . . . . . . . . . . . 73.1 t80 -72.73 -41.27 65.36 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 120.203 -0.599 . . . . 34.08 110.949 174.496 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 8.2 mp0 -65.86 -39.12 90.42 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.813 -0.355 . . . . 49.93 111.461 -178.056 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.69 -44.01 90.58 Favored Glycine 0 C--N 1.335 0.49 0 C-N-CA 119.978 -1.106 . . . . 36.79 112.641 178.328 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.454 ' OH ' ' O ' ' C' ' 205' ' ' ACT . 56.2 t80 -62.51 -40.76 97.76 Favored 'General case' 0 C--O 1.237 0.396 0 O-C-N 122.286 -0.537 . . . . 36.64 111.186 176.951 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 41.8 mmm -69.02 -33.9 74.39 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 119.938 -0.705 . . . . 42.91 112.064 179.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 9.0 tttm -75.65 -28.99 58.96 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 119.808 -0.757 . . . . 62.82 110.83 179.432 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -57.96 -31.65 67.08 Favored 'General case' 0 CA--C 1.52 -0.21 0 O-C-N 122.166 -0.334 . . . . 36.45 111.313 170.102 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 86.9 mt -92.37 12.16 23.58 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 112.838 0.681 . . . . 37.25 112.838 177.955 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ASP . . . . . 0.431 ' OD2' ' NZ ' ' C' ' 101' ' ' LYS . 35.1 m-20 60.79 30.25 19.55 Favored 'General case' 0 N--CA 1.465 0.293 0 C-N-CA 123.284 0.634 . . . . 40.88 112.205 177.486 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 30.7 mm -76.55 135.81 25.98 Favored 'Isoleucine or valine' 0 C--O 1.236 0.354 0 N-CA-C 108.918 -0.771 . . . . 35.08 108.918 175.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -67.72 173.77 4.07 Favored 'General case' 0 C--O 1.235 0.317 0 CA-C-O 122.132 0.968 . . . . 45.8 110.929 -172.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 79.3 t80 -75.29 -40.12 58.98 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.057 -0.974 . . . . 34.7 112.673 -166.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 10.8 m -64.96 -51.35 62.27 Favored 'General case' 0 C--O 1.238 0.451 0 C-N-CA 120.415 -0.514 . . . . 37.28 111.443 -172.871 -83.347 -48.497 -74.152 103.967 2.032 103.615 -42.235 -83.628 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -64.48 -27.07 68.73 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.049 -0.661 . . . . 35.7 111.395 177.363 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ARG . . . . . . . . . . . . . 11.6 mtp180 -64.63 -41.87 95.85 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 120.527 -0.469 . . . . 35.1 111.06 173.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 10.6 ttmt -73.77 -36.59 65.1 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.405 -0.518 . . . . 38.2 111.382 -178.268 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 45.7 mm -77.75 -44.09 29.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.398 0 C-N-CA 120.139 -0.624 . . . . 40.77 111.114 -176.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -65.53 -27.93 68.81 Favored 'General case' 0 C--O 1.236 0.385 0 O-C-N 121.881 -0.512 . . . . 29.52 112.132 -174.636 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' VAL . . . . . . . . . . . . . 2.1 p -73.44 -16.77 17.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 C-N-CA 120.412 -0.515 . . . . 33.82 111.798 -179.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 78.1 mtt180 -95.22 -7.43 39.04 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 113.309 0.855 . . . . 52.96 113.309 -179.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' LEU . . . . . . . . . . . . . 49.5 mt -100.55 145.15 28.68 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 121.444 0.64 . . . . 27.66 110.867 -175.679 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 25.3 m -82.62 120.95 26.19 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 115.422 -0.808 . . . . 33.61 109.179 176.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 -89.87 139.34 30.69 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.01 0.433 . . . . 35.34 110.177 -178.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' THR . . . . . 0.4 ' HA ' ' O ' ' A' ' 8' ' ' TRP . 87.2 m -123.86 112.33 17.14 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 107.147 -1.427 . . . . 38.44 107.147 178.185 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 19.3 ttmm -102.52 115.07 29.82 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 124.003 0.921 . . . . 31.44 108.801 -177.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 84.9 t -95.23 124.78 47.91 Favored 'Isoleucine or valine' 0 C--O 1.238 0.448 0 N-CA-C 107.733 -1.21 . . . . 33.91 107.733 176.389 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 29.6 mt -122.03 122.15 65.89 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 N-CA-C 108.711 -0.848 . . . . 30.89 108.711 -177.686 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 88.9 m-20 -112.36 117.14 31.64 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 108.129 -1.063 . . . . 42.52 108.129 172.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 39.7 tt0 -126.04 128.16 46.98 Favored 'General case' 0 C--O 1.236 0.343 0 N-CA-C 110.179 -0.304 . . . . 29.94 110.179 -174.058 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ASP . . . . . . . . . . . . . 59.4 t0 -124.1 97.71 5.46 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 107.013 -1.477 . . . . 26.7 107.013 173.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 62.15 -100.54 0.3 Allowed Glycine 0 N--CA 1.448 -0.525 0 CA-C-N 116.371 -0.377 . . . . 32.64 112.723 -177.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ASP . . . . . . . . . . . . . 95.3 m-20 -112.61 6.11 18.17 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 112.584 0.587 . . . . 40.05 112.584 178.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ASN . . . . . . . . . . . . . 27.8 m-20 -99.97 124.4 45.27 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 108.6 -0.889 . . . . 48.92 108.6 177.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 21.0 m-85 -118.45 155.92 29.93 Favored 'General case' 0 N--CA 1.453 -0.293 0 CA-C-O 121.725 0.774 . . . . 40.76 111.142 -171.973 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' LYS . . . . . . . . . . . . . 13.5 mttp -147.31 101.86 3.42 Favored 'General case' 0 C--O 1.235 0.309 0 N-CA-C 106.696 -1.594 . . . . 48.6 106.696 175.308 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -110.77 124.71 52.52 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 109.008 -0.738 . . . . 36.23 109.008 -175.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 12.4 tttm -133.22 102.15 5.46 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 108.393 -0.966 . . . . 53.94 108.393 178.167 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 89.7 m -96.01 125.95 40.91 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 109.133 -0.692 . . . . 34.44 109.133 176.843 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 7.6 t -128.56 165.34 20.95 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.472 0.654 . . . . 39.21 109.719 -175.461 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 57.9 m -144.13 130.02 19.39 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 115.669 -0.696 . . . . 31.45 109.535 -179.534 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 54.2 m -88.39 115.14 25.68 Favored 'General case' 0 C--O 1.235 0.33 0 N-CA-C 108.77 -0.826 . . . . 34.91 108.77 178.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' PHE . . . . . . . . . . . . . 25.0 t80 -76.62 -72.88 0.31 Allowed 'General case' 0 C--O 1.236 0.348 0 CA-C-O 120.873 0.368 . . . . 44.99 110.671 178.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 3.2 mmt85 -140.95 151.38 44.14 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 109.549 -0.537 . . . . 53.81 109.549 179.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 12.9 m-80 -118.05 139.63 50.93 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 108.949 -0.76 . . . . 48.88 108.949 172.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -130.85 100.99 5.45 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 108.626 -0.879 . . . . 69.67 108.626 -177.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -103.58 125.55 50.18 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.299 -0.63 . . . . 58.31 109.299 176.452 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 12.9 p -131.62 135.78 58.42 Favored 'Isoleucine or valine' 0 C--O 1.236 0.377 0 N-CA-C 108.359 -0.978 . . . . 44.36 108.359 176.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -119.93 128.52 53.68 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 108.599 -0.889 . . . . 59.33 108.599 178.486 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' PHE . . . . . . . . . . . . . 54.6 p90 -150.19 160.86 43.36 Favored 'General case' 0 N--CA 1.453 -0.281 0 CA-C-O 121.605 0.716 . . . . 39.75 110.137 -177.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 37.8 m -122.64 138.19 54.67 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 114.747 -1.115 . . . . 43.29 108.373 173.163 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.514 HG11 ' CD1' ' A' ' 88' ' ' TRP . 54.9 t -61.77 130.83 26.5 Favored 'Isoleucine or valine' 0 C--O 1.238 0.464 0 CA-C-O 121.184 0.516 . . . . 48.72 109.957 -175.416 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 85.18 0.26 88.73 Favored Glycine 0 N--CA 1.446 -0.668 0 N-CA-C 115.517 0.967 . . . . 43.02 115.517 178.44 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' VAL . . . . . . . . . . . . . 23.7 t -118.42 112.68 39.21 Favored 'Isoleucine or valine' 0 C--O 1.239 0.502 0 N-CA-C 107.595 -1.261 . . . . 48.12 107.595 -179.365 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' GLU . . . . . 0.488 ' HG2' HD13 ' A' ' 85' ' ' LEU . 20.3 mt-10 -69.45 158.39 35.24 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-O 121.767 0.794 . . . . 79.31 110.515 179.079 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 24.3 p90 -152.95 154.31 34.74 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.536 -0.756 . . . . 47.89 109.924 -178.518 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ASP . . . . . . . . . . . . . 37.9 m-20 -80.25 101.2 8.74 Favored 'General case' 0 C--O 1.233 0.219 0 N-CA-C 108.322 -0.992 . . . . 57.21 108.322 177.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLU . . . . . . . . . . . . . 68.1 tt0 -103.72 120.73 41.53 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 109.455 -0.572 . . . . 44.07 109.455 -178.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' TYR . . . . . . . . . . . . . 47.7 m-85 -93.7 114.31 26.58 Favored 'General case' 0 C--O 1.235 0.337 0 N-CA-C 107.6 -1.259 . . . . 47.48 107.6 169.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 76.5 p -73.68 55.8 0.52 Allowed 'General case' 0 C--O 1.234 0.279 0 C-N-CA 120.821 -0.351 . . . . 47.79 111.698 -174.228 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' LYS . . . . . . . . . . . . . 9.2 ptmm? -63.26 161.98 12.88 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 109.698 -0.482 . . . . 56.0 109.698 178.314 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 54.3 m 60.54 30.16 19.55 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 117.844 0.293 . . . . 52.3 111.781 -176.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' LEU . . . . . . . . . . . . . 10.1 tp -157.54 -94.3 0.03 OUTLIER 'General case' 0 C--O 1.235 0.334 0 N-CA-C 109.698 -0.482 . . . . 44.34 109.698 173.669 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 23.2 p-10 -112.04 -10.6 13.91 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 113.15 0.796 . . . . 42.84 113.15 174.909 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 30.8 t30 59.26 53.7 5.2 Favored 'General case' 0 N--CA 1.465 0.312 0 CA-C-O 121.707 0.765 . . . . 39.76 111.733 173.694 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 74.4 mtt85 -110.05 153.48 24.56 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 115.734 -0.666 . . . . 35.26 109.684 174.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' HIS . . . . . . . . . . . . . 16.9 t-160 -91.51 115.25 27.88 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 109.138 -0.69 . . . . 43.51 109.138 178.097 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' VAL . . . . . . . . . . . . . 29.6 m -129.39 147.38 33.32 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 N-CA-C 108.641 -0.874 . . . . 35.18 108.641 178.328 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 54.7 mttm -93.85 113.42 25.45 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 107.478 -1.305 . . . . 55.4 107.478 171.386 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.425 ' O ' ' HA ' ' A' ' 69' ' ' GLU . . . -103.18 144.75 30.91 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-O 120.909 0.385 . . . . 42.37 110.797 -171.472 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' LEU . . . . . 0.488 HD13 ' HG2' ' A' ' 69' ' ' GLU . 47.0 tp -138.85 127.99 24.0 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 108.747 -0.834 . . . . 47.7 108.747 177.554 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.474 HG22 ' HB2' ' A' ' 95' ' ' CYS . 57.5 t -113.87 129.63 69.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.382 0 N-CA-C 108.608 -0.886 . . . . 46.44 108.608 -177.99 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' THR . . . . . . . . . . . . . 73.5 p -136.01 159.58 41.25 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-O 121.564 0.697 . . . . 45.68 109.498 -178.967 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' TRP . . . . . 0.514 ' CD1' HG11 ' A' ' 66' ' ' VAL . 85.0 m95 -93.35 120.14 33.29 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 115.043 -0.98 . . . . 