data_2int_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 2int _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' HIS . . . . . 0.458 ' CE1' ' SG ' ' A' ' 127' ' ' CYS . 8.6 t60 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 117.354 -1.308 . . . . 42.920000000000002 108.773 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . 0.295 28.1 mmtm -100.5 144.32 29.63 Favored 'General case' 0 N--CA 1.497 1.878 0 CA-C-O 124.337 2.018 . . . . 41.090000000000003 108.513 177.399 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 99.9 m -127.83 34.13 4.68 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 126.919 2.088 . . . . 28.850000000000001 113.781 -176.687 -65.493 -65.524 -76.527 104.368 2.017 109.532 -69.469 -81.816 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -70.2 153.67 42.83 Favored 'General case' 0 C--N 1.282 -2.351 0 C-N-CA 127.118 2.167 . . . . 31.609999999999999 111.608 179.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -55.55 -25.66 18.24 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.819 0 C-N-CA 128.013 2.525 . . . . 21.82 109.73 177.815 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 57.5 m -50.94 -41.93 59.35 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.084 1.754 . . . . 18.190000000000001 111.32 178.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.86 -39.73 65.91 Favored 'General case' 0 C--N 1.304 -1.392 0 C-N-CA 124.378 1.071 . . . . 19.25 110.329 175.897 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -71.57 -31.32 66.85 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 118.946 -1.101 . . . . 15.77 110.576 -179.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -72.09 -35.5 69.25 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-O 116.427 -1.749 . . . . 23.059999999999999 107.093 178.196 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.9 mt -65.5 -50.82 69.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 O-C-N 125.462 1.726 . . . . 12.84 110.202 176.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 79.3 mt -58.69 -40.83 80.61 Favored 'Isoleucine or valine' 0 C--O 1.254 1.294 0 CA-C-O 123.246 1.498 . . . . 15.08 112.236 178.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 8.3 mtpp -60.72 -51.78 67.88 Favored 'General case' 0 C--O 1.253 1.252 0 O-C-N 118.137 -2.852 . . . . 29.309999999999999 110.13 177.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 18.7 m -58.02 -48.07 81.17 Favored 'General case' 0 C--O 1.261 1.68 0 O-C-N 120.297 -1.502 . . . . 18.91 109.163 176.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' LEU . . . . . . . . . . . . . 46.5 mt -56.18 -37.75 70.02 Favored 'General case' 0 C--O 1.259 1.587 0 CA-C-N 119.843 1.201 . . . . 21.18 111.39 179.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -68.17 -31.13 70.46 Favored 'General case' 0 C--O 1.275 2.42 0 N-CA-C 112.928 0.714 . . . . 26.0 112.928 177.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -83.46 -27.75 29.25 Favored 'General case' 0 C--O 1.247 0.972 0 O-C-N 116.756 -3.715 . . . . 27.32 108.584 175.628 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.0 mt -69.39 -50.63 44.24 Favored 'General case' 0 C--O 1.207 -1.146 0 CA-C-O 117.523 -1.227 . . . . 22.59 111.559 -179.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 80.8 p -73.01 -19.96 61.1 Favored 'General case' 0 C--O 1.259 1.567 0 N-CA-C 115.9 1.815 . . . . 28.050000000000001 115.9 -176.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -87.45 -6.49 58.39 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 116.656 -2.017 . . . . 36.219999999999999 109.945 -177.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -123.65 108.05 12.15 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 125.501 1.751 . . . . 40.07 110.873 -178.89 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -92.77 142.45 27.33 Favored 'General case' 0 C--N 1.305 -1.351 0 O-C-N 128.637 3.71 . . . . 38.090000000000003 106.914 176.488 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 15.0 m -134.0 -168.69 2.17 Favored 'General case' 0 C--O 1.254 1.322 0 O-C-N 119.399 -2.063 . . . . 32.710000000000001 106.271 -177.136 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 2.8 mp -71.52 -34.5 70.12 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-O 125.234 2.445 . . . . 30.870000000000001 109.72 176.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -81.41 -28.32 34.36 Favored 'General case' 0 C--O 1.263 1.803 1 N-CA-C 121.978 4.066 . . . . 24.16 121.978 -175.422 -125.712 68.742 74.533 112.615 2.057 101.093 -143.003 -51.555 3 3 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 67.3 p -63.26 -16.23 59.62 Favored 'General case' 0 C--N 1.282 -2.367 0 C-N-CA 130.292 3.437 . . . . 22.379999999999999 113.788 179.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.295 49.9 mt-10 -97.79 2.14 49.11 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 116.574 -2.05 . . . . 33.899999999999999 108.028 175.856 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 75.3 mt -79.26 167.95 20.24 Favored 'General case' 0 CA--C 1.558 1.259 0 N-CA-C 102.227 -3.249 . . . . 20.489999999999998 102.227 173.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' THR . . . . . 0.488 ' CG2' ' OE1' ' A' ' 106' ' ' GLN 0.292 0.9 OUTLIER -93.84 155.67 17.07 Favored 'General case' 0 C--N 1.277 -2.554 1 N-CA-C 125.156 5.243 . . . . 23.640000000000001 125.156 -172.607 . . . . . . . . 5 4 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 1.0 OUTLIER -143.42 154.75 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.197 0 N-CA-C 105.366 -2.087 . . . . 21.469999999999999 105.366 178.091 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 30.4 m -65.22 124.13 21.38 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-N 120.697 1.59 . . . . 21.510000000000002 108.484 175.972 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -69.53 82.57 0.41 Allowed 'General case' 0 C--N 1.305 -1.327 0 CA-C-O 123.274 1.512 . . . . 22.25 110.725 177.532 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -60.06 -16.36 11.58 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.919 0 C-N-CA 126.302 1.841 . . . . 26.030000000000001 109.668 179.586 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -105.53 31.63 4.83 Favored 'General case' 0 C--N 1.302 -1.475 0 C-N-CA 126.802 2.041 . . . . 24.75 114.138 -178.624 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -116.9 2.0 12.73 Favored 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 127.485 2.314 . . . . 25.440000000000001 105.858 178.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.15 157.28 34.89 Favored 'General case' 0 C--N 1.291 -1.943 0 N-CA-C 103.877 -2.638 . . . . 28.5 103.877 175.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 70.1 p -109.24 47.02 0.95 Allowed 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 103.186 -2.894 . . . . 34.280000000000001 103.186 177.163 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LYS . . . . . 0.57 ' O ' ' NZ ' ' A' ' 37' ' ' LYS . 0.0 OUTLIER 163.57 66.2 0.0 OUTLIER 'General case' 0 C--O 1.272 2.256 0 CA-C-O 115.733 -2.08 . . . . 42.43 116.26 -178.934 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ASN . . . . . 0.405 ' OD1' ' OG1' ' A' ' 44' ' ' THR 0.272 7.6 t-20 -62.68 140.25 58.69 Favored 'General case' 0 N--CA 1.508 2.435 0 N-CA-C 103.228 -2.879 . . . . 44.740000000000002 103.228 176.995 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' THR . . . . . . . . . . . . 0.266 2.5 p -112.87 111.45 22.22 Favored 'General case' 0 C--O 1.246 0.9 0 CA-C-O 115.231 -2.319 . . . . 39.880000000000003 116.076 -175.023 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 4.0 m 70.22 127.73 0.03 OUTLIER 'General case' 0 C--O 1.253 1.257 0 CA-C-O 115.149 -2.358 . . . . 34.829999999999998 107.091 179.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -70.14 -12.81 61.86 Favored 'General case' 0 C--N 1.321 -0.644 0 O-C-N 126.477 2.361 . . . . 29.920000000000002 115.029 179.895 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 6.8 mmtm -90.01 -23.54 21.46 Favored 'General case' 0 C--N 1.29 -2.012 0 CA-C-O 124.199 1.952 . . . . 33.109999999999999 107.98 178.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -78.85 -40.52 32.43 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 111.849 -2.432 . . . . 36.060000000000002 106.612 177.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' THR . . . . . 0.405 ' OG1' ' OD1' ' A' ' 38' ' ' ASN . 95.9 m -57.93 -47.7 82.1 Favored 'General case' 0 C--N 1.289 -2.05 0 O-C-N 127.771 3.17 . . . . 23.940000000000001 105.954 176.024 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 20.2 m-30 -61.63 -43.51 98.72 Favored 'General case' 0 N--CA 1.444 -0.748 0 O-C-N 125.214 1.571 . . . . 25.91 111.844 -177.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 44.6 t -61.67 -42.39 98.85 Favored 'General case' 0 N--CA 1.482 1.152 0 O-C-N 126.531 2.394 . . . . 22.760000000000002 107.524 -179.565 -176.908 -84.506 -80.74 100.114 2.058 107.496 -102.715 33.477 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ARG . . . . . 0.586 ' NH1' ' O ' ' A' ' 100' ' ' PRO 0.259 32.1 mtp85 -62.15 -44.78 95.87 Favored 'General case' 0 C--O 1.254 1.319 0 CA-C-N 113.023 -1.899 . . . . 35.020000000000003 113.293 -178.875 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.68 -39.71 73.37 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 108.605 -0.887 . . . . 15.789999999999999 108.605 178.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -62.3 -45.59 92.59 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 127.268 2.227 . . . . 14.81 111.085 179.435 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 52.0 m -60.97 -41.56 96.65 Favored 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 124.738 1.215 . . . . 17.199999999999999 112.728 176.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . 0.446 1.0 OUTLIER -77.62 -32.04 17.95 Favored 'Isoleucine or valine' 0 C--O 1.268 2.06 0 O-C-N 119.774 -1.829 . . . . 19.390000000000001 111.117 -177.815 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 95.6 mt -72.12 -30.69 65.31 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 118.262 -2.774 . . . . 17.219999999999999 107.961 175.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 44.5 ttt-85 -70.06 -38.42 75.77 Favored 'General case' 0 C--N 1.312 -1.033 0 O-C-N 119.908 -1.745 . . . . 23.98 112.481 179.328 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -64.8 -45.33 86.72 Favored 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 105.958 -1.867 . . . . 24.960000000000001 105.958 177.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 33.7 t80 -60.5 -66.99 0.44 Allowed 'General case' 0 C--O 1.251 1.154 0 O-C-N 120.056 -1.653 . . . . 15.68 111.184 -178.093 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 1.6 p90 -56.49 -36.37 69.05 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 116.644 -1.645 . . . . 17.59 114.069 -179.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.8 m -63.59 -45.34 90.86 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-N 122.056 2.207 . . . . 24.800000000000001 109.037 -177.572 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 28.4 m170 -81.39 -17.39 49.17 Favored 'General case' 0 C--O 1.245 0.831 0 O-C-N 127.997 3.311 . . . . 31.010000000000002 115.27 -178.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' HIS . . . . . . . . . . . . . 96.2 m-70 -111.67 4.04 18.28 Favored 'General case' 0 CA--C 1.501 -0.911 0 CA-C-O 116.294 -1.812 . . . . 20.789999999999999 114.755 -177.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 54.8 tt0 -61.12 -37.65 83.56 Favored 'General case' 0 C--N 1.297 -1.694 0 O-C-N 124.582 1.176 . . . . 29.690000000000001 112.237 -177.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -120.55 30.74 6.78 Favored 'General case' 0 C--N 1.312 -1.052 0 O-C-N 124.581 1.176 . . . . 34.560000000000002 108.94 179.1 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 36.2 t0 -73.97 119.43 18.16 Favored 'General case' 0 C--N 1.286 -2.157 0 N-CA-C 107.259 -1.386 . . . . 17.469999999999999 107.259 178.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 76.3 p -57.87 -28.97 64.64 Favored 'General case' 0 CA--C 1.501 -0.925 0 O-C-N 125.84 1.962 . . . . 20.620000000000001 109.03 -178.534 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 79.9 mtm180 -68.88 -21.23 64.26 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 116.164 -2.214 . . . . 17.73 112.303 179.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 35.7 m -108.51 -22.63 12.2 Favored 'General case' 0 C--O 1.248 1.017 0 N-CA-C 117.546 2.424 . . . . 21.899999999999999 117.546 -176.533 -51.555 -143.003 74.533 101.093 2.057 112.615 68.742 -125.712 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 78.5 mt -55.2 -31.65 61.59 Favored 'General case' 0 C--O 1.26 1.624 0 N-CA-C 118.078 2.621 . . . . 16.579999999999998 118.078 -176.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 88.7 165.31 41.15 Favored Glycine 0 C--N 1.277 -2.699 0 C-N-CA 129.118 3.247 . . . . 16.16 113.83 178.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -96.53 -50.96 4.52 Favored 'General case' 0 C--N 1.31 -1.148 0 O-C-N 127.702 2.648 . . . . 16.940000000000001 110.869 176.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 39.7 p -89.55 171.75 9.47 Favored 'General case' 0 CA--C 1.507 -0.674 0 O-C-N 119.959 -1.713 . . . . 18.57 110.224 -176.986 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.08 -29.78 67.95 Favored 'General case' 0 N--CA 1.478 0.951 0 O-C-N 126.506 2.379 . . . . 20.789999999999999 108.698 178.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -65.78 -54.96 20.03 Favored 'General case' 0 C--O 1.255 1.391 0 CA-C-O 123.188 1.471 . . . . 33.299999999999997 108.735 -178.647 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 82.5 mt-30 -54.98 -42.69 72.77 Favored 'General case' 0 C--O 1.255 1.353 0 CA-C-N 114.42 -1.264 . . . . 21.09 111.979 178.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -66.84 -40.24 87.89 Favored 'General case' 0 C--O 1.253 1.26 0 O-C-N 124.228 0.955 . . . . 19.68 112.083 -178.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' HIS . . . . . . . . . . . . . 6.7 m-70 -67.41 -42.2 83.64 Favored 'General case' 0 C--N 1.313 -1.01 0 O-C-N 125.109 1.506 . . . . 31.379999999999999 109.35 -179.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 73.8 mtt85 -61.5 -44.13 97.62 Favored 'General case' 0 C--N 1.306 -1.311 0 O-C-N 125.982 2.051 . . . . 32.689999999999998 109.892 179.797 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 39.8 t-80 -57.27 -47.29 81.81 Favored 'General case' 0 C--N 1.321 -0.649 0 O-C-N 127.419 2.949 . . . . 16.91 111.162 179.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' LYS . . . . . . . . . . . . . 42.1 mtmt -58.25 -40.0 80.65 Favored 'General case' 0 CA--C 1.553 1.088 0 O-C-N 126.571 2.42 . . . . 30.199999999999999 109.072 -178.408 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLN . . . . . 0.484 ' NE2' ' NH2' ' A' ' 81' ' ' ARG . 0.8 OUTLIER -72.11 -38.58 69.28 Favored 'General case' 0 C--N 1.315 -0.9 0 O-C-N 126.682 2.489 . . . . 31.199999999999999 109.577 -177.16 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.8 tp -60.7 -50.58 72.9 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-O 115.361 -2.256 . . . . 16.190000000000001 107.098 176.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . 0.253 25.7 mm -60.97 -39.32 81.76 Favored 'Isoleucine or valine' 0 C--O 1.256 1.42 0 O-C-N 125.511 1.757 . . . . 14.789999999999999 113.048 -179.326 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' ARG . . . . . 0.484 ' NH2' ' NE2' ' A' ' 78' ' ' GLN . 0.8 OUTLIER -57.32 -53.43 58.26 Favored 'General case' 0 C--N 1.301 -1.533 0 C-N-CA 126.64 1.976 . . . . 29.309999999999999 109.97 178.669 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 22.2 m-30 -64.46 -40.58 95.98 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 125.772 1.629 . . . . 21.469999999999999 113.867 -179.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 57.9 mt -61.74 -37.88 85.9 Favored 'General case' 0 C--O 1.264 1.842 0 O-C-N 124.421 1.076 . . . . 14.94 110.337 176.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 90.0 mttt -72.62 -36.32 68.04 Favored 'General case' 0 C--N 1.312 -1.027 0 C-N-CA 124.015 0.926 . . . . 