53.26 109.277 176.124 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 -105.09 91.56 3.85 Favored 'General case' 0 C--N 1.327 -0.39 0 N-CA-C 106.315 -1.735 . . . . 64.69 106.315 171.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' GLY . . . . . . . . . . . . . . . 64.46 -92.13 0.12 Allowed Glycine 0 N--CA 1.449 -0.482 0 N-CA-C 111.152 -0.779 . . . . 58.8 111.152 -172.699 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -125.07 2.14 7.95 Favored 'General case' 0 C--O 1.236 0.381 0 N-CA-C 113.011 0.745 . . . . 59.71 113.011 174.807 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' VAL . . . . . . . . . . . . . 61.3 t -96.9 129.07 47.47 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 108.749 -0.834 . . . . 42.85 108.749 -178.153 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 13.5 tp -85.51 104.8 15.61 Favored 'General case' 0 C--N 1.33 -0.279 0 N-CA-C 108.692 -0.855 . . . . 41.3 108.692 -179.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' VAL . . . . . . . . . . . . . 48.2 t -105.34 135.69 42.4 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 N-CA-C 109.018 -0.734 . . . . 47.01 109.018 -175.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' CYS . . . . . 0.474 ' HB2' HG22 ' A' ' 86' ' ' VAL . 8.3 t -130.23 126.22 36.82 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 109.884 -0.413 . . . . 42.32 109.884 -179.286 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' VAL . . . . . . . . . . . . . 62.0 t -106.43 126.6 62.14 Favored 'Isoleucine or valine' 0 C--O 1.237 0.423 0 N-CA-C 108.163 -1.051 . . . . 38.46 108.163 176.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' GLN . . . . . . . . . . . . . 85.6 mt-30 -110.16 96.87 6.5 Favored 'General case' 0 C--O 1.234 0.254 0 N-CA-C 107.728 -1.212 . . . . 36.25 107.728 179.378 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 13.0 mmtm -82.62 123.35 29.16 Favored 'General case' 0 C--O 1.236 0.362 0 N-CA-C 109.717 -0.475 . . . . 56.16 109.717 -177.633 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . -172.98 -138.15 2.54 Favored Glycine 0 N--CA 1.45 -0.412 0 CA-C-N 116.354 -0.385 . . . . 38.07 112.805 179.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' GLU . . . . . . . . . . . . . 79.3 tt0 -66.6 -61.76 1.81 Allowed 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.604 -0.439 . . . . 45.7 110.902 179.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' LYS . . . . . . . . . . . . . 73.9 mmtt -70.28 134.75 48.29 Favored 'General case' 0 C--O 1.234 0.288 0 CA-C-O 121.136 0.493 . . . . 38.31 110.358 178.303 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -96.72 162.75 13.3 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-O 121.47 0.652 . . . . 63.23 110.161 177.289 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ASN . . . . . 0.471 ' O ' HG22 ' A' ' 120' ' ' THR . 2.8 t30 52.7 46.93 25.78 Favored 'General case' 0 C--N 1.333 -0.109 0 CA-C-N 115.249 -0.887 . . . . 71.84 110.29 -173.378 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ARG . . . . . . . . . . . . . 70.1 ttt180 -114.14 128.94 56.6 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-N 115.476 -0.784 . . . . 34.15 109.542 -177.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' GLY . . . . . . . . . . . . . . . 170.81 -160.19 32.62 Favored Glycine 0 N--CA 1.45 -0.409 0 N-CA-C 109.815 -1.314 . . . . 33.26 109.815 -179.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' TRP . . . . . . . . . . . . . 34.3 p-90 -158.06 156.87 31.83 Favored 'General case' 0 C--N 1.331 -0.221 0 C-N-CA 119.449 -0.901 . . . . 37.75 109.655 175.474 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 99.0 mttt -122.79 128.43 50.44 Favored 'General case' 0 C--O 1.234 0.242 0 CA-C-N 115.137 -0.938 . . . . 45.67 108.67 175.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' LYS . . . . . . . . . . . . . 32.8 ttmt -132.89 113.72 13.21 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 108.662 -0.866 . . . . 40.58 108.662 -172.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' TRP . . . . . . . . . . . . . 19.5 p90 -143.04 157.86 44.14 Favored 'General case' 0 C--N 1.332 -0.17 0 CA-C-O 121.429 0.633 . . . . 43.29 109.91 -178.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ILE . . . . . . . . . . . . . 19.7 mm -99.97 137.28 27.96 Favored 'Isoleucine or valine' 0 C--O 1.237 0.426 0 CA-C-N 115.416 -0.811 . . . . 50.12 108.814 179.383 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -130.63 113.4 14.15 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 108.088 -1.079 . . . . 54.92 108.088 173.257 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' GLY . . . . . . . . . . . . . . . 60.82 -99.96 0.21 Allowed Glycine 0 N--CA 1.449 -0.467 0 CA-C-N 116.265 -0.425 . . . . 67.15 112.543 -177.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -121.75 11.37 10.44 Favored 'General case' 0 C--O 1.237 0.432 0 N-CA-C 112.416 0.524 . . . . 67.65 112.416 178.772 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -118.42 148.25 42.74 Favored 'General case' 0 C--O 1.236 0.363 0 CA-C-N 118.416 0.553 . . . . 53.68 110.692 -175.361 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.572 ' HB3' ' HB2' ' A' ' 130' ' ' PHE . 17.2 tp -102.06 120.71 40.88 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-N 115.24 -0.891 . . . . 40.05 109.006 179.14 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' TYR . . . . . . . . . . . . . 33.1 m-85 -105.51 126.31 51.98 Favored 'General case' 0 C--O 1.238 0.477 0 N-CA-C 109.429 -0.582 . . . . 48.62 109.429 -179.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' LEU . . . . . . . . . . . . . 24.6 tp -131.33 122.92 27.23 Favored 'General case' 0 C--O 1.233 0.23 0 N-CA-C 108.691 -0.855 . . . . 35.61 108.691 -179.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' GLU . . . . . . . . . . . . . 2.6 mt-10 -118.72 108.86 15.4 Favored 'General case' 0 C--O 1.237 0.403 0 N-CA-C 108.31 -0.996 . . . . 49.41 108.31 -179.353 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' LEU . . . . . . . . . . . . . 3.9 mt -88.17 129.93 35.19 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 108.997 -0.742 . . . . 33.58 108.997 175.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' THR . . . . . 0.471 HG22 ' O ' ' A' ' 103' ' ' ASN . 3.6 m -125.2 131.35 53.19 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 109.622 -0.51 . . . . 44.77 109.622 -171.26 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' CYS . . . . . . . . . . . . . 53.9 t -150.42 113.31 4.79 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 108.091 -1.077 . . . . 38.42 108.091 176.123 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' GLY . . . . . . . . . . . . . . . 60.78 -110.22 2.87 Favored Glycine 0 N--CA 1.45 -0.41 0 O-C-N 123.354 0.408 . . . . 37.1 113.138 -179.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' ASP . . . . . . . . . . . . . 42.1 p-10 -112.44 16.93 19.7 Favored 'General case' 0 C--O 1.235 0.318 0 N-CA-C 112.166 0.432 . . . . 55.0 112.166 177.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' GLN . . . . . . . . . . . . . 99.1 mm-40 -116.46 131.88 56.83 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 109.254 -0.647 . . . . 43.53 109.254 179.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' VAL . . . . . . . . . . . . . 17.3 t -133.35 122.68 45.22 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 N-CA-C 108.121 -1.066 . . . . 39.17 108.121 -179.305 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -105.51 135.44 46.91 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 123.385 0.674 . . . . 32.38 109.567 177.285 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' ARG . . . . . . . . . . . . . 22.8 ttp180 -108.74 131.55 54.83 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 109.68 -0.489 . . . . 40.93 109.68 -179.786 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' GLN . . . . . . . . . . . . . 79.5 mt-30 -133.61 120.98 21.39 Favored 'General case' 0 C--O 1.237 0.405 0 N-CA-C 108.247 -1.02 . . . . 37.84 108.247 -179.971 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' VAL . . . . . . . . . . . . . 46.0 t -111.14 133.85 55.35 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 N-CA-C 108.324 -0.991 . . . . 38.07 108.324 179.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' PHE . . . . . 0.594 ' HB3' ' HB3' ' C' ' 8' ' ' TRP . 60.8 m-85 -119.49 141.97 48.7 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 123.779 0.832 . . . . 38.43 109.815 -175.721 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' LYS . . . . . . . . . . . . . 63.3 pttt -100.96 149.13 24.24 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 115.924 -0.58 . . . . 54.67 109.729 173.089 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' LYS . . . . . . . . . . . . . 21.6 tttm -82.89 135.66 34.85 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.798 -0.637 . . . . 50.4 110.748 -176.821 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' LYS . . . . . . . . . . . . . 20.3 mtmt . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 115.826 -0.625 . . . . 63.04 110.821 177.206 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 1' ' ' THR . . . . . . . . . . . . . 5.2 t . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.858 0.361 . . . . 47.84 111.405 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 86.6 mtt180 -98.38 -17.23 18.95 Favored 'General case' 0 C--O 1.236 0.374 0 N-CA-C 113.046 0.758 . . . . 43.49 113.046 175.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 3' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -75.1 121.32 21.86 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 109.224 -0.658 . . . . 54.93 109.224 178.388 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 -119.85 20.57 12.2 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 116.227 -0.442 . . . . 41.97 112.0 -175.532 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 5' ' ' ASN . . . . . . . . . . . . . 11.0 m-80 -65.3 156.12 33.07 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 121.772 0.796 . . . . 39.53 110.653 179.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 6' ' ' GLY . . . . . . . . . . . . . . . 118.94 -173.62 15.01 Favored Glycine 0 N--CA 1.449 -0.452 0 CA-C-O 122.113 0.84 . . . . 42.93 112.33 170.016 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 91.6 m -111.65 120.31 41.62 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 108.907 -0.775 . . . . 44.78 108.907 -177.46 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' TRP . . . . . 0.415 ' HB3' ' HB3' ' D' ' 130' ' ' PHE . 6.7 m95 -118.62 132.53 56.19 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 109.408 -0.59 . . . . 50.45 109.408 -176.245 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' GLU . . . . . . . . . . . . . 3.1 mm-40 -107.3 139.28 42.01 Favored 'General case' 0 C--N 1.33 -0.282 0 N-CA-C 110.074 -0.343 . . . . 66.26 110.074 178.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' MET . . . . . . . . . . . . . 29.2 ttm -67.62 135.89 53.56 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.916 -0.584 . . . . 48.65 111.161 -175.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' GLU . . . . . 0.488 ' OE2' ' HB2' ' D' ' 131' ' ' LYS . 20.7 mt-10 -104.45 -64.0 1.16 Allowed 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.728 -0.669 . . . . 66.93 111.864 175.595 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 86.2 p -119.28 157.14 28.66 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-O 121.414 0.626 . . . . 45.32 109.688 178.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' ASN . . . . . . . . . . . . . 48.9 t30 -154.15 89.45 1.29 Allowed 'General case' 0 N--CA 1.466 0.325 0 N-CA-C 107.521 -1.288 . . . . 42.83 107.521 -176.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 5.3 tt0 -95.23 138.56 32.77 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.729 -0.669 . . . . 53.98 110.573 -177.5 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' ASN . . . . . . . . . . . . . 51.2 t30 58.58 33.14 22.86 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.806 -0.633 . . . . 38.56 111.982 175.265 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' PHE . . . . . . . . . . . . . 6.2 t80 -68.15 -37.1 80.68 Favored 'General case' 0 C--O 1.238 0.471 0 C-N-CA 120.126 -0.629 . . . . 41.31 110.862 174.8 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' GLU . . . . . . . . . . . . . 87.3 tt0 -69.48 -31.04 69.08 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 120.674 -0.41 . . . . 66.6 111.735 179.146 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.68 -40.52 76.63 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 119.751 -1.214 . . . . 36.47 112.209 174.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -65.64 -41.17 92.93 Favored 'General case' 0 C--O 1.236 0.39 0 O-C-N 122.355 -0.497 . . . . 36.09 111.246 177.523 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' MET . . . . . . . . . . . . . 73.2 mtm -68.61 -37.59 79.88 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.013 -0.675 . . . . 49.26 111.186 177.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' LYS . . . . . . . . . . . . . 20.1 tttt -67.96 -30.44 69.73 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 120.518 -0.473 . . . . 49.12 111.562 178.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.32 -25.29 65.94 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.102 -0.639 . . . . 32.63 111.477 174.718 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' LEU . . . . . . . . . . . . . 65.2 mt -89.77 5.67 45.01 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 112.632 0.605 . . . . 34.14 112.632 176.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 58.75 39.58 24.07 Favored 'General case' 0 N--CA 1.465 0.317 0 CA-C-O 121.317 0.58 . . . . 38.01 111.232 -179.313 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' ILE . . . . . . . . . . . . . 38.7 mm -73.4 148.99 8.35 Favored 'Isoleucine or valine' 0 C--O 1.238 0.499 0 CA-C-O 121.541 0.686 . . . . 