20.559999999999999 111.034 179.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 24.5 ttm180 -62.71 -49.22 75.93 Favored 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 124.264 1.025 . . . . 23.739999999999998 110.619 176.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 25.5 tp -65.77 -45.37 82.74 Favored 'General case' 0 C--N 1.303 -1.455 0 C-N-CA 127.728 2.411 . . . . 16.059999999999999 108.405 -179.217 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ASP . . . . . . . . . . . . . 3.2 t70 -60.11 -48.96 79.53 Favored 'General case' 0 C--O 1.258 1.517 0 CA-C-O 126.291 2.948 . . . . 18.02 114.07 178.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -60.6 -34.55 74.38 Favored 'General case' 0 N--CA 1.495 1.788 0 CA-C-N 113.278 -1.783 . . . . 28.77 110.245 178.934 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 52.0 m-20 -66.51 -46.04 77.54 Favored 'General case' 0 C--O 1.22 -0.476 0 O-C-N 120.321 -1.487 . . . . 16.199999999999999 110.042 178.557 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -60.69 -52.14 66.39 Favored 'General case' 0 C--N 1.291 -1.961 0 C-N-CA 127.609 2.364 . . . . 17.239999999999998 107.287 -178.017 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 53.3 m95 -59.75 -39.57 85.21 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.79 -0.641 . . . . 18.66 111.381 178.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -66.56 -32.15 80.73 Favored Glycine 0 CA--C 1.525 0.706 0 CA-C-O 117.928 -1.485 . . . . 18.68 110.014 -179.431 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 1.3 tp -79.29 -39.12 33.7 Favored 'General case' 0 C--N 1.303 -1.415 0 CA-C-O 124.866 2.269 . . . . 27.32 113.263 179.878 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -60.99 -54.98 38.31 Favored 'General case' 0 N--CA 1.446 -0.644 0 O-C-N 119.514 -1.991 . . . . 30.539999999999999 108.076 178.066 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 63.75 28.54 72.76 Favored Glycine 0 CA--C 1.539 1.589 0 N-CA-C 105.401 -3.079 . . . . 32.270000000000003 105.401 -177.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . 0.276 7.6 tp -143.87 131.45 21.16 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 101.233 -3.617 . . . . 36.380000000000003 101.233 -177.771 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -117.73 8.12 12.68 Favored 'General case' 0 C--N 1.308 -1.232 0 O-C-N 126.104 2.128 . . . . 35.920000000000002 114.624 -173.285 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -153.83 124.81 7.31 Favored 'General case' 0 C--N 1.306 -1.302 0 O-C-N 127.921 3.263 . . . . 41.479999999999997 106.198 179.886 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -152.4 161.59 28.88 Favored Pre-proline 0 C--N 1.298 -1.639 0 N-CA-C 105.025 -2.213 . . . . 37.810000000000002 105.025 -179.138 33.477 -102.715 -80.74 107.496 2.058 100.114 -84.506 -176.908 2 2 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' PRO . . . . . 0.586 ' O ' ' NH1' ' A' ' 47' ' ' ARG . 1.6 Cg_endo -98.28 122.16 0.15 Allowed 'Trans proline' 0 C--N 1.309 -1.54 1 C-N-CA 125.788 4.325 . . . . 38.149999999999999 113.694 -177.967 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . 0.265 2.3 t -111.88 110.32 31.75 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.581 0 N-CA-C 103.09 -2.93 . . . . 37.189999999999998 103.09 179.704 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 53.3 pttt -124.89 0.98 8.05 Favored 'General case' 0 C--O 1.249 1.075 0 N-CA-C 117.301 2.334 . . . . 40.710000000000001 117.301 -174.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 42.5 mp0 -67.35 167.08 13.16 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-O 124.525 2.107 . . . . 39.969999999999999 110.146 179.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -129.27 -22.71 3.06 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-O 117.311 -1.328 . . . . 32.890000000000001 110.521 -178.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 20.7 t-20 -67.16 150.5 49.04 Favored 'General case' 0 CA--C 1.568 1.657 1 N-CA-C 98.386 -4.672 . . . . 31.890000000000001 98.386 176.867 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' GLN . . . . . 0.488 ' OE1' ' CG2' ' A' ' 28' ' ' THR . 61.5 mm-40 -121.77 153.22 38.57 Favored 'General case' 0 C--N 1.283 -2.284 0 O-C-N 128.565 3.665 . . . . 25.699999999999999 103.485 -178.803 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 2.3 p -135.15 169.96 16.65 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 101.547 -3.501 . . . . 24.77 101.547 176.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 77.4 p -72.6 164.1 27.0 Favored 'General case' 0 N--CA 1.502 2.168 0 N-CA-C 106.467 -1.679 . . . . 19.109999999999999 106.467 176.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -60.84 -39.18 88.12 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 123.219 1.485 . . . . 18.079999999999998 107.536 178.14 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -52.81 -49.57 65.37 Favored 'General case' 0 C--O 1.267 1.998 0 C-N-CA 126.887 2.075 . . . . 30.800000000000001 113.266 179.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -67.44 -44.47 78.64 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 122.532 2.424 . . . . 24.329999999999998 111.299 177.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -53.56 -47.09 70.38 Favored 'General case' 0 C--N 1.297 -1.688 0 C-N-CA 128.133 2.573 . . . . 19.960000000000001 110.32 177.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -70.76 -33.75 71.12 Favored 'General case' 0 C--N 1.281 -2.378 0 C-N-CA 129.728 3.211 . . . . 16.73 111.913 -178.559 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' GLU . . . . . 0.405 ' OE2' ' NZ ' ' A' ' 117' ' ' LYS . 3.5 tp10 -73.5 -39.66 64.67 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 113.564 -1.653 . . . . 30.399999999999999 108.659 178.235 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' ARG . . . . . 0.522 ' NH2' ' CG2' ' A' ' 118' ' ' THR . 5.5 tpm_? -64.75 -51.4 62.51 Favored 'General case' 0 C--N 1.313 -1.022 0 O-C-N 119.084 -2.26 . . . . 33.240000000000002 108.79 178.962 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 42.9 tp -56.26 -40.05 73.59 Favored 'General case' 0 C--O 1.252 1.209 0 C-N-CA 125.132 1.373 . . . . 15.279999999999999 109.844 179.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' LYS . . . . . 0.405 ' NZ ' ' OE2' ' A' ' 114' ' ' GLU . 13.8 ttmt -57.86 -42.78 85.2 Favored 'General case' 0 C--O 1.251 1.165 0 N-CA-C 108.564 -0.902 . . . . 23.440000000000001 108.564 179.157 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' THR . . . . . 0.522 ' CG2' ' NH2' ' A' ' 115' ' ' ARG . 41.0 m -64.81 -45.03 87.96 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 114.378 -2.725 . . . . 18.129999999999999 111.642 -179.124 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ILE . . . . . . . . . . . . 0.255 0.7 OUTLIER -71.28 -29.7 37.02 Favored 'Isoleucine or valine' 0 C--O 1.257 1.5 0 O-C-N 125.202 1.564 . . . . 20.460000000000001 109.272 179.674 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 89.8 mmm -67.75 -43.45 79.84 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 119.732 -1.855 . . . . 18.57 107.015 179.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' ARG . . . . . . . . . . . . . 53.9 mtt-85 -71.25 -26.09 62.76 Favored 'General case' 0 C--N 1.301 -1.536 0 CA-C-N 120.984 1.72 . . . . 37.229999999999997 111.163 176.542 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' GLU . . . . . 0.406 ' O ' ' C ' ' A' ' 123' ' ' LYS . 37.9 tp10 -70.47 -48.06 57.62 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 102.921 -2.992 . . . . 22.190000000000001 102.921 176.503 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' LYS . . . . . 0.406 ' C ' ' O ' ' A' ' 122' ' ' GLU . 0.0 OUTLIER -51.13 -53.5 33.77 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 116.85 -1.94 . . . . 24.710000000000001 107.45 179.09 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -50.29 -48.45 55.05 Favored 'General case' 0 C--N 1.305 -1.341 0 CA-C-O 116.724 -1.608 . . . . 