40.43 109.883 -178.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -46.1 130.63 10.13 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 115.63 -0.714 . . . . 57.17 111.362 175.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' PHE . . . . . . . . . . . . . 58.9 t80 -54.47 -58.35 7.81 Favored 'General case' 0 C--O 1.238 0.477 0 CA-C-N 115.691 -0.686 . . . . 55.07 111.932 -172.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' CYS . . . . . . . . . . . . . 14.3 m -62.07 -30.61 71.11 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.404 -0.519 . . . . 53.29 111.622 -179.785 -82.235 -45.32 -70.379 104.387 2.032 104.247 -54.445 -73.237 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' THR . . . . . 0.494 HG23 ' HZ ' ' D' ' 57' ' ' PHE . 88.3 m -64.12 -43.41 95.36 Favored 'General case' 0 C--O 1.238 0.468 0 C-N-CA 120.342 -0.543 . . . . 53.69 111.118 177.308 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' ARG . . . . . 0.412 ' O ' HG23 ' B' ' 34' ' ' VAL . 19.6 mtm-85 -61.34 -45.96 92.22 Favored 'General case' 0 C--O 1.237 0.422 0 C-N-CA 120.089 -0.644 . . . . 45.33 110.742 172.209 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' LYS . . . . . . . . . . . . . 33.9 mmtt -60.76 -32.54 71.84 Favored 'General case' 0 C--O 1.237 0.398 0 N-CA-C 112.136 0.421 . . . . 56.26 112.136 -175.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' ILE . . . . . . . . . . . . . 7.3 mm -84.18 -39.36 14.61 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 C-N-CA 120.447 -0.501 . . . . 47.33 111.273 176.758 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' ALA . . . . . . . . . . . . . . . -67.32 -3.13 7.24 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 113.024 0.75 . . . . 48.05 113.024 176.367 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' VAL . . . . . 0.412 HG23 ' O ' ' B' ' 30' ' ' ARG . 44.8 t -54.93 -59.04 2.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.417 0 CA-C-N 118.605 0.639 . . . . 57.1 110.336 175.094 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' ARG . . . . . 0.4 ' O ' HD23 ' B' ' 36' ' ' LEU . 0.6 OUTLIER -123.26 86.25 2.55 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 107.768 -1.197 . . . . 69.79 107.768 -177.491 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' LEU . . . . . 0.467 HD22 ' HA ' ' B' ' 57' ' ' PHE . 5.3 mt -131.94 153.52 50.2 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 108.163 -1.051 . . . . 59.58 108.163 174.119 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' THR . . . . . . . . . . . . . 2.3 m -88.12 123.93 33.28 Favored 'General case' 0 C--N 1.332 -0.183 0 C-N-CA 120.085 -0.646 . . . . 70.05 109.291 -173.938 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -109.01 130.68 55.48 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 109.868 -0.419 . . . . 57.58 109.868 -178.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' THR . . . . . . . . . . . . . 27.4 m -123.56 120.39 32.72 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 108.469 -0.937 . . . . 52.22 108.469 175.114 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' LYS . . . . . 0.547 ' HZ3' ' H12' ' D' ' 203' ' ' RET . 13.8 ttmt -114.36 100.68 8.51 Favored 'General case' 0 C--N 1.329 -0.319 0 C-N-CA 124.289 1.036 . . . . 56.06 108.545 -172.192 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' VAL . . . . . . . . . . . . . 43.1 t -91.75 119.7 39.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.331 0 N-CA-C 108.027 -1.101 . . . . 43.25 108.027 173.201 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' ILE . . . . . . . . . . . . . 54.5 mt -116.61 124.23 72.5 Favored 'Isoleucine or valine' 0 C--O 1.24 0.559 0 N-CA-C 108.446 -0.946 . . . . 39.11 108.446 -178.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' ASP . . . . . . . . . . . . . 6.5 t70 -114.26 110.08 19.37 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 107.522 -1.288 . . . . 58.12 107.522 175.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -121.95 127.17 50.06 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 122.995 0.518 . . . . 40.9 110.089 -173.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' ASP . . . . . . . . . . . . . 27.2 t0 -121.58 100.76 7.2 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 106.74 -1.578 . . . . 69.04 106.74 172.609 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' GLY . . . . . . . . . . . . . . . 63.51 -109.25 2.62 Favored Glycine 0 N--CA 1.449 -0.491 0 C-N-CA 121.365 -0.445 . . . . 42.58 112.108 -175.546 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -103.63 -3.73 24.75 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 112.653 0.612 . . . . 49.71 112.653 175.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' ASN . . . . . . . . . . . . . 5.8 m120 -83.78 116.76 22.86 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 109.338 -0.615 . . . . 59.98 109.338 177.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' PHE . . . . . . . . . . . . . 36.1 m-85 -112.96 140.4 47.8 Favored 'General case' 0 C--O 1.236 0.359 0 C-N-CA 122.86 0.464 . . . . 41.9 110.421 -176.31 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' LYS . . . . . . . . . . . . . 12.6 mttp -136.66 108.69 7.17 Favored 'General case' 0 C--O 1.236 0.389 0 N-CA-C 107.664 -1.235 . . . . 55.59 107.664 169.521 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -115.05 123.58 49.41 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 123.505 0.722 . . . . 60.55 109.5 -172.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' LYS . . . . . 0.68 ' HG3' ' OD2' ' D' ' 61' ' ' ASP . 1.6 mptp? -118.1 123.28 45.21 Favored 'General case' 0 C--N 1.331 -0.215 0 N-CA-C 108.389 -0.967 . . . . 60.96 108.389 178.45 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' THR . . . . . 0.452 ' OG1' H182 ' D' ' 203' ' ' RET . 1.3 p -125.49 114.23 18.52 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 109.151 -0.685 . . . . 61.25 109.151 -178.676 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' THR . . . . . . . . . . . . . 1.2 t -98.92 129.84 45.27 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 109.68 -0.489 . . . . 56.8 109.68 177.289 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 39.6 t -106.81 88.43 2.75 Favored 'General case' 0 C--N 1.329 -0.284 0 N-CA-C 107.785 -1.191 . . . . 58.37 107.785 179.355 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' THR . . . . . . . . . . . . . 17.0 m -65.69 127.6 32.58 Favored 'General case' 0 C--O 1.243 0.712 0 CA-C-N 115.786 -0.643 . . . . 71.79 110.646 175.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' PHE . . . . . 0.467 ' HA ' HD22 ' B' ' 36' ' ' LEU . 36.7 t80 -66.06 -108.68 0.0 OUTLIER 'General case' 0 C--O 1.235 0.328 0 C-N-CA 126.034 1.734 . . . . 73.25 110.103 173.909 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 4.3 mmt85 -103.25 139.98 37.99 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 109.726 -0.472 . . . . 71.08 109.726 176.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' ASN . . . . . 0.443 ' HA ' ' O ' ' D' ' 53' ' ' THR . 2.4 p30 -130.26 116.29 18.17 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 107.211 -1.403 . . . . 73.93 107.211 166.866 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' TYR . . . . . . . . . . . . . 46.3 t80 -112.72 101.07 9.19 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 108.899 -0.778 . . . . 57.58 108.899 -169.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' ASP . . . . . . . . . . . . . 7.5 m-20 -92.53 133.13 36.23 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 109.425 -0.583 . . . . 68.58 109.425 175.711 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' VAL . . . . . . . . . . . . . 2.9 p -149.32 126.66 2.55 Favored 'Isoleucine or valine' 0 C--O 1.235 0.299 0 N-CA-C 108.106 -1.072 . . . . 64.02 108.106 175.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' ASP . . . . . 0.428 ' N ' ' OD1' ' B' ' 63' ' ' ASP . 1.7 p-10 -120.65 141.4 50.4 Favored 'General case' 0 C--N 1.329 -0.305 0 N-CA-C 109.213 -0.662 . . . . 75.27 109.213 179.193 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' PHE . . . . . . . . . . . . . 52.7 p90 -158.99 156.32 29.18 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-O 121.445 0.64 . . . . 57.96 109.64 -174.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' THR . . . . . . . . . . . . . 61.8 m -107.23 117.71 34.79 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 107.651 -1.24 . . . . 64.28 107.651 169.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' VAL . . . . . . . . . . . . . 2.3 p -61.36 124.36 15.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.429 0 N-CA-C 109.073 -0.714 . . . . 51.61 109.073 -176.306 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' GLY . . . . . 0.431 ' N ' ' O ' ' B' ' 86' ' ' VAL . . . 105.59 -3.5 39.56 Favored Glycine 0 N--CA 1.449 -0.457 0 CA-C-O 119.023 -0.876 . . . . 53.87 114.616 -174.453 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' VAL . . . . . . . . . . . . . 34.6 t -120.49 120.98 64.29 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 CA-C-N 118.534 1.167 . . . . 52.41 107.947 -179.948 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' GLU . . . . . . . . . . . . . 8.7 tt0 -78.62 125.97 30.1 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 110.057 -0.349 . . . . 59.26 110.057 -178.067 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 27.7 p90 -128.3 150.55 50.02 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-N 116.04 -0.527 . . . . 56.94 109.756 -176.809 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' ASP . . . . . 0.696 ' OD1' ' N ' ' B' ' 71' ' ' ASP . 17.3 t70 -81.81 113.06 19.51 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 108.608 -0.886 . . . . 52.53 108.608 176.968 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' GLU . . . . . . . . . . . . . 81.5 tt0 -101.95 119.05 38.17 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 109.156 -0.683 . . . . 48.62 109.156 -179.181 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 73' ' ' TYR . . . . . . . . . . . . . 79.1 t80 -96.94 106.06 18.31 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 107.575 -1.269 . . . . 42.4 107.575 172.101 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 74' ' ' THR . . . . . . . . . . . . . 69.5 p -77.23 67.14 3.14 Favored 'General case' 0 CA--C 1.53 0.203 0 CA-C-O 122.494 1.14 . . . . 38.69 109.938 -173.411 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 75' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -60.79 152.01 28.15 Favored 'General case' 0 C--O 1.234 0.267 0 CA-C-N 114.872 -1.058 . . . . 54.85 109.904 173.848 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 76' ' ' SER . . . . . . . . . . . . . 52.9 m 70.35 -16.88 0.29 Allowed 'General case' 0 C--O 1.235 0.3 0 C-N-CA 123.816 0.846 . . . . 64.32 112.05 178.228 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 77' ' ' LEU . . . . . . . . . . . . . 9.5 mt -95.02 -100.95 0.15 Allowed 'General case' 0 C--O 1.235 0.311 0 N-CA-C 110.231 -0.285 . . . . 53.56 110.231 175.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 78' ' ' ASP . . . . . . . . . . . . . 16.7 p-10 -108.52 -2.69 18.72 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 112.806 0.669 . . . . 43.24 112.806 175.953 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 79' ' ' ASN . . . . . . . . . . . . . 2.6 m-80 55.34 66.64 1.17 Allowed 'General case' 0 N--CA 1.464 0.273 0 CA-C-O 122.519 1.152 . . . . 50.73 110.929 177.475 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 80' ' ' ARG . . . . . 0.409 ' NH2' ' OD2' ' D' ' 24' ' ' ASP . 75.4 mtt85 -133.22 149.16 52.02 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-N 114.143 -1.389 . . . . 39.36 109.678 178.76 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 81' ' ' HIS . . . . . 0.589 ' H ' ' H32' ' B' ' 202' ' ' GOL . 56.3 m80 -92.38 126.02 37.28 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 115.601 -0.727 . . . . 47.09 109.204 173.757 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 82' ' ' VAL . . . . . 1.038 HG11 ' NH2' ' B' ' 104' ' ' ARG . 20.2 m -128.72 154.39 39.54 Favored 'Isoleucine or valine' 0 C--O 1.235 0.312 0 N-CA-C 108.969 -0.752 . . . . 50.1 108.969 177.569 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 83' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt -93.35 96.89 10.23 Favored 'General case' 0 C--N 1.328 -0.334 0 N-CA-C 106.614 -1.624 . . . . 50.05 106.614 169.454 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -98.17 129.08 44.95 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 116.139 -0.482 . . . . 47.86 109.887 -174.199 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 85' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -129.39 132.76 47.1 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 108.17 -1.048 . . . . 48.17 108.17 178.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 86' ' ' VAL . . . . . 0.432 HG22 ' HB2' ' B' ' 95' ' ' CYS . 43.7 t -115.51 126.31 73.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 N-CA-C 108.628 -0.879 . . . . 54.65 108.628 -176.649 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 87' ' ' THR . . . . . . . . . . . . . 1.6 p -118.15 157.08 27.59 Favored 'General case' 0 C--O 1.238 0.453 0 C-N-CA 123.707 0.803 . . . . 51.63 110.108 174.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 88' ' ' TRP . . . . . . . . . . . . . 29.7 m95 -89.55 138.35 31.53 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 114.722 -1.126 . . . . 52.14 109.414 167.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 89' ' ' GLU . . . . . . . . . . . . . 65.2 mt-10 -133.07 80.16 1.87 Allowed 'General case' 0 C--O 1.235 0.335 0 N-CA-C 106.223 -1.769 . . . . 48.98 106.223 174.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 90' ' ' GLY . . . . . . . . . . . . . . . 58.35 -99.07 0.11 Allowed Glycine 0 N--CA 1.448 -0.51 0 CA-C-N 115.824 -0.626 . . . . 54.95 112.788 -176.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 91' ' ' ASP . . . . . . . . . . . . . 8.6 t70 -87.93 -30.7 19.88 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 112.505 0.558 . . . . 64.06 112.505 178.278 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 92' ' ' VAL . . . . . . . . . . . . . 10.3 t -93.92 133.62 34.34 Favored 'Isoleucine or valine' 0 C--O 1.236 0.372 0 CA-C-N 118.049 0.386 . . . . 49.67 110.015 -167.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 18.8 tp -93.26 111.05 22.59 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 107.884 -1.154 . . . . 44.97 107.884 172.333 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 94' ' ' VAL . . . . . 0.797 HG22 ' HG2' ' B' ' 107' ' ' LYS . 5.1 t -107.14 142.38 20.04 Favored 'Isoleucine or valine' 0 C--O 1.235 0.297 0 N-CA-C 108.536 -0.912 . . . . 48.56 108.536 -172.284 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 95' ' ' CYS . . . . . 0.432 ' HB2' HG22 ' B' ' 86' ' ' VAL . 6.8 t -136.86 128.78 29.22 Favored 'General case' 0 C--O 1.237 0.419 0 N-CA-C 109.919 -0.401 . . . . 48.42 109.919 178.888 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 96' ' ' VAL . . . . . . . . . . . . . 16.4 t -108.38 127.27 64.86 Favored 'Isoleucine or valine' 0 C--O 1.237 0.409 0 N-CA-C 107.985 -1.117 . . . . 41.36 107.985 175.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 97' ' ' GLN . . . . . 0.992 ' HB2' ' HD2' ' B' ' 104' ' ' ARG . 39.3 mt-30 -110.74 87.68 2.59 Favored 'General case' 0 C--N 1.329 -0.288 0 N-CA-C 107.818 -1.178 . . . . 44.34 107.818 -179.266 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 25.1 mmtt -73.58 119.76 18.24 Favored 'General case' 0 C--O 1.236 0.348 0 CA-C-N 116.044 -0.526 . . . . 52.79 109.876 -178.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 99' ' ' GLY . . . . . . . . . . . . . . . -168.62 -136.98 2.15 Favored Glycine 0 N--CA 1.448 -0.522 0 C-N-CA 120.516 -0.85 . . . . 39.14 114.521 -179.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' GLU . . . . . . . . . . . . . 32.7 tp10 -70.03 -38.98 76.01 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.756 -0.377 . . . . 35.8 111.456 -176.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 101' ' ' LYS . . . . . . . . . . . . . 25.5 mmtt -95.34 142.32 27.87 Favored 'General case' 0 C--O 1.235 0.31 0 O-C-N 122.039 -0.413 . . . . 41.52 110.372 -177.469 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 102' ' ' GLU . . . . . . . . . . . . . 46.9 mt-10 -86.04 148.6 25.66 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.87 -0.604 . . . . 76.71 110.564 179.215 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 103' ' ' ASN . . . . . . . . . . . . . 11.0 t-20 53.5 52.29 13.62 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.924 0.869 . . . . 48.13 111.057 177.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 104' ' ' ARG . . . . . 1.038 ' NH2' HG11 ' B' ' 82' ' ' VAL . 1.1 tmm_? -114.16 121.67 44.47 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 108.892 -0.781 . . . . 69.75 108.892 -179.338 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 105' ' ' GLY . . . . . . . . . . . . . . . -179.03 -161.25 26.3 Favored Glycine 0 N--CA 1.449 -0.436 0 N-CA-C 110.039 -1.224 . . . . 40.94 110.039 -179.393 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 106' ' ' TRP . . . . . 0.576 ' HB3' HD23 ' B' ' 119' ' ' LEU . 42.6 p-90 -160.66 159.69 30.66 Favored 'General case' 0 CA--C 1.52 -0.193 0 C-N-CA 119.358 -0.937 . . . . 46.28 110.149 177.046 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 107' ' ' LYS . . . . . 0.797 ' HG2' HG22 ' B' ' 94' ' ' VAL . 98.0 mttt -126.91 141.48 51.8 Favored 'General case' 0 C--N 1.331 -0.226 0 CA-C-N 114.998 -1.001 . . . . 51.89 108.461 175.439 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 108' ' ' LYS . . . . . . . . . . . . . 17.6 ttmt -139.92 119.44 13.11 Favored 'General case' 0 C--O 1.234 0.281 0 N-CA-C 108.921 -0.77 . . . . 48.12 108.921 -173.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 109' ' ' TRP . . . . . . . . . . . . . 25.4 p90 -147.37 -179.21 6.69 Favored 'General case' 0 C--O 1.233 0.219 0 CA-C-O 121.508 0.67 . . . . 50.83 109.682 -178.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 110' ' ' ILE . . . . . . . . . . . . . 13.5 mm -122.63 139.78 48.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.358 0 N-CA-C 108.75 -0.833 . . . . 60.24 108.75 -178.053 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 111' ' ' GLU . . . . . 0.599 ' HB2' ' CE1' ' B' ' 116' ' ' TYR . 23.6 mt-10 -128.5 53.12 1.85 Allowed 'General case' 0 C--N 1.331 -0.199 0 CA-C-O 121.815 0.817 . . . . 70.69 109.997 174.423 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 112' ' ' GLY . . . . . . . . . . . . . . . 78.41 89.22 0.4 Allowed Glycine 0 N--CA 1.45 -0.419 0 O-C-N 121.867 -0.521 . . . . 70.6 113.49 -179.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 113' ' ' ASP . . . . . . . . . . . . . . . 61.17 4.91 0.95 Allowed 'General case' 0 C--O 1.235 0.332 0 C-N-CA 123.786 0.835 . . . . 67.7 112.893 175.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 114' ' ' LYS . . . . . . . . . . . . . 31.4 mttt -127.59 125.24 39.91 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 108.574 -0.899 . . . . 60.09 108.574 178.233 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 115' ' ' LEU . . . . . . . . . . . . . 6.1 tt -94.15 139.1 31.43 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 109.322 -0.622 . . . . 59.58 109.322 178.608 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 116' ' ' TYR . . . . . 0.599 ' CE1' ' HB2' ' B' ' 111' ' ' GLU . 13.5 m-85 -121.67 127.96 51.35 Favored 'General case' 0 C--O 1.239 0.523 0 N-CA-C 108.721 -0.844 . . . . 55.69 108.721 -177.905 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 117' ' ' LEU . . . . . . . . . . . . . 56.4 tp -126.05 118.4 25.22 Favored 'General case' 0 C--O 1.234 0.241 0 N-CA-C 108.902 -0.777 . . . . 44.74 108.902 -177.944 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 118' ' ' GLU . . . . . . . . . . . . . 84.2 tt0 -110.99 99.64 8.48 Favored 'General case' 0 C--N 1.326 -0.44 0 N-CA-C 108.115 -1.068 . . . . 54.96 108.115 -179.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 119' ' ' LEU . . . . . 0.576 HD23 ' HB3' ' B' ' 106' ' ' TRP . 7.2 mt -84.86 143.16 29.22 Favored 'General case' 0 C--O 1.234 0.253 0 N-CA-C 109.549 -0.537 . . . . 41.07 109.549 173.705 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 120' ' ' THR . . . . . 0.422 ' O ' ' HA ' ' B' ' 104' ' ' ARG . 9.0 t -138.36 141.12 39.68 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-O 120.968 0.413 . . . . 47.61 110.259 -178.301 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 121' ' ' CYS . . . . . . . . . . . . . 49.9 t -154.78 118.32 4.55 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 108.05 -1.092 . . . . 46.15 108.05 175.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 122' ' ' GLY . . . . . . . . . . . . . . . 63.41 -127.18 36.96 Favored Glycine 0 C--O 1.237 0.299 0 N-CA-C 110.406 -1.078 . . . . 46.53 110.406 -176.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 123' ' ' ASP . . . . . . . . . . . . . 43.8 p30 -97.56 8.51 44.5 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 112.304 0.483 . . . . 59.96 112.304 174.664 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 124' ' ' GLN . . . . . . . . . . . . . 91.8 mm-40 -99.94 129.16 45.98 Favored 'General case' 0 C--O 1.237 0.446 0 N-CA-C 109.859 -0.423 . . . . 47.24 109.859 -177.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 125' ' ' VAL . . . . . . . . . . . . . 61.2 t -122.29 136.7 58.28 Favored 'Isoleucine or valine' 0 C--O 1.236 0.368 0 N-CA-C 108.457 -0.942 . . . . 49.69 108.457 179.007 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 126' ' ' CYS . . . . . . . . . . . . . 7.2 t -127.49 127.2 43.62 Favored 'General case' 0 C--N 1.33 -0.278 0 N-CA-C 108.319 -0.993 . . . . 42.21 108.319 177.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 127' ' ' ARG . . . . . . . . . . . . . 1.1 ttt-85 -117.12 136.56 52.92 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 110.046 -0.353 . . . . 67.28 110.046 179.349 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 128' ' ' GLN . . . . . . . . . . . . . 64.1 mt-30 -128.18 133.56 48.92 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 124.115 0.966 . . . . 45.09 108.601 -173.61 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 129' ' ' VAL . . . . . . . . . . . . . 5.4 m -108.36 146.15 14.53 Favored 'Isoleucine or valine' 0 C--O 1.237 0.414 0 N-CA-C 107.915 -1.142 . . . . 44.82 107.915 171.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 130' ' ' PHE . . . . . 0.712 ' HB3' ' HB3' ' D' ' 8' ' ' TRP . 75.8 m-85 -135.0 122.4 21.79 Favored 'General case' 0 C--O 1.237 0.42 0 N-CA-C 108.489 -0.93 . . . . 53.39 108.489 -178.701 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 131' ' ' LYS . . . . . 0.4 ' HE2' ' OE1' ' D' ' 11' ' ' GLU . 49.6 mttt -83.35 145.34 29.09 Favored 'General case' 0 C--O 1.235 0.302 0 CA-C-O 121.306 0.574 . . . . 52.5 109.524 166.513 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 132' ' ' LYS . . . . . . . . . . . . . 68.7 tttt -88.14 153.66 21.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 115.804 -0.634 . . . . 63.79 110.356 179.537 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 133' ' ' LYS . . . . . . . . . . . . . 23.2 pttt . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 115.66 -0.7 . . . . 70.81 110.881 177.306 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 1' ' ' THR . . . . . . . . . . . . . 1.4 t . . . . . 0 C--O 1.232 0.147 0 CA-C-O 120.811 0.338 . . . . 43.52 111.242 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 2' ' ' ARG . . . . . . . . . . . . . 96.2 mtt180 -95.18 -6.72 41.05 Favored 'General case' 0 C--O 1.236 0.355 0 N-CA-C 113.189 0.811 . . . . 44.0 113.189 178.782 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 3' ' ' ASP . . . . . . . . . . . . . 50.7 t0 -78.06 105.34 9.21 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 109.082 -0.711 . . . . 52.32 109.082 -179.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 4' ' ' GLN . . . . . . . . . . . . . 77.0 mt-30 -106.65 18.14 22.3 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 122.83 0.452 . . . . 37.67 112.184 179.013 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 5' ' ' ASN . . . . . 0.411 ' ND2' ' HB3' ' C' ' 44' ' ' GLN . 10.0 m-80 -63.15 148.48 47.88 Favored 'General case' 0 C--O 1.234 0.271 0 CA-C-O 121.49 0.662 . . . . 43.31 110.856 -178.834 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 6' ' ' GLY . . . . . . . . . . . . . . . 124.99 -178.68 16.43 Favored Glycine 0 N--CA 1.448 -0.532 0 CA-C-O 122.372 0.985 . . . . 39.43 112.353 167.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 7' ' ' THR . . . . . . . . . . . . . 52.8 m -104.43 120.14 40.56 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 114.215 -0.992 . . . . 36.16 108.928 -179.177 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 8' ' ' TRP . . . . . 0.594 ' HB3' ' HB3' ' A' ' 130' ' ' PHE . 30.8 m95 -114.24 149.6 35.6 Favored 'General case' 0 N--CA 1.452 -0.355 0 C-N-CA 123.011 0.525 . . . . 36.16 110.258 -177.049 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 9' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -127.2 131.99 50.54 Favored 'General case' 0 C--O 1.235 0.331 0 N-CA-C 108.952 -0.758 . . . . 60.31 108.952 177.239 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 10' ' ' MET . . . . . . . . . . . . . 36.9 ttm -71.73 131.67 43.45 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 116.112 -0.494 . . . . 32.06 110.742 -175.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 11' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -118.22 -5.27 10.9 Favored 'General case' 0 C--O 1.237 0.442 0 N-CA-C 113.528 0.936 . . . . 43.79 113.528 175.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 12' ' ' SER . . . . . . . . . . . . . 11.4 p -152.07 143.69 23.54 Favored 'General case' 0 C--O 1.234 0.251 0 N-CA-C 108.594 -0.891 . . . . 38.93 108.594 176.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 13' ' ' ASN . . . . . . . . . . . . . 50.3 t30 -156.18 95.55 1.61 Allowed 'General case' 0 C--O 1.234 0.28 0 N-CA-C 107.419 -1.326 . . . . 35.13 107.419 -177.409 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 14' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -111.18 145.21 39.07 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 123.641 0.588 . . . . 40.47 110.333 -176.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 15' ' ' ASN . . . . . . . . . . . . . 49.9 t30 56.62 29.44 15.64 Favored 'General case' 0 N--CA 1.464 0.257 0 C-N-CA 123.63 0.772 . . . . 35.39 112.032 -178.243 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 16' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -64.95 -33.68 76.61 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 119.795 -0.762 . . . . 47.02 110.853 169.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 pm0 -69.45 -31.42 69.73 Favored 'General case' 0 C--O 1.234 0.247 0 N-CA-C 112.056 0.391 . . . . 78.54 112.056 -177.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 18' ' ' GLY . . . . . . . . . . . . . . . -75.56 -51.17 7.45 Favored Glycine 0 C--N 1.333 0.378 0 C-N-CA 121.206 -0.521 . . . . 36.22 112.244 178.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 19' ' ' TYR . . . . . . . . . . . . . 71.6 t80 -54.15 -31.22 51.91 Favored 'General case' 0 C--O 1.236 0.361 0 C-N-CA 120.77 -0.372 . . . . 35.65 111.308 172.03 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 20' ' ' MET . . . . . 0.401 ' HG2' HD13 ' C' ' 25' ' ' ILE . 55.5 mtm -79.68 -26.51 40.96 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.016 -0.673 . . . . 37.02 112.134 175.957 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 21' ' ' LYS . . . . . . . . . . . . . 38.0 mttp -68.84 -31.82 71.06 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.048 -0.661 . . . . 