19.370000000000001 112.198 -179.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 39.1 m -56.92 -45.4 82.72 Favored 'General case' 0 C--N 1.304 -1.374 0 C-N-CA 127.052 2.141 . . . . 22.620000000000001 113.743 177.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' LYS . . . . . . . . . . . . . 9.2 mmmt -67.36 -11.22 57.14 Favored 'General case' 0 C--O 1.249 1.051 0 O-C-N 119.881 -1.762 . . . . 30.870000000000001 110.785 179.297 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' CYS . . . . . 0.458 ' SG ' ' CE1' ' A' ' 1' ' ' HIS . 15.9 m -95.95 -31.27 13.18 Favored 'General case' 0 C--O 1.246 0.88 0 N-CA-C 114.751 1.389 . . . . 21.640000000000001 114.751 -178.743 -81.816 -69.469 -76.527 109.532 2.017 104.368 -65.524 -65.493 2 2 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 20.2 p -116.13 154.83 29.3 Favored 'General case' 0 N--CA 1.443 -0.792 0 O-C-N 124.728 1.268 . . . . 29.02 111.745 -179.102 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 4.3 p . . . . . 0 C--N 1.302 -1.483 0 N-CA-C 100.226 -3.99 . . . . 33.399999999999999 100.226 175.126 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' HIS . . . . . 0.458 ' CE1' ' SG ' ' A' ' 127' ' ' CYS . 8.6 t60 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 117.354 -1.308 . . . . 42.92 108.773 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . 0.295 28.1 mmtm -100.5 144.32 29.63 Favored 'General case' 0 N--CA 1.497 1.878 0 CA-C-O 124.337 2.018 . . . . 41.09 108.513 177.399 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 99.9 m -127.83 34.13 4.68 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 126.919 2.088 . . . . 28.85 113.781 -176.687 -65.493 -65.524 -76.527 104.368 2.017 109.532 -69.469 -81.816 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -70.2 153.67 42.83 Favored 'General case' 0 C--N 1.282 -2.351 0 C-N-CA 127.118 2.167 . . . . 31.61 111.608 179.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -55.55 -25.66 18.24 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.819 0 C-N-CA 128.013 2.525 . . . . 21.82 109.73 177.815 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 57.5 m -50.94 -41.93 59.35 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.084 1.754 . . . . 18.19 111.32 178.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.86 -39.73 65.91 Favored 'General case' 0 C--N 1.304 -1.392 0 C-N-CA 124.378 1.071 . . . . 19.25 110.329 175.897 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 54.5 tp60 -71.57 -31.32 66.85 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 118.946 -1.101 . . . . 15.77 110.576 -179.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -72.09 -35.5 69.25 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-O 116.427 -1.749 . . . . 23.06 107.093 178.196 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.9 mt -65.5 -50.82 69.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 O-C-N 125.462 1.726 . . . . 12.84 110.202 176.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 79.3 mt -58.69 -40.83 80.61 Favored 'Isoleucine or valine' 0 C--O 1.254 1.294 0 CA-C-O 123.246 1.498 . . . . 15.08 112.236 178.199 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 8.3 mtpp -60.72 -51.78 67.88 Favored 'General case' 0 C--O 1.253 1.252 0 O-C-N 118.137 -2.852 . . . . 29.31 110.13 177.763 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 18.7 m -58.02 -48.07 81.17 Favored 'General case' 0 C--O 1.261 1.68 0 O-C-N 120.297 -1.502 . . . . 18.91 109.163 176.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' LEU . . . . . 0.494 HD13 ' HA ' ' A' ' 117' ' ' LYS . 46.5 mt -56.18 -37.75 70.02 Favored 'General case' 0 C--O 1.259 1.587 0 CA-C-N 119.843 1.201 . . . . 21.18 111.39 179.899 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 97.3 m-20 -68.17 -31.13 70.46 Favored 'General case' 0 C--O 1.275 2.42 0 N-CA-C 112.928 0.714 . . . . 26.0 112.928 177.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -83.46 -27.75 29.25 Favored 'General case' 0 C--O 1.247 0.972 0 O-C-N 116.756 -3.715 . . . . 27.32 108.584 175.628 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.0 mt -69.39 -50.63 44.24 Favored 'General case' 0 C--O 1.207 -1.146 0 CA-C-O 117.523 -1.227 . . . . 22.59 111.559 -179.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 80.8 p -73.01 -19.96 61.1 Favored 'General case' 0 C--O 1.259 1.567 0 N-CA-C 115.9 1.815 . . . . 28.05 115.9 -176.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -87.45 -6.49 58.39 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 116.656 -2.017 . . . . 36.22 109.945 -177.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -123.65 108.05 12.15 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 125.501 1.751 . . . . 40.07 110.873 -178.89 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' LYS . . . . . 0.417 ' HD3' ' N ' ' A' ' 22' ' ' THR . 1.0 OUTLIER -92.77 142.45 27.33 Favored 'General case' 0 C--N 1.305 -1.351 0 O-C-N 128.637 3.71 . . . . 38.09 106.914 176.488 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 22' ' ' THR . . . . . 0.424 HG22 ' H ' ' A' ' 24' ' ' CYS . 15.0 m -134.0 -168.69 2.17 Favored 'General case' 0 C--O 1.254 1.322 0 O-C-N 119.399 -2.063 . . . . 32.71 106.271 -177.136 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' LEU . . . . . 0.413 ' N ' HG22 ' A' ' 22' ' ' THR . 2.8 mp -71.52 -34.5 70.12 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-O 125.234 2.445 . . . . 30.87 109.72 176.554 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' CYS . . . . . 0.424 ' H ' HG22 ' A' ' 22' ' ' THR . 0.1 OUTLIER -81.41 -28.32 34.36 Favored 'General case' 0 C--O 1.263 1.803 1 N-CA-C 121.978 4.066 . . . . 24.16 121.978 -175.422 -125.712 68.742 74.533 112.615 2.057 101.093 -143.003 -51.555 4 4 . 1 . 001 ecloud build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 67.3 p -63.26 -16.23 59.62 Favored 'General case' 0 C--N 1.282 -2.367 0 C-N-CA 130.292 3.437 . . . . 22.38 113.788 179.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.295 49.9 mt-10 -97.79 2.14 49.11 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 116.574 -2.05 . . . . 33.9 108.028 175.856 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LEU . . . . . 0.408 HD13 ' CE1' ' A' ' 59' ' ' HIS . 75.3 mt -79.26 167.95 20.24 Favored 'General case' 0 CA--C 1.558 1.259 0 N-CA-C 102.227 -3.249 . . . . 20.49 102.227 173.799 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' THR . . . . . 0.658 HG23 ' OE1' ' A' ' 106' ' ' GLN 0.292 0.9 OUTLIER -93.84 155.67 17.07 Favored 'General case' 0 C--N 1.277 -2.554 1 N-CA-C 125.156 5.243 . . . . 23.64 125.156 -172.607 . . . . . . . . 5 4 . 1 . 001 ecloud build full ' A' A ' 29' ' ' VAL . . . . . 0.829 HG13 HG13 ' A' ' 51' ' ' VAL . 1.0 OUTLIER -143.42 154.75 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.197 0 N-CA-C 105.366 -2.087 . . . . 21.47 105.366 178.091 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 30.4 m -65.22 124.13 21.38 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-N 120.697 1.59 . . . . 21.51 108.484 175.972 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -69.53 82.57 0.41 Allowed 'General case' 0 C--N 1.305 -1.327 0 CA-C-O 123.274 1.512 . . . . 22.25 110.725 177.532 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' ILE . . . . . 0.801 HD11 HG13 ' A' ' 101' ' ' VAL . 1.0 OUTLIER -60.06 -16.36 11.58 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.919 0 C-N-CA 126.302 1.841 . . . . 26.03 109.668 179.586 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -105.53 31.63 4.83 Favored 'General case' 0 C--N 1.302 -1.475 0 C-N-CA 126.802 2.041 . . . . 24.75 114.138 -178.624 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -116.9 2.0 12.73 Favored 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 127.485 2.314 . . . . 25.44 105.858 178.121 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.15 157.28 34.89 Favored 'General case' 0 C--N 1.291 -1.943 0 N-CA-C 103.877 -2.638 . . . . 28.5 103.877 175.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' SER . . . . . 0.48 ' O ' ' HB3' ' A' ' 37' ' ' LYS . 70.1 p -109.24 47.02 0.95 Allowed 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 103.186 -2.894 . . . . 