57.0 111.217 173.24 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 22' ' ' ALA . . . . . . . . . . . . . . . -67.5 -36.64 81.45 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.301 -0.56 . . . . 32.35 111.524 179.579 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 23' ' ' LEU . . . . . . . . . . . . . 92.2 mt -88.93 4.25 48.65 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 113.201 0.815 . . . . 32.23 113.201 -177.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 24' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 61.13 40.88 14.34 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 123.127 0.571 . . . . 39.28 111.912 174.159 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 25' ' ' ILE . . . . . 0.401 HD13 ' HG2' ' C' ' 20' ' ' MET . 2.8 mp -74.85 149.58 7.25 Favored 'Isoleucine or valine' 0 C--O 1.239 0.541 0 CA-C-O 121.491 0.663 . . . . 36.02 109.63 178.425 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 26' ' ' ASP . . . . . 0.475 ' OD1' ' N ' ' C' ' 27' ' ' PHE . 2.1 t0 -48.09 146.68 2.48 Favored 'General case' 0 C--O 1.234 0.25 0 CA-C-N 115.485 -0.78 . . . . 39.83 111.01 -179.024 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 27' ' ' PHE . . . . . 0.475 ' N ' ' OD1' ' C' ' 26' ' ' ASP . 82.9 t80 -57.75 -59.52 5.1 Favored 'General case' 0 C--O 1.237 0.436 0 CA-C-N 114.975 -1.011 . . . . 31.92 111.438 -173.949 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 28' ' ' CYS . . . . . . . . . . . . . 10.0 m -63.63 -31.14 72.22 Favored 'General case' 0 C--O 1.237 0.431 0 C-N-CA 120.416 -0.514 . . . . 35.32 111.766 -176.984 -83.628 -42.235 -74.152 103.615 2.032 103.967 -48.497 -83.347 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 29' ' ' THR . . . . . . . . . . . . . 23.2 m -64.14 -34.81 78.92 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 120.282 -0.567 . . . . 36.33 111.188 174.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 30' ' ' ARG . . . . . . . . . . . . . 41.9 mtm-85 -70.46 -40.69 73.54 Favored 'General case' 0 C--O 1.236 0.384 0 C-N-CA 120.323 -0.551 . . . . 46.76 111.148 174.064 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 31' ' ' LYS . . . . . . . . . . . . . 64.8 tttp -67.93 -34.73 77.17 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.455 -0.498 . . . . 38.83 111.896 -176.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 32' ' ' ILE . . . . . . . . . . . . . 15.2 tt -88.38 -23.47 6.39 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 N-CA-C 112.444 0.535 . . . . 45.89 112.444 177.414 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 33' ' ' ALA . . . . . . . . . . . . . . . -71.85 4.67 3.12 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 112.871 0.693 . . . . 66.92 112.871 178.598 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 34' ' ' VAL . . . . . 0.533 HG13 ' HG3' ' C' ' 35' ' ' ARG . 3.6 p -101.32 1.46 10.51 Favored 'Isoleucine or valine' 0 C--O 1.238 0.496 0 CA-C-N 118.635 0.652 . . . . 73.39 112.157 175.961 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 35' ' ' ARG . . . . . 0.533 ' HG3' HG13 ' C' ' 34' ' ' VAL . 2.2 mtt180 -135.4 25.91 3.47 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 112.968 0.729 . . . . 66.13 112.968 -177.662 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 36' ' ' LEU . . . . . . . . . . . . . 2.9 mp -111.73 166.11 11.46 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 119.004 0.82 . . . . 59.7 110.941 -174.028 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 37' ' ' THR . . . . . . . . . . . . . 3.0 m -103.18 133.78 47.7 Favored 'General case' 0 C--O 1.232 0.153 0 CA-C-N 115.086 -0.961 . . . . 48.66 109.703 -177.497 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 38' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -121.3 127.53 51.43 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 110.233 -0.284 . . . . 55.8 110.233 -176.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 39' ' ' THR . . . . . . . . . . . . . 58.2 m -119.63 126.94 52.37 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 109.099 -0.704 . . . . 42.83 109.099 176.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 40' ' ' LYS . . . . . . . . . . . . . 23.9 ttmm -120.22 109.62 15.62 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 109.165 -0.68 . . . . 45.85 109.165 -176.811 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 41' ' ' VAL . . . . . . . . . . . . . 98.2 t -95.96 121.36 46.42 Favored 'Isoleucine or valine' 0 C--O 1.238 0.493 0 N-CA-C 107.819 -1.178 . . . . 40.17 107.819 175.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 42' ' ' ILE . . . . . . . . . . . . . 52.0 mt -116.37 118.25 58.16 Favored 'Isoleucine or valine' 0 C--O 1.24 0.556 0 N-CA-C 108.388 -0.967 . . . . 42.89 108.388 -176.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 43' ' ' ASP . . . . . 0.431 ' HB3' ' HB2' ' C' ' 50' ' ' LYS . 32.9 t0 -107.36 104.33 13.9 Favored 'General case' 0 C--O 1.233 0.195 0 N-CA-C 107.681 -1.229 . . . . 62.49 107.681 177.051 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 44' ' ' GLN . . . . . 0.411 ' HB3' ' ND2' ' C' ' 5' ' ' ASN . 55.0 tt0 -113.03 136.1 53.06 Favored 'General case' 0 C--O 1.235 0.328 0 CA-C-O 120.78 0.324 . . . . 48.03 110.756 -174.076 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 45' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -134.52 94.32 3.18 Favored 'General case' 0 C--O 1.234 0.269 0 N-CA-C 106.993 -1.484 . . . . 83.4 106.993 175.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 46' ' ' GLY . . . . . . . . . . . . . . . 62.87 -87.58 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.408 0 CA-C-N 116.319 -0.4 . . . . 49.08 112.836 -178.228 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 47' ' ' ASP . . . . . . . . . . . . . 67.5 m-20 -120.24 -10.96 9.27 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 113.415 0.894 . . . . 55.48 113.415 176.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 48' ' ' ASN . . . . . . . . . . . . . 25.2 m-20 -80.95 129.15 34.39 Favored 'General case' 0 C--O 1.236 0.35 0 CA-C-N 118.728 0.695 . . . . 54.01 109.719 176.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 49' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -121.09 130.54 53.8 Favored 'General case' 0 C--O 1.235 0.333 0 N-CA-C 109.892 -0.41 . . . . 45.36 109.892 -177.407 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 50' ' ' LYS . . . . . 0.431 ' HB2' ' HB3' ' C' ' 43' ' ' ASP . 3.5 mtmt -121.12 98.32 5.93 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 106.371 -1.715 . . . . 47.79 106.371 173.111 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 51' ' ' ASP . . . . . . . . . . . . . 14.8 t0 -102.94 133.13 48.56 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 123.169 0.588 . . . . 49.1 109.681 -174.753 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 52' ' ' LYS . . . . . . . . . . . . . 8.9 mttp -133.53 115.09 14.32 Favored 'General case' 0 C--O 1.234 0.279 0 N-CA-C 108.667 -0.864 . . . . 61.98 108.667 178.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 53' ' ' THR . . . . . . . . . . . . . 54.5 m -117.06 127.8 54.52 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 109.639 -0.504 . . . . 47.57 109.639 -177.429 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 54' ' ' THR . . . . . . . . . . . . . 13.8 m -119.41 123.85 45.11 Favored 'General case' 0 C--O 1.238 0.463 0 N-CA-C 109.139 -0.689 . . . . 54.13 109.139 -179.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 55' ' ' SER . . . . . . . . . . . . . 3.7 p -95.8 142.02 28.56 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 108.914 -0.773 . . . . 49.76 108.914 170.314 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 56' ' ' THR . . . . . . . . . . . . . 75.3 m -143.53 129.96 20.01 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.961 -0.563 . . . . 36.91 109.984 -163.631 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 57' ' ' PHE . . . . . . . . . . . . . 92.8 t80 -98.55 127.1 44.35 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 109.373 -0.602 . . . . 40.06 109.373 176.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 58' ' ' ARG . . . . . . . . . . . . . 1.1 mtp-105 -90.24 104.13 16.74 Favored 'General case' 0 C--N 1.33 -0.272 0 N-CA-C 108.385 -0.969 . . . . 70.72 108.385 -179.518 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 59' ' ' ASN . . . . . . . . . . . . . 10.9 m120 -74.64 -55.84 5.46 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.366 -0.534 . . . . 43.2 110.889 178.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 60' ' ' TYR . . . . . 0.486 ' HE2' ' H1 ' ' C' ' 205' ' ' ACT . 0.2 OUTLIER -164.7 142.64 6.56 Favored 'General case' 0 C--O 1.233 0.209 0 N-CA-C 109.653 -0.499 . . . . 60.96 109.653 178.037 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 61' ' ' ASP . . . . . . . . . . . . . 60.3 t0 -140.45 113.07 8.05 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 107.166 -1.42 . . . . 46.35 107.166 175.124 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 62' ' ' VAL . . . . . . . . . . . . . 8.1 p -142.01 147.91 21.08 Favored 'Isoleucine or valine' 0 C--O 1.236 0.349 0 CA-C-O 121.397 0.617 . . . . 41.21 109.469 -173.821 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 63' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -126.3 138.31 53.58 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 108.788 -0.819 . . . . 47.64 108.788 171.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 64' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -154.35 173.27 16.43 Favored 'General case' 0 C--O 1.234 0.24 0 N-CA-C 109.097 -0.705 . . . . 33.77 109.097 -175.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 65' ' ' THR . . . . . . . . . . . . . 94.4 m -131.02 134.89 47.09 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-N 115.209 -0.905 . . . . 40.81 108.596 177.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 66' ' ' VAL . . . . . 0.459 HG11 ' CD1' ' C' ' 88' ' ' TRP . 3.4 t -67.02 137.99 23.74 Favored 'Isoleucine or valine' 0 C--O 1.239 0.55 0 CA-C-O 121.297 0.57 . . . . 34.5 109.924 -178.144 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 67' ' ' GLY . . . . . . . . . . . . . . . 84.76 -11.59 59.14 Favored Glycine 0 N--CA 1.445 -0.704 0 N-CA-C 115.493 0.957 . . . . 37.59 115.493 178.83 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 68' ' ' VAL . . . . . . . . . . . . . 14.5 t -112.88 119.96 61.77 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 CA-C-N 118.767 1.284 . . . . 42.16 108.146 -178.608 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 69' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -78.06 151.43 33.46 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 121.367 0.603 . . . . 55.28 110.396 177.703 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 70' ' ' PHE . . . . . . . . . . . . . 33.3 p90 -150.4 158.29 43.98 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 115.699 -0.682 . . . . 39.96 109.583 -176.391 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 71' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -92.5 99.35 12.1 Favored 'General case' 0 N--CA 1.463 0.206 0 N-CA-C 108.648 -0.871 . . . . 47.13 108.648 -178.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 72' ' ' GLU . . . . . . . . . . . . . 52.5 tt0 -88.41 143.98 26.66 Favored 'General case' 0 C--N 1.329 -0.324 0 C-N-CA 123.08 0.552 . . . . 55.71 110.691 -178.351 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 73' ' ' TYR . . . . . . . . . . . . . 62.1 m-85 -123.3 108.55 12.88 Favored 'General case' 0 C--O 1.235 0.311 0 N-CA-C 107.466 -1.309 . . . . 49.09 107.466 175.648 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 74' ' ' THR . . . . . . . . . . . . . 70.4 p -84.7 53.06 2.56 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 113.288 0.848 . . . . 45.98 113.288 -165.47 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 75' ' ' LYS . . . . . . . . . . . . . 26.5 mttt -66.31 158.41 29.16 Favored 'General case' 0 N--CA 1.452 -0.35 0 C-N-CA 119.872 -0.731 . . . . 58.22 109.453 166.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 76' ' ' SER . . . . . . . . . . . . . 52.2 p 72.89 -7.29 1.49 Allowed 'General case' 0 C--N 1.333 -0.134 0 C-N-CA 127.575 2.35 . . . . 50.66 111.124 -165.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 77' ' ' LEU . . . . . . . . . . . . . 10.0 tp -122.38 -104.33 0.38 Allowed 'General case' 0 C--O 1.236 0.355 0 CA-C-N 119.083 0.856 . . . . 48.86 110.103 173.703 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 78' ' ' ASP . . . . . . . . . . . . . 22.8 p-10 -105.07 -4.93 21.34 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 113.468 0.914 . . . . 40.23 113.468 -176.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 79' ' ' ASN . . . . . . . . . . . . . 6.1 t30 57.17 72.64 0.5 Allowed 'General case' 0 N--CA 1.466 0.335 0 CA-C-O 122.465 1.126 . . . . 52.5 110.892 178.104 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 80' ' ' ARG . . . . . . . . . . . . . 66.0 mtt85 -142.53 144.93 33.16 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 114.19 -1.368 . . . . 44.93 109.225 179.578 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 81' ' ' HIS . . . . . . . . . . . . . 11.4 t-80 -86.9 129.5 34.85 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 109.305 -0.628 . . . . 48.18 109.305 174.386 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 82' ' ' VAL . . . . . . . . . . . . . 3.9 m -139.48 145.4 27.08 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.227 0 N-CA-C 108.71 -0.848 . . . . 40.93 108.71 179.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 83' ' ' LYS . . . . . . . . . . . . . 27.8 mtmt -88.46 105.73 17.8 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 107.924 -1.139 . . . . 47.68 107.924 173.209 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 84' ' ' ALA . . . . . . . . . . . . . . . -98.02 141.81 30.51 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 122.76 0.424 . . . . 