34.28 103.186 177.163 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LYS . . . . . 0.48 ' HB3' ' O ' ' A' ' 36' ' ' SER . 0.0 OUTLIER 163.57 66.2 0.0 OUTLIER 'General case' 0 C--O 1.272 2.256 0 CA-C-O 115.733 -2.08 . . . . 42.43 116.26 -178.934 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . 0.272 7.6 t-20 -62.68 140.25 58.69 Favored 'General case' 0 N--CA 1.508 2.435 0 N-CA-C 103.228 -2.879 . . . . 44.74 103.228 176.995 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' THR . . . . . 0.679 ' O ' ' HB2' ' A' ' 43' ' ' GLU 0.266 2.5 p -112.87 111.45 22.22 Favored 'General case' 0 C--O 1.246 0.9 0 CA-C-O 115.231 -2.319 . . . . 39.88 116.076 -175.023 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 4.0 m 70.22 127.73 0.03 OUTLIER 'General case' 0 C--O 1.253 1.257 0 CA-C-O 115.149 -2.358 . . . . 34.83 107.091 179.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -70.14 -12.81 61.86 Favored 'General case' 0 C--N 1.321 -0.644 0 O-C-N 126.477 2.361 . . . . 29.92 115.029 179.895 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 6.8 mmtm -90.01 -23.54 21.46 Favored 'General case' 0 C--N 1.29 -2.012 0 CA-C-O 124.199 1.952 . . . . 33.11 107.98 178.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLU . . . . . 0.679 ' HB2' ' O ' ' A' ' 39' ' ' THR . 11.2 mt-10 -78.85 -40.52 32.43 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 111.849 -2.432 . . . . 36.06 106.612 177.762 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 95.9 m -57.93 -47.7 82.1 Favored 'General case' 0 C--N 1.289 -2.05 0 O-C-N 127.771 3.17 . . . . 23.94 105.954 176.024 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 20.2 m-30 -61.63 -43.51 98.72 Favored 'General case' 0 N--CA 1.444 -0.748 0 O-C-N 125.214 1.571 . . . . 25.91 111.844 -177.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 44.6 t -61.67 -42.39 98.85 Favored 'General case' 0 N--CA 1.482 1.152 0 O-C-N 126.531 2.394 . . . . 22.76 107.524 -179.565 -176.908 -84.506 -80.74 100.114 2.058 107.496 -102.715 33.477 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ARG . . . . . 0.592 HH12 ' HA ' ' A' ' 101' ' ' VAL 0.259 32.1 mtp85 -62.15 -44.78 95.87 Favored 'General case' 0 C--O 1.254 1.319 0 CA-C-N 113.023 -1.899 . . . . 35.02 113.293 -178.875 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.68 -39.71 73.37 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 108.605 -0.887 . . . . 15.79 108.605 178.424 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ALA . . . . . 0.507 ' HB2' ' HB3' ' A' ' 90' ' ' LEU . . . -62.3 -45.59 92.59 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 127.268 2.227 . . . . 14.81 111.085 179.435 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 52.0 m -60.97 -41.56 96.65 Favored 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 124.738 1.215 . . . . 17.2 112.728 176.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' VAL . . . . . 0.829 HG13 HG13 ' A' ' 29' ' ' VAL 0.446 1.0 OUTLIER -77.62 -32.04 17.95 Favored 'Isoleucine or valine' 0 C--O 1.268 2.06 0 O-C-N 119.774 -1.829 . . . . 19.39 111.117 -177.815 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 95.6 mt -72.12 -30.69 65.31 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 118.262 -2.774 . . . . 17.22 107.961 175.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 44.5 ttt-85 -70.06 -38.42 75.77 Favored 'General case' 0 C--N 1.312 -1.033 0 O-C-N 119.908 -1.745 . . . . 23.98 112.481 179.328 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -64.8 -45.33 86.72 Favored 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 105.958 -1.867 . . . . 24.96 105.958 177.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 33.7 t80 -60.5 -66.99 0.44 Allowed 'General case' 0 C--O 1.251 1.154 0 O-C-N 120.056 -1.653 . . . . 15.68 111.184 -178.093 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 1.6 p90 -56.49 -36.37 69.05 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 116.644 -1.645 . . . . 17.59 114.069 -179.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.8 m -63.59 -45.34 90.86 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-N 122.056 2.207 . . . . 24.8 109.037 -177.572 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 28.4 m170 -81.39 -17.39 49.17 Favored 'General case' 0 C--O 1.245 0.831 0 O-C-N 127.997 3.311 . . . . 31.01 115.27 -178.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' HIS . . . . . 0.465 ' HA ' ' HB2' ' A' ' 62' ' ' ASP . 96.2 m-70 -111.67 4.04 18.28 Favored 'General case' 0 CA--C 1.501 -0.911 0 CA-C-O 116.294 -1.812 . . . . 20.79 114.755 -177.599 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 54.8 tt0 -61.12 -37.65 83.56 Favored 'General case' 0 C--N 1.297 -1.694 0 O-C-N 124.582 1.176 . . . . 29.69 112.237 -177.229 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -120.55 30.74 6.78 Favored 'General case' 0 C--N 1.312 -1.052 0 O-C-N 124.581 1.176 . . . . 34.56 108.94 179.1 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ASP . . . . . 0.465 ' HB2' ' HA ' ' A' ' 59' ' ' HIS . 36.2 t0 -73.97 119.43 18.16 Favored 'General case' 0 C--N 1.286 -2.157 0 N-CA-C 107.259 -1.386 . . . . 17.47 107.259 178.564 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 76.3 p -57.87 -28.97 64.64 Favored 'General case' 0 CA--C 1.501 -0.925 0 O-C-N 125.84 1.962 . . . . 20.62 109.03 -178.534 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 79.9 mtm180 -68.88 -21.23 64.26 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 116.164 -2.214 . . . . 17.73 112.303 179.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 35.7 m -108.51 -22.63 12.2 Favored 'General case' 0 C--O 1.248 1.017 0 N-CA-C 117.546 2.424 . . . . 21.9 117.546 -176.533 -51.555 -143.003 74.533 101.093 2.057 112.615 68.742 -125.712 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 78.5 mt -55.2 -31.65 61.59 Favored 'General case' 0 C--O 1.26 1.624 0 N-CA-C 118.078 2.621 . . . . 16.58 118.078 -176.741 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 88.7 165.31 41.15 Favored Glycine 0 C--N 1.277 -2.699 0 C-N-CA 129.118 3.247 . . . . 16.16 113.83 178.522 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -96.53 -50.96 4.52 Favored 'General case' 0 C--N 1.31 -1.148 0 O-C-N 127.702 2.648 . . . . 16.94 110.869 176.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 39.7 p -89.55 171.75 9.47 Favored 'General case' 0 CA--C 1.507 -0.674 0 O-C-N 119.959 -1.713 . . . . 18.57 110.224 -176.986 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.08 -29.78 67.95 Favored 'General case' 0 N--CA 1.478 0.951 0 O-C-N 126.506 2.379 . . . . 20.79 108.698 178.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -65.78 -54.96 20.03 Favored 'General case' 0 C--O 1.255 1.391 0 CA-C-O 123.188 1.471 . . . . 33.3 108.735 -178.647 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 82.5 mt-30 -54.98 -42.69 72.77 Favored 'General case' 0 C--O 1.255 1.353 0 CA-C-N 114.42 -1.264 . . . . 21.09 111.979 178.408 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -66.84 -40.24 87.89 Favored 'General case' 0 C--O 1.253 1.26 0 O-C-N 124.228 0.955 . . . . 19.68 112.083 -178.243 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' HIS . . . . . 0.412 ' ND1' ' HE2' ' A' ' 77' ' ' LYS . 6.7 m-70 -67.41 -42.2 83.64 Favored 'General case' 0 C--N 1.313 -1.01 0 O-C-N 125.109 1.506 . . . . 31.38 109.35 -179.529 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 73.8 mtt85 -61.5 -44.13 97.62 Favored 'General case' 0 C--N 1.306 -1.311 0 O-C-N 125.982 2.051 . . . . 32.69 109.892 179.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 84.9 t60 -57.27 -47.29 81.81 Favored 'General case' 0 C--N 1.321 -0.649 0 O-C-N 127.419 2.949 . . . . 16.91 111.162 179.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' LYS . . . . . 0.412 ' HE2' ' ND1' ' A' ' 74' ' ' HIS . 42.1 mtmt -58.25 -40.0 80.65 Favored 'General case' 0 CA--C 1.553 1.088 0 O-C-N 126.571 2.42 . . . . 30.2 109.072 -178.408 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLN . . . . . 0.881 HE22 HH21 ' A' ' 81' ' ' ARG . 0.8 OUTLIER -72.11 -38.58 69.28 Favored 'General case' 0 C--N 1.315 -0.9 0 O-C-N 126.682 2.489 . . . . 31.2 109.577 -177.16 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.8 tp -60.7 -50.58 72.9 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-O 115.361 -2.256 . . . . 16.19 107.098 176.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' ILE . . . . . 0.404 ' O ' ' HG3' ' A' ' 84' ' ' LYS 0.253 25.7 mm -60.97 -39.32 81.76 Favored 'Isoleucine or valine' 0 C--O 1.256 1.42 0 O-C-N 125.511 1.757 . . . . 14.79 113.048 -179.326 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 81' ' ' ARG . . . . . 0.881 HH21 HE22 ' A' ' 78' ' ' GLN . 0.8 OUTLIER -57.32 -53.43 58.26 Favored 'General case' 0 C--N 1.301 -1.533 0 C-N-CA 126.64 1.976 . . . . 29.31 109.97 178.669 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 22.2 m-30 -64.46 -40.58 95.98 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 125.772 1.629 . . . . 21.47 113.867 -179.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' LEU . . . . . 0.437 ' O ' ' HB2' ' A' ' 87' ' ' ASP . 57.9 mt -61.74 -37.88 85.9 Favored 'General case' 0 C--O 1.264 1.842 0 O-C-N 124.421 1.076 . . . . 14.94 110.337 176.658 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LYS . . . . . 0.404 ' HG3' ' O ' ' A' ' 80' ' ' ILE . 90.0 mttt -72.62 -36.32 68.04 Favored 'General case' 0 C--N 1.312 -1.027 0 C-N-CA 124.015 0.926 . . . . 20.56 111.034 179.506 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 24.5 ttm180 -62.71 -49.22 75.93 Favored 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 124.264 1.025 . . . . 23.74 110.619 176.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 25.5 tp -65.77 -45.37 82.74 Favored 'General case' 0 C--N 1.303 -1.455 0 C-N-CA 127.728 2.411 . . . . 16.06 108.405 -179.217 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ASP . . . . . 0.437 ' HB2' ' O ' ' A' ' 83' ' ' LEU . 3.2 t70 -60.11 -48.96 79.53 Favored 'General case' 0 C--O 1.258 1.517 0 CA-C-O 126.291 2.948 . . . . 18.02 114.07 178.884 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ARG . . . . . 0.417 HH11 ' HD3' ' A' ' 88' ' ' ARG . 0.0 OUTLIER -60.6 -34.55 74.38 Favored 'General case' 0 N--CA 1.495 1.788 0 CA-C-N 113.278 -1.783 . . . . 28.77 110.245 178.934 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 52.0 m-20 -66.51 -46.04 77.54 Favored 'General case' 0 C--O 1.22 -0.476 0 O-C-N 120.321 -1.487 . . . . 16.2 110.042 178.557 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LEU . . . . . 0.507 ' HB3' ' HB2' ' A' ' 49' ' ' ALA . 0.3 OUTLIER -60.69 -52.14 66.39 Favored 'General case' 0 C--N 1.291 -1.961 0 C-N-CA 127.609 2.364 . . . . 17.24 107.287 -178.017 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 53.3 m95 -59.75 -39.57 85.21 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.79 -0.641 . . . . 18.66 111.381 178.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -66.56 -32.15 80.73 Favored Glycine 0 CA--C 1.525 0.706 0 CA-C-O 117.928 -1.485 . . . . 18.68 110.014 -179.431 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' LEU . . . . . 0.446 ' HA ' HD12 ' A' ' 93' ' ' LEU . 1.3 tp -79.29 -39.12 33.7 Favored 'General case' 0 C--N 1.303 -1.415 0 CA-C-O 124.866 2.269 . . . . 27.32 113.263 179.878 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -60.99 -54.98 38.31 Favored 'General case' 0 N--CA 1.446 -0.644 0 O-C-N 119.514 -1.991 . . . . 30.54 108.076 178.066 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 63.75 28.54 72.76 Favored Glycine 0 CA--C 1.539 1.589 0 N-CA-C 105.401 -3.079 . . . . 32.27 105.401 -177.53 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . 0.276 7.6 tp -143.87 131.45 21.16 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 101.233 -3.617 . . . . 36.38 101.233 -177.771 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -117.73 8.12 12.68 Favored 'General case' 0 C--N 1.308 -1.232 0 O-C-N 126.104 2.128 . . . . 35.92 114.624 -173.285 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -153.83 124.81 7.31 Favored 'General case' 0 C--N 1.306 -1.302 0 O-C-N 127.921 3.263 . . . . 41.48 106.198 179.886 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -152.4 161.59 28.88 Favored Pre-proline 0 C--N 1.298 -1.639 0 N-CA-C 105.025 -2.213 . . . . 37.81 105.025 -179.138 33.477 -102.715 -80.74 107.496 2.058 100.114 -84.506 -176.908 2 2 . 1 . 001 ecloud build full ' A' A ' 100' ' ' PRO . . . . . 0.586 ' O ' ' NH1' ' A' ' 47' ' ' ARG . 1.6 Cg_endo -98.28 122.16 0.15 Allowed 'Trans proline' 0 C--N 1.309 -1.54 1 C-N-CA 125.788 4.325 . . . . 38.15 113.694 -177.967 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 101' ' ' VAL . . . . . 0.801 HG13 HD11 ' A' ' 32' ' ' ILE 0.265 2.3 t -111.88 110.32 31.75 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.581 0 N-CA-C 103.09 -2.93 . . . . 37.19 103.09 179.704 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 53.3 pttt -124.89 0.98 8.05 Favored 'General case' 0 C--O 1.249 1.075 0 N-CA-C 117.301 2.334 . . . . 40.71 117.301 -174.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 42.5 mp0 -67.35 167.08 13.16 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-O 124.525 2.107 . . . . 39.97 110.146 179.097 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -129.27 -22.71 3.06 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-O 117.311 -1.328 . . . . 32.89 110.521 -178.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 20.7 t-20 -67.16 150.5 49.04 Favored 'General case' 0 CA--C 1.568 1.657 1 N-CA-C 98.386 -4.672 . . . . 31.89 98.386 176.867 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 106' ' ' GLN . . . . . 0.658 ' OE1' HG23 ' A' ' 28' ' ' THR . 61.5 mm-40 -121.77 153.22 38.57 Favored 'General case' 0 C--N 1.283 -2.284 0 O-C-N 128.565 3.665 . . . . 25.7 103.485 -178.803 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 2.3 p -135.15 169.96 16.65 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 101.547 -3.501 . . . . 24.77 101.547 176.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 77.4 p -72.6 164.1 27.0 Favored 'General case' 0 N--CA 1.502 2.168 0 N-CA-C 106.467 -1.679 . . . . 19.11 106.467 176.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' LEU . . . . . 0.68 HD13 HD22 ' A' ' 113' ' ' LEU . 0.8 OUTLIER -60.84 -39.18 88.12 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 123.219 1.485 . . . . 18.08 107.536 178.14 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -52.81 -49.57 65.37 Favored 'General case' 0 C--O 1.267 1.998 0 C-N-CA 126.887 2.075 . . . . 30.8 113.266 179.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 98.5 m-20 -67.44 -44.47 78.64 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 122.532 2.424 . . . . 24.33 111.299 177.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -53.56 -47.09 70.38 Favored 'General case' 0 C--N 1.297 -1.688 0 C-N-CA 128.133 2.573 . . . . 19.96 110.32 177.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' LEU . . . . . 0.68 HD22 HD13 ' A' ' 109' ' ' LEU . 0.1 OUTLIER -70.76 -33.75 71.12 Favored 'General case' 0 C--N 1.281 -2.378 0 C-N-CA 129.728 3.211 . . . . 16.73 111.913 -178.559 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -73.5 -39.66 64.67 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 113.564 -1.653 . . . . 30.4 108.659 178.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' ARG . . . . . 0.522 ' NH2' ' CG2' ' A' ' 118' ' ' THR . 5.5 tpm_? -64.75 -51.4 62.51 Favored 'General case' 0 C--N 1.313 -1.022 0 O-C-N 119.084 -2.26 . . . . 33.24 108.79 178.962 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 42.9 tp -56.26 -40.05 73.59 Favored 'General case' 0 C--O 1.252 1.209 0 C-N-CA 125.132 1.373 . . . . 15.28 109.844 179.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' LYS . . . . . 0.494 ' HA ' HD13 ' A' ' 14' ' ' LEU . 13.8 ttmt -57.86 -42.78 85.2 Favored 'General case' 0 C--O 1.251 1.165 0 N-CA-C 108.564 -0.902 . . . . 23.44 108.564 179.157 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 118' ' ' THR . . . . . 0.522 ' CG2' ' NH2' ' A' ' 115' ' ' ARG . 41.0 m -64.81 -45.03 87.96 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 114.378 -2.725 . . . . 18.13 111.642 -179.124 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ILE . . . . . 