37.12 110.694 -174.352 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 85' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -140.26 124.67 17.87 Favored 'General case' 0 C--O 1.236 0.368 0 N-CA-C 108.101 -1.074 . . . . 36.28 108.101 178.074 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 86' ' ' VAL . . . . . . . . . . . . . 66.0 t -115.63 127.4 73.23 Favored 'Isoleucine or valine' 0 C--O 1.236 0.383 0 N-CA-C 108.523 -0.918 . . . . 29.15 108.523 -177.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 87' ' ' THR . . . . . . . . . . . . . 1.3 p -136.77 170.19 16.48 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-O 121.647 0.737 . . . . 36.95 109.347 -179.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 88' ' ' TRP . . . . . 0.459 ' CD1' HG11 ' C' ' 66' ' ' VAL . 85.5 m95 -102.92 123.12 45.95 Favored 'General case' 0 C--O 1.236 0.388 0 CA-C-N 115.256 -0.884 . . . . 37.45 109.0 175.916 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 89' ' ' GLU . . . . . . . . . . . . . 92.1 mt-10 -109.5 95.1 5.39 Favored 'General case' 0 C--N 1.327 -0.383 0 N-CA-C 106.093 -1.817 . . . . 38.19 106.093 169.064 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 90' ' ' GLY . . . . . . . . . . . . . . . 64.88 -110.36 3.44 Favored Glycine 0 N--CA 1.448 -0.525 0 N-CA-C 110.875 -0.89 . . . . 39.76 110.875 -170.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 91' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -110.45 9.51 23.34 Favored 'General case' 0 C--O 1.236 0.361 0 N-CA-C 112.156 0.428 . . . . 50.48 112.156 174.157 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 92' ' ' VAL . . . . . . . . . . . . . 72.2 t -101.53 118.32 48.13 Favored 'Isoleucine or valine' 0 C--O 1.237 0.407 0 N-CA-C 108.485 -0.932 . . . . 36.48 108.485 -177.717 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 93' ' ' LEU . . . . . . . . . . . . . 15.5 tp -78.23 104.54 8.88 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.455 -0.942 . . . . 32.8 108.455 178.108 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 94' ' ' VAL . . . . . . . . . . . . . 81.5 t -99.88 139.87 20.42 Favored 'Isoleucine or valine' 0 C--O 1.237 0.413 0 N-CA-C 108.886 -0.783 . . . . 30.24 108.886 -176.889 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 95' ' ' CYS . . . . . . . . . . . . . 27.9 t -136.11 124.23 23.0 Favored 'General case' 0 C--O 1.237 0.438 0 N-CA-C 109.303 -0.628 . . . . 30.54 109.303 -179.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 96' ' ' VAL . . . . . . . . . . . . . 75.0 t -110.55 127.31 67.65 Favored 'Isoleucine or valine' 0 C--O 1.238 0.454 0 N-CA-C 108.16 -1.052 . . . . 26.17 108.16 177.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 97' ' ' GLN . . . . . 0.434 ' HB2' ' HG2' ' C' ' 104' ' ' ARG . 73.1 mt-30 -115.67 99.1 7.09 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 108.047 -1.094 . . . . 40.49 108.047 -179.715 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 98' ' ' LYS . . . . . . . . . . . . . 4.1 mmtt -82.96 129.28 35.01 Favored 'General case' 0 C--O 1.234 0.27 0 CA-C-N 116.502 -0.317 . . . . 68.76 110.3 -178.17 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 99' ' ' GLY . . . . . . . . . . . . . . . -176.49 -143.71 4.88 Favored Glycine 0 N--CA 1.449 -0.488 0 C-N-CA 120.685 -0.769 . . . . 32.05 113.553 -179.875 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 100' ' ' GLU . . . . . . . . . . . . . 58.5 tt0 -64.5 -50.11 68.7 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 120.605 -0.438 . . . . 56.4 111.181 -179.036 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 101' ' ' LYS . . . . . 0.431 ' NZ ' ' OD2' ' A' ' 24' ' ' ASP . 12.9 mmtm -82.97 139.35 33.38 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-O 121.095 0.474 . . . . 43.58 110.597 -179.989 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 102' ' ' GLU . . . . . . . . . . . . . 3.6 mm-40 -92.03 150.32 21.04 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 115.784 -0.644 . . . . 62.43 110.634 -177.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 103' ' ' ASN . . . . . . . . . . . . . 1.2 t30 56.62 49.36 14.74 Favored 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 115.379 -0.828 . . . . 53.43 111.015 -177.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 104' ' ' ARG . . . . . 0.434 ' HG2' ' HB2' ' C' ' 97' ' ' GLN . 62.1 ttt180 -102.83 122.93 45.51 Favored 'General case' 0 C--O 1.236 0.385 0 N-CA-C 108.832 -0.803 . . . . 30.49 108.832 178.944 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 105' ' ' GLY . . . . . . . . . . . . . . . 173.85 -164.65 36.16 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.188 -1.005 . . . . 33.25 110.721 179.468 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 106' ' ' TRP . . . . . 0.451 ' HB2' HD11 ' C' ' 117' ' ' LEU . 35.5 p-90 -160.55 163.36 32.83 Favored 'General case' 0 C--O 1.233 0.224 0 C-N-CA 119.683 -0.807 . . . . 39.29 110.032 178.298 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 107' ' ' LYS . . . . . 0.422 ' O ' ' HA ' ' C' ' 117' ' ' LEU . 97.5 mttt -130.56 125.12 33.39 Favored 'General case' 0 C--O 1.234 0.289 0 CA-C-N 115.125 -0.943 . . . . 37.6 109.067 177.022 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 108' ' ' LYS . . . . . . . . . . . . . 27.2 ttmt -123.86 118.67 27.63 Favored 'General case' 0 C--O 1.235 0.293 0 N-CA-C 109.181 -0.674 . . . . 36.4 109.181 -175.542 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 109' ' ' TRP . . . . . . . . . . . . . 29.0 p90 -143.83 158.67 43.53 Favored 'General case' 0 C--N 1.331 -0.197 0 CA-C-O 121.378 0.609 . . . . 35.18 109.693 179.03 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 110' ' ' ILE . . . . . . . . . . . . . 12.7 mm -108.91 139.42 31.63 Favored 'Isoleucine or valine' 0 C--O 1.237 0.416 0 N-CA-C 108.914 -0.773 . . . . 39.69 108.914 -177.654 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 111' ' ' GLU . . . . . . . . . . . . . 73.4 mt-10 -129.22 110.32 11.87 Favored 'General case' 0 C--O 1.236 0.371 0 N-CA-C 108.009 -1.108 . . . . 52.18 108.009 174.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 112' ' ' GLY . . . . . . . . . . . . . . . 58.1 -93.08 0.04 OUTLIER Glycine 0 N--CA 1.45 -0.41 0 CA-C-N 116.372 -0.376 . . . . 62.15 112.497 -177.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 113' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -105.93 -35.01 7.43 Favored 'General case' 0 C--N 1.329 -0.308 0 N-CA-C 113.026 0.75 . . . . 67.51 113.026 175.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 114' ' ' LYS . . . . . 0.547 ' HZ2' ' CG ' ' D' ' 63' ' ' ASP . 75.7 mttt -81.13 150.06 28.89 Favored 'General case' 0 C--O 1.236 0.372 0 CA-C-O 121.781 0.8 . . . . 50.61 112.285 -167.805 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 115' ' ' LEU . . . . . 0.415 ' HB3' ' HB2' ' C' ' 130' ' ' PHE . 8.4 tt -101.77 127.3 48.61 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 114.864 -1.062 . . . . 29.0 108.651 171.383 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 116' ' ' TYR . . . . . 0.585 ' OH ' ' OD2' ' D' ' 63' ' ' ASP . 85.7 m-85 -115.45 131.13 57.03 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 108.826 -0.805 . . . . 53.46 108.826 178.671 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 117' ' ' LEU . . . . . 0.472 HD21 ' H2 ' ' A' ' 203' ' ' ACT . 12.2 tp -136.55 124.44 22.69 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 109.398 -0.593 . . . . 38.57 109.398 177.359 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 118' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -107.4 101.48 10.84 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 107.854 -1.165 . . . . 53.14 107.854 176.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 119' ' ' LEU . . . . . . . . . . . . . 3.1 mt -78.7 147.41 33.48 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 109.284 -0.635 . . . . 36.42 109.284 167.401 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 120' ' ' THR . . . . . 0.529 HG23 HG22 ' C' ' 125' ' ' VAL . 6.4 m -148.66 134.63 19.09 Favored 'General case' 0 C--O 1.237 0.44 0 C-N-CA 120.025 -0.67 . . . . 43.9 110.207 -177.669 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 121' ' ' CYS . . . . . . . . . . . . . 43.2 t -140.98 119.44 12.27 Favored 'General case' 0 C--O 1.236 0.345 0 N-CA-C 108.17 -1.048 . . . . 32.6 108.17 175.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 122' ' ' GLY . . . . . . . . . . . . . . . 61.52 -114.01 6.29 Favored Glycine 0 N--CA 1.449 -0.459 0 C-N-CA 121.508 -0.377 . . . . 50.84 112.755 -178.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 123' ' ' ASP . . . . . . . . . . . . . 21.4 p-10 -106.73 8.38 30.92 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 112.374 0.509 . . . . 35.79 112.374 176.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 124' ' ' GLN . . . . . . . . . . . . . 86.7 mm-40 -103.56 126.35 50.65 Favored 'General case' 0 C--O 1.238 0.49 0 N-CA-C 109.858 -0.423 . . . . 30.96 109.858 -178.381 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 125' ' ' VAL . . . . . 0.529 HG22 HG23 ' C' ' 120' ' ' THR . 39.6 t -119.77 125.13 74.02 Favored 'Isoleucine or valine' 0 C--O 1.237 0.439 0 N-CA-C 108.051 -1.092 . . . . 34.09 108.051 -178.954 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 126' ' ' CYS . . . . . . . . . . . . . 24.3 t -113.21 124.17 51.91 Favored 'General case' 0 C--O 1.235 0.326 0 N-CA-C 108.514 -0.921 . . . . 32.06 108.514 176.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 127' ' ' ARG . . . . . . . . . . . . . 65.0 ttt-85 -111.1 125.81 54.16 Favored 'General case' 0 C--N 1.328 -0.339 0 N-CA-C 109.473 -0.566 . . . . 54.87 109.473 -178.334 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 128' ' ' GLN . . . . . . . . . . . . . 24.0 mt-30 -124.85 136.29 53.67 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 120.951 0.405 . . . . 33.8 110.411 -177.602 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 129' ' ' VAL . . . . . . . . . . . . . 21.7 t -118.12 133.41 65.01 Favored 'Isoleucine or valine' 0 C--O 1.236 0.378 0 N-CA-C 108.337 -0.986 . . . . 31.85 108.337 -179.51 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 130' ' ' PHE . . . . . 0.595 ' HB3' ' HB3' ' A' ' 8' ' ' TRP . 85.6 m-85 -127.78 147.38 50.42 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 123.52 0.728 . . . . 31.61 109.71 -176.797 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 131' ' ' LYS . . . . . . . . . . . . . 25.4 tptp -114.8 134.6 54.99 Favored 'General case' 0 C--O 1.236 0.352 0 CA-C-N 115.494 -0.776 . . . . 53.06 109.098 177.117 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 132' ' ' LYS . . . . . . . . . . . . . 76.1 tttt -71.04 139.5 50.47 Favored 'General case' 0 C--O 1.235 0.297 0 CA-C-O 121.209 0.528 . . . . 47.16 110.803 -178.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 133' ' ' LYS . . . . . . . . . . . . . 18.2 mtpt . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 115.905 -0.588 . . . . 68.81 110.729 177.024 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 1' ' ' THR . . . . . . . . . . . . . 1.3 t . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.894 0.378 . . . . 48.63 110.945 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 2' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -101.22 -3.75 28.44 Favored 'General case' 0 C--O 1.234 0.266 0 N-CA-C 113.119 0.785 . . . . 57.96 113.119 -177.781 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 3' ' ' ASP . . . . . . . . . . . . . 50.5 t0 -83.56 104.6 13.81 Favored 'General case' 0 C--N 1.33 -0.253 0 N-CA-C 108.596 -0.89 . . . . 63.53 108.596 -179.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 4' ' ' GLN . . . . . . . . . . . . . 89.4 mt-30 -107.02 14.24 26.62 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 112.666 0.617 . . . . 60.83 112.666 -179.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 5' ' ' ASN . . . . . . . . . . . . . 48.4 m-80 -64.79 149.52 49.19 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.547 0.689 . . . . 65.53 111.297 -175.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 6' ' ' GLY . . . . . . . . . . . . . . . 125.14 -166.68 17.75 Favored Glycine 0 N--CA 1.446 -0.679 0 C-N-CA 120.469 -0.872 . . . . 60.14 112.454 167.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 7' ' ' THR . . . . . . . . . . . . . 91.2 m -112.36 125.83 54.62 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 123.774 0.83 . . . . 54.18 109.506 -176.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 8' ' ' TRP . . . . . 0.712 ' HB3' ' HB3' ' B' ' 130' ' ' PHE . 76.6 m95 -121.71 136.51 54.94 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 123.598 0.759 . . . . 56.8 109.93 -175.125 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 9' ' ' GLU . . . . . . . . . . . . . 92.8 mt-10 -113.27 133.84 54.9 Favored 'General case' 0 C--O 1.237 0.411 0 N-CA-C 109.213 -0.662 . . . . 63.16 109.213 177.417 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 10' ' ' MET . . . . . . . . . . . . . 56.8 ttm -70.0 139.07 52.7 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-O 121.203 0.525 . . . . 45.92 111.223 -172.878 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 11' ' ' GLU . . . . . 0.4 ' OE1' ' HE2' ' B' ' 131' ' ' LYS . 6.5 tt0 -107.67 -48.87 3.33 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-N 115.838 -0.619 . . . . 45.07 112.572 176.544 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 12' ' ' SER . . . . . . . . . . . . . 5.8 p -135.95 166.51 23.16 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-O 121.716 0.769 . . . . 40.94 109.22 175.194 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 13' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -159.19 102.14 1.59 Allowed 'General case' 0 C--O 1.234 0.245 0 N-CA-C 106.683 -1.599 . . . . 46.68 106.683 -172.