0.748 HD12 ' HD2' ' A' ' 123' ' ' LYS 0.255 0.7 OUTLIER -71.28 -29.7 37.02 Favored 'Isoleucine or valine' 0 C--O 1.257 1.5 0 O-C-N 125.202 1.564 . . . . 20.46 109.272 179.674 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 89.8 mmm -67.75 -43.45 79.84 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 119.732 -1.855 . . . . 18.57 107.015 179.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' ARG . . . . . 0.473 HH21 ' HD3' ' A' ' 117' ' ' LYS . 53.9 mtt-85 -71.25 -26.09 62.76 Favored 'General case' 0 C--N 1.301 -1.536 0 CA-C-N 120.984 1.72 . . . . 37.23 111.163 176.542 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 122' ' ' GLU . . . . . 0.406 ' O ' ' C ' ' A' ' 123' ' ' LYS . 37.9 tp10 -70.47 -48.06 57.62 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 102.921 -2.992 . . . . 22.19 102.921 176.503 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 123' ' ' LYS . . . . . 0.799 ' HE3' ' N ' ' A' ' 123' ' ' LYS . 0.0 OUTLIER -51.13 -53.5 33.77 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 116.85 -1.94 . . . . 24.71 107.45 179.09 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -50.29 -48.45 55.05 Favored 'General case' 0 C--N 1.305 -1.341 0 CA-C-O 116.724 -1.608 . . . . 19.37 112.198 -179.422 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 39.1 m -56.92 -45.4 82.72 Favored 'General case' 0 C--N 1.304 -1.374 0 C-N-CA 127.052 2.141 . . . . 22.62 113.743 177.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' LYS . . . . . 0.45 ' N ' ' HD2' ' A' ' 126' ' ' LYS . 9.2 mmmt -67.36 -11.22 57.14 Favored 'General case' 0 C--O 1.249 1.051 0 O-C-N 119.881 -1.762 . . . . 30.87 110.785 179.297 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 127' ' ' CYS . . . . . 0.458 ' SG ' ' CE1' ' A' ' 1' ' ' HIS . 15.9 m -95.95 -31.27 13.18 Favored 'General case' 0 C--O 1.246 0.88 0 N-CA-C 114.751 1.389 . . . . 21.64 114.751 -178.743 -81.816 -69.469 -76.527 109.532 2.017 104.368 -65.524 -65.493 2 2 . 1 . 001 ecloud build full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 20.2 p -116.13 154.83 29.3 Favored 'General case' 0 N--CA 1.443 -0.792 0 O-C-N 124.728 1.268 . . . . 29.02 111.745 -179.102 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 4.3 p . . . . . 0 C--N 1.302 -1.483 0 N-CA-C 100.226 -3.99 . . . . 33.4 100.226 175.126 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' HIS . . . . . 0.458 ' CE1' ' SG ' ' A' ' 127' ' ' CYS . 8.6 t60 . . . . . 0 C--O 1.248 1.022 0 CA-C-O 117.354 -1.308 . . . . 42.920000000000002 108.773 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' LYS . . . . . . . . . . . . 0.295 28.1 mmtm -100.5 144.32 29.63 Favored 'General case' 0 N--CA 1.497 1.878 0 CA-C-O 124.337 2.018 . . . . 41.090000000000003 108.513 177.399 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 99.9 m -127.83 34.13 4.68 Favored 'General case' 0 C--N 1.317 -0.823 0 C-N-CA 126.919 2.088 . . . . 28.850000000000001 113.781 -176.687 -65.493 -65.524 -76.527 104.368 2.017 109.532 -69.469 -81.816 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' ASP . . . . . . . . . . . . . 18.7 t0 -70.2 153.67 42.83 Favored 'General case' 0 C--N 1.282 -2.351 0 C-N-CA 127.118 2.167 . . . . 31.609999999999999 111.608 179.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -55.55 -25.66 18.24 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.819 0 C-N-CA 128.013 2.525 . . . . 21.82 109.73 177.815 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 57.5 m -50.94 -41.93 59.35 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 126.084 1.754 . . . . 18.190000000000001 111.32 178.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -53.86 -39.73 65.91 Favored 'General case' 0 C--N 1.304 -1.392 0 C-N-CA 124.378 1.071 . . . . 19.25 110.329 175.897 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -71.57 -31.32 66.85 Favored 'General case' 0 N--CA 1.492 1.627 0 C-N-CA 118.946 -1.101 . . . . 15.77 110.576 -179.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -72.09 -35.5 69.25 Favored 'General case' 0 C--O 1.218 -0.594 0 CA-C-O 116.427 -1.749 . . . . 23.059999999999999 107.093 178.196 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 33.9 mt -65.5 -50.82 69.93 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 O-C-N 125.462 1.726 . . . . 12.84 110.202 176.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ILE . . . . . . . . . . . . . 79.3 mt -58.69 -40.83 80.61 Favored 'Isoleucine or valine' 0 C--O 1.254 1.294 0 CA-C-O 123.246 1.498 . . . . 15.08 112.236 178.199 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 8.3 mtpp -60.72 -51.78 67.88 Favored 'General case' 0 C--O 1.253 1.252 0 O-C-N 118.137 -2.852 . . . . 29.309999999999999 110.13 177.763 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' THR . . . . . . . . . . . . . 18.7 m -58.02 -48.07 81.17 Favored 'General case' 0 C--O 1.261 1.68 0 O-C-N 120.297 -1.502 . . . . 18.91 109.163 176.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' LEU . . . . . 0.494 HD13 ' HA ' ' A' ' 117' ' ' LYS . 46.5 mt -56.18 -37.75 70.02 Favored 'General case' 0 C--O 1.259 1.587 0 CA-C-N 119.843 1.201 . . . . 21.18 111.39 179.899 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.566 HD21 HH21 ' A' ' 121' ' ' ARG . 9.0 m120 -68.17 -31.13 70.46 Favored 'General case' 0 C--O 1.275 2.42 0 N-CA-C 112.928 0.714 . . . . 26.0 112.928 177.658 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -83.46 -27.75 29.25 Favored 'General case' 0 C--O 1.247 0.972 0 O-C-N 116.756 -3.715 . . . . 27.32 108.584 175.628 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 14.0 mt -69.39 -50.63 44.24 Favored 'General case' 0 C--O 1.207 -1.146 0 CA-C-O 117.523 -1.227 . . . . 22.59 111.559 -179.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 80.8 p -73.01 -19.96 61.1 Favored 'General case' 0 C--O 1.259 1.567 0 N-CA-C 115.9 1.815 . . . . 28.050000000000001 115.9 -176.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -87.45 -6.49 58.39 Favored 'General case' 0 N--CA 1.482 1.15 0 C-N-CA 116.656 -2.017 . . . . 36.219999999999999 109.945 -177.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -123.65 108.05 12.15 Favored 'General case' 0 C--N 1.303 -1.417 0 O-C-N 125.501 1.751 . . . . 40.07 110.873 -178.89 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.417 ' HD3' ' N ' ' A' ' 22' ' ' THR . 1.0 OUTLIER -92.77 142.45 27.33 Favored 'General case' 0 C--N 1.305 -1.351 0 O-C-N 128.637 3.71 . . . . 38.090000000000003 106.914 176.488 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' THR . . . . . 0.424 HG22 ' H ' ' A' ' 24' ' ' CYS . 15.0 m -134.0 -168.69 2.17 Favored 'General case' 0 C--O 1.254 1.322 0 O-C-N 119.399 -2.063 . . . . 32.710000000000001 106.271 -177.136 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.413 ' N ' HG22 ' A' ' 22' ' ' THR . 2.8 mp -71.52 -34.5 70.12 Favored 'General case' 0 C--N 1.298 -1.632 0 CA-C-O 125.234 2.445 . . . . 30.870000000000001 109.72 176.554 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.424 ' H ' HG22 ' A' ' 22' ' ' THR . 0.1 OUTLIER -81.41 -28.32 34.36 Favored 'General case' 0 C--O 1.263 1.803 1 N-CA-C 121.978 4.066 . . . . 24.16 121.978 -175.422 -125.712 68.742 74.533 112.615 2.057 101.093 -143.003 -51.555 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 67.3 p -63.26 -16.23 59.62 Favored 'General case' 0 C--N 1.282 -2.367 0 C-N-CA 130.292 3.437 . . . . 22.379999999999999 113.788 179.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . 0.295 49.9 mt-10 -97.79 2.14 49.11 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 116.574 -2.05 . . . . 33.899999999999999 108.028 175.856 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.408 HD13 ' CE1' ' A' ' 59' ' ' HIS . 75.3 mt -79.26 167.95 20.24 Favored 'General case' 0 CA--C 1.558 1.259 0 N-CA-C 102.227 -3.249 . . . . 20.489999999999998 102.227 173.799 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' THR . . . . . 0.658 HG23 ' OE1' ' A' ' 106' ' ' GLN 0.292 0.9 OUTLIER -93.84 155.67 17.07 Favored 'General case' 0 C--N 1.277 -2.554 1 N-CA-C 125.156 5.243 . . . . 23.640000000000001 125.156 -172.607 . . . . . . . . 