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 14' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -106.85 130.89 54.46 Favored 'General case' 0 C--O 1.236 0.348 0 O-C-N 123.593 0.558 . . . . 59.64 110.182 -172.016 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 15' ' ' ASN . . . . . . . . . . . . . 61.9 t30 58.25 49.19 11.52 Favored 'General case' 0 N--CA 1.464 0.226 0 CA-C-O 121.661 0.743 . . . . 36.54 111.518 178.096 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 16' ' ' PHE . . . . . 0.47 ' O ' ' HG3' ' D' ' 20' ' ' MET . 1.1 t80 -76.25 -38.01 56.86 Favored 'General case' 0 C--O 1.238 0.46 0 C-N-CA 120.2 -0.6 . . . . 42.3 111.32 172.539 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 17' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -65.8 -33.78 76.65 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.782 -0.367 . . . . 62.84 111.784 179.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 18' ' ' GLY . . . . . . . . . . . . . . . -67.81 -42.99 85.43 Favored Glycine 0 C--N 1.334 0.436 0 C-N-CA 119.945 -1.121 . . . . 41.85 112.558 174.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 19' ' ' TYR . . . . . . . . . . . . . 82.9 t80 -65.02 -41.42 95.3 Favored 'General case' 0 C--O 1.238 0.46 0 O-C-N 122.344 -0.504 . . . . 38.04 111.344 -179.505 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 20' ' ' MET . . . . . 0.594 ' HE3' ' HA ' ' D' ' 30' ' ' ARG . 32.2 mtm -78.88 -33.01 46.09 Favored 'General case' 0 C--O 1.235 0.326 0 C-N-CA 119.414 -0.914 . . . . 69.98 112.012 -177.872 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 21' ' ' LYS . . . . . . . . . . . . . 21.6 ttmt -66.89 -29.84 69.84 Favored 'General case' 0 C--O 1.236 0.342 0 C-N-CA 118.868 -1.133 . . . . 52.72 111.266 172.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 22' ' ' ALA . . . . . . . . . . . . . . . -64.32 -27.16 68.84 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.009 -0.677 . . . . 34.46 111.218 171.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 23' ' ' LEU . . . . . . . . . . . . . 95.8 mt -89.34 9.68 25.18 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 112.6 0.593 . . . . 33.34 112.6 175.305 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 24' ' ' ASP . . . . . 0.409 ' OD2' ' NH2' ' B' ' 80' ' ' ARG . 12.2 m-20 60.25 28.3 17.89 Favored 'General case' 0 C--O 1.234 0.28 0 C-N-CA 123.559 0.743 . . . . 40.75 111.956 -179.78 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 25' ' ' ILE . . . . . . . . . . . . . 3.5 mt -70.79 134.01 30.81 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 N-CA-C 109.019 -0.734 . . . . 41.23 109.019 176.092 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 26' ' ' ASP . . . . . . . . . . . . . 8.4 p-10 -60.71 164.0 5.06 Favored 'General case' 0 C--O 1.234 0.251 0 CA-C-O 121.839 0.828 . . . . 47.51 110.791 -176.166 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 27' ' ' PHE . . . . . . . . . . . . . 45.1 t80 -64.03 -50.89 66.68 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.314 -0.857 . . . . 57.01 111.7 -171.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 28' ' ' CYS . . . . . . . . . . . . . 64.0 m -57.89 -42.13 84.0 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 120.625 -0.43 . . . . 47.67 111.535 -173.039 -73.237 -54.445 -70.379 104.247 2.032 104.387 -45.32 -82.235 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 29' ' ' THR . . . . . . . . . . . . . 8.6 m -60.61 -33.39 72.67 Favored 'General case' 0 C--O 1.237 0.427 0 C-N-CA 120.413 -0.515 . . . . 42.94 111.381 175.26 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 30' ' ' ARG . . . . . 0.594 ' HA ' ' HE3' ' D' ' 20' ' ' MET . 72.2 mtm-85 -71.79 -44.21 64.37 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.262 -0.575 . . . . 49.31 111.349 178.511 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 31' ' ' LYS . . . . . . . . . . . . . 27.0 tttm -68.11 -35.83 78.76 Favored 'General case' 0 C--O 1.237 0.412 0 C-N-CA 120.948 -0.301 . . . . 54.74 111.35 -177.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 32' ' ' ILE . . . . . . . . . . . . . 5.6 mt -86.66 -42.18 15.4 Favored 'Isoleucine or valine' 0 C--O 1.234 0.281 0 O-C-N 122.045 -0.409 . . . . 45.75 111.76 -175.996 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 33' ' ' ALA . . . . . . . . . . . . . . . -63.36 -22.86 67.14 Favored 'General case' 0 C--O 1.236 0.352 0 O-C-N 121.645 -0.66 . . . . 52.02 112.56 -178.219 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 34' ' ' VAL . . . . . . . . . . . . . 3.4 p -80.29 -14.96 12.99 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 N-CA-C 112.151 0.426 . . . . 55.1 112.151 179.324 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 35' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -81.77 -29.52 32.76 Favored 'General case' 0 C--O 1.237 0.412 0 N-CA-C 112.314 0.487 . . . . 65.83 112.314 -177.313 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 36' ' ' LEU . . . . . . . . . . . . . 2.3 mt -94.82 147.71 23.06 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.398 0.618 . . . . 56.6 111.057 -173.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 37' ' ' THR . . . . . . . . . . . . . 4.6 t -88.47 142.28 27.84 Favored 'General case' 0 C--O 1.235 0.308 0 CA-C-N 115.546 -0.752 . . . . 56.82 109.72 176.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 38' ' ' GLN . . . . . . . . . . . . . 72.9 mt-30 -101.54 146.33 27.81 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 121.462 0.648 . . . . 45.89 111.01 -173.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 39' ' ' THR . . . . . . . . . . . . . 95.6 m -115.96 99.63 7.41 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 107.693 -1.225 . . . . 43.0 107.693 179.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 40' ' ' LYS . . . . . . . . . . . . . 7.6 tppt? -76.54 143.89 40.07 Favored 'General case' 0 N--CA 1.453 -0.301 0 CA-C-N 115.946 -0.57 . . . . 58.09 109.729 173.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 41' ' ' VAL . . . . . . . . . . . . . 55.3 t -139.11 117.57 12.66 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 N-CA-C 107.635 -1.246 . . . . 55.44 107.635 179.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 42' ' ' ILE . . . . . . . . . . . . . 2.9 mp -117.04 121.22 67.29 Favored 'Isoleucine or valine' 0 C--O 1.241 0.606 0 N-CA-C 108.886 -0.783 . . . . 59.94 108.886 -174.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 43' ' ' ASP . . . . . 0.563 ' HB2' ' HB2' ' D' ' 50' ' ' LYS . 0.8 OUTLIER -111.03 100.97 9.56 Favored 'General case' 0 C--O 1.234 0.268 0 N-CA-C 106.714 -1.588 . . . . 65.79 106.714 170.606 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 44' ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -111.83 135.42 52.46 Favored 'General case' 0 C--O 1.236 0.376 0 C-N-CA 122.694 0.397 . . . . 57.46 110.54 -173.684 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 45' ' ' ASP . . . . . 0.424 ' O ' ' N ' ' D' ' 47' ' ' ASP . 39.6 t0 -116.31 74.12 0.89 Allowed 'General case' 0 C--O 1.235 0.312 0 N-CA-C 108.236 -1.024 . . . . 76.24 108.236 175.519 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 46' ' ' GLY . . . . . . . . . . . . . . . 65.41 -65.2 0.1 Allowed Glycine 0 N--CA 1.449 -0.471 0 C-N-CA 121.203 -0.522 . . . . 59.11 112.891 -177.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 47' ' ' ASP . . . . . 0.424 ' N ' ' O ' ' D' ' 45' ' ' ASP . 38.2 m-20 -130.09 -23.17 2.77 Favored 'General case' 0 C--O 1.237 0.408 0 N-CA-C 114.189 1.181 . . . . 74.99 114.189 178.611 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 48' ' ' ASN . . . . . . . . . . . . . 3.4 m-80 -81.7 127.83 33.33 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 119.382 0.992 . . . . 67.97 109.376 172.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 49' ' ' PHE . . . . . . . . . . . . . 26.6 m-85 -113.79 156.31 24.09 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 121.673 0.749 . . . . 57.74 111.067 -173.954 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 50' ' ' LYS . . . . . 0.563 ' HB2' ' HB2' ' D' ' 43' ' ' ASP . 21.3 mttt -140.56 98.64 3.46 Favored 'General case' 0 C--O 1.235 0.306 0 N-CA-C 106.692 -1.595 . . . . 59.99 106.692 173.379 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 51' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -103.34 134.02 47.43 Favored 'General case' 0 C--O 1.235 0.334 0 C-N-CA 122.82 0.448 . . . . 54.27 109.831 -175.241 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 52' ' ' LYS . . . . . . . . . . . . . 32.3 tttp -147.12 112.03 5.4 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 108.966 -0.753 . . . . 57.36 108.966 -179.451 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 53' ' ' THR . . . . . 0.443 ' O ' ' HA ' ' B' ' 59' ' ' ASN . 32.9 m -103.23 130.2 50.4 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 109.427 -0.583 . . . . 47.92 109.427 177.694 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 54' ' ' THR . . . . . . . . . . . . . 4.7 m -124.04 139.56 53.82 Favored 'General case' 0 C--O 1.233 0.199 0 C-N-CA 122.374 0.27 . . . . 61.48 110.334 -178.657 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 55' ' ' SER . . . . . . . . . . . . . 1.9 t -133.39 137.67 45.93 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 109.341 -0.614 . . . . 56.77 109.341 176.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 56' ' ' THR . . . . . . . . . . . . . 97.9 m -103.43 121.02 41.94 Favored 'General case' 0 C--O 1.235 0.341 0 N-CA-C 109.288 -0.634 . . . . 58.63 109.288 -178.067 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 57' ' ' PHE . . . . . 0.494 ' HZ ' HG23 ' B' ' 29' ' ' THR . 30.4 t80 -72.4 -76.81 0.11 Allowed 'General case' 0 C--O 1.236 0.363 0 CA-C-N 116.357 -0.383 . . . . 62.15 110.564 178.406 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 58' ' ' ARG . . . . . 0.55 ' HB2' ' H32' ' D' ' 203' ' ' RET . 48.2 mtt180 -139.94 174.13 10.82 Favored 'General case' 0 C--N 1.33 -0.274 0 N-CA-C 108.937 -0.764 . . . . 61.38 108.937 177.493 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 59' ' ' ASN . . . . . . . . . . . . . 3.0 m-80 -135.79 130.23 33.73 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 108.609 -0.886 . . . . 62.97 108.609 175.488 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 60' ' ' TYR . . . . . . . . . . . . . 31.4 t80 -110.37 129.94 55.65 Favored 'General case' 0 C--O 1.236 0.363 0 N-CA-C 108.905 -0.776 . . . . 51.75 108.905 172.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 61' ' ' ASP . . . . . 0.68 ' OD2' ' HG3' ' B' ' 52' ' ' LYS . 0.8 OUTLIER -154.42 138.41 16.37 Favored 'General case' 0 C--N 1.327 -0.394 0 C-N-CA 120.398 -0.521 . . . . 63.22 109.898 177.573 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 62' ' ' VAL . . . . . . . . . . . . . 6.3 p -149.39 144.48 18.02 Favored 'Isoleucine or valine' 0 C--O 1.234 0.289 0 N-CA-C 108.259 -1.015 . . . . 44.36 108.259 -170.121 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 63' ' ' ASP . . . . . 0.585 ' OD2' ' OH ' ' C' ' 116' ' ' TYR . 15.4 m-20 -114.43 140.94 48.28 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 109.278 -0.638 . . . . 42.96 109.278 173.484 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 64' ' ' PHE . . . . . . . . . . . . . 51.5 p90 -157.44 152.13 25.36 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 120.054 -0.658 . . . . 36.67 109.808 179.155 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 65' ' ' THR . . . . . . . . . . . . . 84.0 m -109.74 128.46 55.3 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.132 -0.94 . . . . 38.14 108.51 173.766 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 66' ' ' VAL . . . . . . . . . . . . . 46.2 t -69.57 123.47 23.31 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 N-CA-C 109.249 -0.648 . . . . 35.18 109.249 -175.916 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 67' ' ' GLY . . . . . . . . . . . . . . . 107.53 -4.45 34.86 Favored Glycine 0 N--CA 1.448 -0.513 0 CA-C-O 119.004 -0.887 . . . . 39.9 114.89 177.8 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 68' ' ' VAL . . . . . . . . . . . . . 92.7 t -122.48 123.96 69.73 Favored 'Isoleucine or valine' 0 C--O 1.237 0.431 0 CA-C-N 118.637 1.219 . . . . 37.41 108.326 -177.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 69' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -69.04 149.77 48.39 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-O 121.446 0.641 . . . . 56.45 110.289 175.905 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 70' ' ' PHE . . . . . . . . . . . . . 24.8 p90 -157.27 143.05 17.58 Favored 'General case' 0 C--N 1.332 -0.188 0 CA-C-N 115.873 -0.603 . . . . 31.7 109.614 -178.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 71' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -82.34 127.81 33.6 Favored 'General case' 0 C--O 1.234 0.239 0 CA-C-N 115.987 -0.551 . . . . 33.09 110.13 179.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 72' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -104.03 163.53 12.32 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-O 121.884 0.85 . . . . 43.52 110.933 -179.744 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 73' ' ' TYR . . . . . . . . . . . . . 37.2 m-85 -143.05 90.85 2.23 Favored 'General case' 0 N--CA 1.466 0.333 0 N-CA-C 105.77 -1.937 . . . . 34.83 105.77 177.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 74' ' ' THR . . . . . . . . . . . . . 19.8 p -76.02 60.53 1.42 Allowed 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 122.203 1.001 . . . . 41.56 111.735 -166.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 75' ' ' LYS . . . . . 0.539 ' NZ ' ' O ' ' D' ' 302' ' ' HOH . 69.4 mmtt -63.09 154.5 30.75 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.293 -0.867 . . . . 51.1 109.428 167.943 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 76' ' ' SER . . . . . . . . . . . . . 60.5 p 64.92 7.28 3.87 Favored 'General case' 0 C--O 1.238 0.466 0 C-N-CA 125.065 1.346 . . . . 54.03 112.317 -170.743 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 77' ' ' LEU . . . . . 0.437 ' HB3' ' H ' ' D' ' 78' ' ' ASP . 0.9 OUTLIER -125.53 -116.78 0.28 Allowed 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.101 0.56 . . . . 46.2 109.753 175.551 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' D' D ' 78' ' ' ASP . . . . . 0.437 ' H ' ' HB3' ' D' ' 77' ' ' LEU . 20.9 p-10 -94.16 -8.52 39.18 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 112.918 0.711 . . . . 34.34 112.918 175.427 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 79' ' ' ASN . . . . . . . . . . . . . 34.6 t30 52.46 70.56 0.55 Allowed 'General case' 0 CA--C 1.531 0.235 0 CA-C-O 122.784 1.278 . . . . 52.73 110.662 -177.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 80' ' ' ARG . . . . . . . . . . . . . 76.2 mtt85 -133.17 162.06 32.77 Favored 'General case' 0 N--CA 1.452 -0.349 0 CA-C-N 113.88 -1.509 . . . . 38.01 108.757 174.583 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 81' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -101.33 123.47 45.48 Favored 'General case' 0 C--N 1.327 -0.384 0 N-CA-C 108.983 -0.747 . . . . 35.81 108.983 177.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 82' ' ' VAL . . . . . 0.54 HG12 ' HA3' ' D' ' 99' ' ' GLY . 18.8 m -133.58 162.16 40.04 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 N-CA-C 107.936 -1.135 . . . . 29.47 107.936 175.836 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 83' ' ' LYS . . . . . . . . . . . . . 25.7 mttt -110.1 112.59 24.68 Favored 'General case' 0 C--N 1.324 -0.511 0 N-CA-C 106.981 -1.489 . . . . 48.73 106.981 171.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 84' ' ' ALA . . . . . 0.464 ' HA ' ' O ' ' D' ' 96' ' ' VAL . . . -102.26 140.91 35.91 Favored 'General case' 0 C--O 1.236 0.392 0 CA-C-N 115.971 -0.559 . . . . 31.69 110.561 -173.525 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 85' ' ' LEU . . . . . . . . . . . . . 61.6 tp -132.41 129.02 38.78 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 108.137 -1.06 . . . . 35.86 108.137 173.87 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 86' ' ' VAL . . . . . 0.495 HG22 ' HB2' ' D' ' 95' ' ' CYS . 60.9 t -115.19 121.08 66.4 Favored 'Isoleucine or valine' 0 C--O 1.237 0.437 0 N-CA-C 107.752 -1.203 . . . . 31.7 107.752 -178.894 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 87' ' ' THR . . . . . . . . . . . . . 30.7 p -129.81 161.37 30.9 Favored 'General case' 0 C--O 1.234 0.28 0 CA-C-O 121.423 0.63 . . . . 34.85 109.548 179.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 88' ' ' TRP . . . . . . . . . . . . . 76.0 m95 -92.12 126.51 37.23 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 115.37 -0.832 . . . . 38.02 109.494 175.05 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 89' ' ' GLU . . . . . . . . . . . . . 91.7 mt-10 -118.11 97.31 5.74 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 106.29 -1.744 . . . . 41.91 106.29 171.378 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 90' ' ' GLY . . . . . . . . . . . . . . . 66.44 -126.49 27.9 Favored Glycine 0 C--O 1.235 0.209 0 N-CA-C 109.074 -1.61 . . . . 37.3 109.074 -168.672 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 91' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -99.79 17.69 20.1 Favored 'General case' 0 C--O 1.236 0.365 0 O-C-N 122.53 -0.394 . . . . 50.97 111.945 170.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 92' ' ' VAL . . . . . . . . . . . . . 62.1 t -108.39 106.13 20.1 Favored 'Isoleucine or valine' 0 C--O 1.237 0.446 0 N-CA-C 108.045 -1.095 . . . . 36.88 108.045 -175.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 93' ' ' LEU . . . . . . . . . . . . . 13.1 tp -67.1 109.07 2.88 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 123.169 0.588 . . . . 38.61 109.471 173.027 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 94' ' ' VAL . . . . . . . . . . . . . 22.1 t -108.03 141.13 24.06 Favored 'Isoleucine or valine' 0 C--O 1.236 0.386 0 N-CA-C 108.667 -0.864 . . . . 34.94 108.667 -179.188 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 95' ' ' CYS . . . . . 0.495 ' HB2' HG22 ' D' ' 86' ' ' VAL . 1.6 t -133.37 125.03 28.27 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-N 116.354 -0.385 . . . . 30.54 110.086 -178.0 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 96' ' ' VAL . . . . . 0.464 ' O ' ' HA ' ' D' ' 84' ' ' ALA . 2.6 t -101.2 135.43 37.64 Favored 'Isoleucine or valine' 0 C--O 1.238 0.475 0 C-N-CA 124.34 1.056 . . . . 39.1 108.318 175.718 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 97' ' ' GLN . . . . . . . . . . . . . 89.0 mt-30 -122.98 91.79 3.56 Favored 'General case' 0 C--N 1.33 -0.262 0 N-CA-C 107.928 -1.138 . . . . 37.49 107.928 178.527 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 98' ' ' LYS . . . . . . . . . . . . . 64.7 mttt -75.96 122.19 23.81 Favored 'General case' 0 C--O 1.234 0.286 0 CA-C-N 116.279 -0.419 . . . . 52.37 110.047 -178.409 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 99' ' ' GLY . . . . . 0.54 ' HA3' HG12 ' D' ' 82' ' ' VAL . . . -170.48 -143.25 3.88 Favored Glycine 0 N--CA 1.449 -0.449 0 C-N-CA 120.545 -0.836 . . . . 38.34 114.667 -179.726 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 100' ' ' GLU . . . . . . . . . . . . . 56.0 tt0 -66.99 -31.55 72.19 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.777 -0.369 . . . . 46.63 111.777 -178.394 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 101' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -94.03 157.49 16.07 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 121.748 0.785 . . . . 46.46 110.738 -178.502 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 102' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -102.97 144.6 31.04 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.264 -0.88 . . . . 69.03 109.93 178.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 103' ' ' ASN . . . . . . . . . . . . . 29.8 m120 55.66 35.48 25.33 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-O 121.326 0.584 . . . . 68.4 111.406 -179.721 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 104' ' ' ARG . . . . . . . . . . . . . 74.4 ttt180 -89.53 129.77 35.95 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 109.603 -0.517 . . . . 42.62 109.603 178.588 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 105' ' ' GLY . . . . . . . . . . . . . . . 165.76 -161.42 34.95 Favored Glycine 0 N--CA 1.451 -0.358 0 N-CA-C 110.173 -1.171 . . . . 37.67 110.173 -179.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 106' ' ' TRP . . . . . 0.46 ' HB3' HD23 ' D' ' 119' ' ' LEU . 51.6 p-90 -159.1 167.6 28.8 Favored 'General case' 0 C--N 1.33 -0.259 0 C-N-CA 119.081 -1.048 . . . . 38.92 109.906 179.256 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 107' ' ' LYS . . . . . . . . . . . . . 39.6 mttp -138.42 137.52 37.31 Favored 'General case' 0 CA--C 1.52 -0.21 0 CA-C-N 114.875 -1.057 . . . . 44.7 108.695 179.232 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 108' ' ' LYS . . . . . . . . . . . . . 9.7 ttmm -143.02 133.99 25.57 Favored 'General case' 0 C--N 1.33 -0.245 0 N-CA-C 107.917 -1.142 . . . . 53.69 107.917 -171.957 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 109' ' ' TRP . . . . . . . . . . . . . 30.4 p90 -159.67 144.57 15.28 Favored 'General case' 0 C--N 1.329 -0.284 0 C-N-CA 119.843 -0.743 . . . . 42.46 109.625 178.333 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 110' ' ' ILE . . . . . . . . . . . . . 24.8 mm -89.58 138.92 18.34 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 N-CA-C 109.111 -0.7 . . . . 45.0 109.111 179.098 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 111' ' ' GLU . . . . . . . . . . . . . 20.9 tp10 -130.18 112.73 13.67 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 107.841 -1.17 . . . . 51.39 107.841 171.561 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 112' ' ' GLY . . . . . . . . . . . . . . . 58.27 -96.07 0.06 OUTLIER Glycine 0 N--CA 1.449 -0.485 0 CA-C-N 116.239 -0.437 . . . . 52.14 113.034 -178.378 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 113' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -118.09 4.2 12.04 Favored 'General case' 0 C--O 1.237 0.41 0 N-CA-C 113.366 0.876 . . . . 69.35 113.366 -178.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 114' ' ' LYS . . . . . . . . . . . . . 12.2 mtmm -119.21 154.33 33.55 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 118.832 0.742 . . . . 60.26 110.774 -174.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 115' ' ' LEU . . . . . 0.615 ' HB3' ' HB2' ' D' ' 130' ' ' PHE . 8.3 tt -107.31 110.67 22.74 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 108.037 -1.098 . . . . 44.68 108.037 178.175 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 116' ' ' TYR . . . . . . . . . . . . . 34.2 m-85 -91.45 126.89 36.69 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 109.388 -0.597 . . . . 59.78 109.388 177.001 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 117' ' ' LEU . . . . . . . . . . . . . 30.8 tp -131.15 143.25 50.48 Favored 'General case' 0 C--O 1.233 0.216 0 N-CA-C 109.373 -0.603 . . . . 43.59 109.373 -178.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 118' ' ' GLU . . . . . . . . . . . . . 78.8 mt-10 -140.94 110.81 6.51 Favored 'General case' 0 C--O 1.235 0.298 0 N-CA-C 108.217 -1.031 . . . . 43.6 108.217 179.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 119' ' ' LEU . . . . . 0.46 HD23 ' HB3' ' D' ' 106' ' ' TRP . 4.5 mt -97.24 133.8 41.4 Favored 'General case' 0 C--N 1.329 -0.29 0 N-CA-C 109.111 -0.7 . . . . 41.04 109.111 178.141 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 120' ' ' THR . . . . . . . . . . . . . 72.4 p -126.74 136.07 51.93 Favored 'General case' 0 C--O 1.237 0.401 0 CA-C-O 120.793 0.33 . . . . 37.74 110.532 -175.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 121' ' ' CYS . . . . . . . . . . . . . 43.0 t -149.67 121.14 7.94 Favored 'General case' 0 C--O 1.235 0.304 0 N-CA-C 108.413 -0.958 . . . . 36.99 108.413 173.656 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 122' ' ' GLY . . . . . . . . . . . . . . . 64.47 -122.92 26.22 Favored Glycine 0 C--O 1.237 0.314 0 N-CA-C 110.165 -1.174 . . . . 50.71 110.165 -177.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 123' ' ' ASP . . . . . . . . . . . . . 46.6 p-10 -96.09 -5.27 41.24 Favored 'General case' 0 C--O 1.235 0.338 0 N-CA-C 112.813 0.671 . . . . 63.58 112.813 173.585 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 124' ' ' GLN . . . . . . . . . . . . . 99.7 mm-40 -87.94 133.08 34.01 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 118.115 0.416 . . . . 42.66 110.589 -173.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 125' ' ' VAL . . . . . . . . . . . . . 94.2 t -125.59 127.14 71.38 Favored 'Isoleucine or valine' 0 C--O 1.237 0.402 0 N-CA-C 108.199 -1.037 . . . . 36.14 108.199 178.192 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 126' ' ' CYS . . . . . . . . . . . . . 2.5 t -114.23 127.05 55.7 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 123.524 0.729 . . . . 35.18 109.038 177.882 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 127' ' ' ARG . . . . . . . . . . . . . 63.9 mtt-85 -110.09 116.46 31.6 Favored 'General case' 0 C--O 1.236 0.382 0 N-CA-C 109.16 -0.681 . . . . 40.51 109.16 -176.255 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 128' ' ' GLN . . . . . . . . . . . . . 86.2 mt-30 -116.1 141.96 47.44 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 123.524 0.73 . . . . 37.47 109.879 -179.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 129' ' ' VAL . . . . . . . . . . . . . 85.5 t -124.76 128.25 73.21 Favored 'Isoleucine or valine' 0 C--O 1.236 0.374 0 N-CA-C 108.231 -1.026 . . . . 42.07 108.231 178.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 130' ' ' PHE . . . . . 0.615 ' HB2' ' HB3' ' D' ' 115' ' ' LEU . 48.6 m-85 -117.0 153.22 33.04 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 123.162 0.585 . . . . 51.68 109.672 178.942 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 131' ' ' LYS . . . . . 0.488 ' HB2' ' OE2' ' B' ' 11' ' ' GLU . 2.2 ttpp -117.37 141.18 48.64 Favored 'General case' 0 C--O 1.235 0.293 0 CA-C-N 116.004 -0.544 . . . . 61.57 109.865 174.037 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' D' D ' 132' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -74.57 144.76 43.86 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.772 -0.649 . . . . 53.93 110.518 178.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 133' ' ' LYS . . . . . . . . . . . . . 13.2 mmmm . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 115.988 -0.551 . . . . 66.64 110.621 176.909 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' ACT . . . . . 0.472 ' H2 ' HD21 ' C' ' 117' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 201' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 202' ' ' GOL . . . . . 0.589 ' H32' ' H ' ' B' ' 81' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 201' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 202' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 203' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 204' ' ' ACT . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 205' ' ' ACT . . . . . 0.486 ' H1 ' ' HE2' ' C' ' 60' ' ' TYR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 206' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 201' ' ' ACT . . . . . 0.456 ' C ' ' HE1' ' D' ' 106' ' ' TRP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 202' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 203' ' ' RET . . . . . 0.55 ' H32' ' HB2' ' D' ' 58' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 ' B' B ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 302' ' ' HOH . . . . . 0.539 ' O ' ' NZ ' ' D' ' 75' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_