5 4 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.829 HG13 HG13 ' A' ' 51' ' ' VAL . 1.0 OUTLIER -143.42 154.75 16.49 Favored 'Isoleucine or valine' 0 N--CA 1.523 3.197 0 N-CA-C 105.366 -2.087 . . . . 21.469999999999999 105.366 178.091 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 30.4 m -65.22 124.13 21.38 Favored 'General case' 0 C--N 1.3 -1.563 0 CA-C-N 120.697 1.59 . . . . 21.510000000000002 108.484 175.972 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.7 t0 -69.53 82.57 0.41 Allowed 'General case' 0 C--N 1.305 -1.327 0 CA-C-O 123.274 1.512 . . . . 22.25 110.725 177.532 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' ILE . . . . . 0.801 HD11 HG13 ' A' ' 101' ' ' VAL . 1.0 OUTLIER -60.06 -16.36 11.58 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.919 0 C-N-CA 126.302 1.841 . . . . 26.030000000000001 109.668 179.586 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' PHE . . . . . . . . . . . . . 18.8 m-85 -105.53 31.63 4.83 Favored 'General case' 0 C--N 1.302 -1.475 0 C-N-CA 126.802 2.041 . . . . 24.75 114.138 -178.624 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ALA . . . . . . . . . . . . . . . -116.9 2.0 12.73 Favored 'General case' 0 C--N 1.304 -1.381 0 C-N-CA 127.485 2.314 . . . . 25.440000000000001 105.858 178.121 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.15 157.28 34.89 Favored 'General case' 0 C--N 1.291 -1.943 0 N-CA-C 103.877 -2.638 . . . . 28.5 103.877 175.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' SER . . . . . 0.48 ' O ' ' HB3' ' A' ' 37' ' ' LYS . 70.1 p -109.24 47.02 0.95 Allowed 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 103.186 -2.894 . . . . 34.280000000000001 103.186 177.163 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LYS . . . . . 0.48 ' HB3' ' O ' ' A' ' 36' ' ' SER . 0.0 OUTLIER 163.57 66.2 0.0 OUTLIER 'General case' 0 C--O 1.272 2.256 0 CA-C-O 115.733 -2.08 . . . . 42.43 116.26 -178.934 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . 0.272 7.6 t-20 -62.68 140.25 58.69 Favored 'General case' 0 N--CA 1.508 2.435 0 N-CA-C 103.228 -2.879 . . . . 44.740000000000002 103.228 176.995 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' THR . . . . . 0.679 ' O ' ' HB2' ' A' ' 43' ' ' GLU 0.266 2.5 p -112.87 111.45 22.22 Favored 'General case' 0 C--O 1.246 0.9 0 CA-C-O 115.231 -2.319 . . . . 39.880000000000003 116.076 -175.023 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 4.0 m 70.22 127.73 0.03 OUTLIER 'General case' 0 C--O 1.253 1.257 0 CA-C-O 115.149 -2.358 . . . . 34.829999999999998 107.091 179.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -70.14 -12.81 61.86 Favored 'General case' 0 C--N 1.321 -0.644 0 O-C-N 126.477 2.361 . . . . 29.920000000000002 115.029 179.895 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 6.8 mmtm -90.01 -23.54 21.46 Favored 'General case' 0 C--N 1.29 -2.012 0 CA-C-O 124.199 1.952 . . . . 33.109999999999999 107.98 178.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.679 ' HB2' ' O ' ' A' ' 39' ' ' THR . 11.2 mt-10 -78.85 -40.52 32.43 Favored 'General case' 0 CA--C 1.532 0.288 0 CA-C-N 111.849 -2.432 . . . . 36.060000000000002 106.612 177.762 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 95.9 m -57.93 -47.7 82.1 Favored 'General case' 0 C--N 1.289 -2.05 0 O-C-N 127.771 3.17 . . . . 23.940000000000001 105.954 176.024 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' PHE . . . . . . . . . . . . . 20.2 m-30 -61.63 -43.51 98.72 Favored 'General case' 0 N--CA 1.444 -0.748 0 O-C-N 125.214 1.571 . . . . 25.91 111.844 -177.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 44.6 t -61.67 -42.39 98.85 Favored 'General case' 0 N--CA 1.482 1.152 0 O-C-N 126.531 2.394 . . . . 22.760000000000002 107.524 -179.565 -176.908 -84.506 -80.74 100.114 2.058 107.496 -102.715 33.477 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.592 HH12 ' HA ' ' A' ' 101' ' ' VAL 0.259 32.1 mtp85 -62.15 -44.78 95.87 Favored 'General case' 0 C--O 1.254 1.319 0 CA-C-N 113.023 -1.899 . . . . 35.020000000000003 113.293 -178.875 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -70.68 -39.71 73.37 Favored 'General case' 0 C--N 1.312 -1.025 0 N-CA-C 108.605 -0.887 . . . . 15.789999999999999 108.605 178.424 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.507 ' HB2' ' HB3' ' A' ' 90' ' ' LEU . . . -62.3 -45.59 92.59 Favored 'General case' 0 C--N 1.305 -1.352 0 C-N-CA 127.268 2.227 . . . . 14.81 111.085 179.435 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 52.0 m -60.97 -41.56 96.65 Favored 'General case' 0 C--N 1.315 -0.915 0 C-N-CA 124.738 1.215 . . . . 17.199999999999999 112.728 176.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.829 HG13 HG13 ' A' ' 29' ' ' VAL 0.446 1.0 OUTLIER -77.62 -32.04 17.95 Favored 'Isoleucine or valine' 0 C--O 1.268 2.06 0 O-C-N 119.774 -1.829 . . . . 19.390000000000001 111.117 -177.815 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' LEU . . . . . . . . . . . . . 95.6 mt -72.12 -30.69 65.31 Favored 'General case' 0 N--CA 1.48 1.032 0 O-C-N 118.262 -2.774 . . . . 17.219999999999999 107.961 175.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ARG . . . . . . . . . . . . . 44.5 ttt-85 -70.06 -38.42 75.77 Favored 'General case' 0 C--N 1.312 -1.033 0 O-C-N 119.908 -1.745 . . . . 23.98 112.481 179.328 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 72.1 mt-30 -64.8 -45.33 86.72 Favored 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 105.958 -1.867 . . . . 24.960000000000001 105.958 177.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 33.7 t80 -60.5 -66.99 0.44 Allowed 'General case' 0 C--O 1.251 1.154 0 O-C-N 120.056 -1.653 . . . . 15.68 111.184 -178.093 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 1.6 p90 -56.49 -36.37 69.05 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 116.644 -1.645 . . . . 17.59 114.069 -179.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' SER . . . . . . . . . . . . . 50.8 m -63.59 -45.34 90.86 Favored 'General case' 0 C--N 1.303 -1.454 0 CA-C-N 122.056 2.207 . . . . 24.800000000000001 109.037 -177.572 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' HIS . . . . . . . . . . . . . 28.4 m170 -81.39 -17.39 49.17 Favored 'General case' 0 C--O 1.245 0.831 0 O-C-N 127.997 3.311 . . . . 31.010000000000002 115.27 -178.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' HIS . . . . . 0.465 ' HA ' ' HB2' ' A' ' 62' ' ' ASP . 96.2 m-70 -111.67 4.04 18.28 Favored 'General case' 0 CA--C 1.501 -0.911 0 CA-C-O 116.294 -1.812 . . . . 20.789999999999999 114.755 -177.599 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLU . . . . . . . . . . . . . 54.8 tt0 -61.12 -37.65 83.56 Favored 'General case' 0 C--N 1.297 -1.694 0 O-C-N 124.582 1.176 . . . . 29.690000000000001 112.237 -177.229 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -120.55 30.74 6.78 Favored 'General case' 0 C--N 1.312 -1.052 0 O-C-N 124.581 1.176 . . . . 34.560000000000002 108.94 179.1 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.465 ' HB2' ' HA ' ' A' ' 59' ' ' HIS . 36.2 t0 -73.97 119.43 18.16 Favored 'General case' 0 C--N 1.286 -2.157 0 N-CA-C 107.259 -1.386 . . . . 17.469999999999999 107.259 178.564 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' THR . . . . . . . . . . . . . 76.3 p -57.87 -28.97 64.64 Favored 'General case' 0 CA--C 1.501 -0.925 0 O-C-N 125.84 1.962 . . . . 20.620000000000001 109.03 -178.534 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ARG . . . . . . . . . . . . . 79.9 mtm180 -68.88 -21.23 64.26 Favored 'General case' 0 N--CA 1.474 0.748 0 C-N-CA 116.164 -2.214 . . . . 17.73 112.303 179.807 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' CYS . . . . . . . . . . . . . 35.7 m -108.51 -22.63 12.2 Favored 'General case' 0 C--O 1.248 1.017 0 N-CA-C 117.546 2.424 . . . . 21.899999999999999 117.546 -176.533 -51.555 -143.003 74.533 101.093 2.057 112.615 68.742 -125.712 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 78.5 mt -55.2 -31.65 61.59 Favored 'General case' 0 C--O 1.26 1.624 0 N-CA-C 118.078 2.621 . . . . 16.579999999999998 118.078 -176.741 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' GLY . . . . . . . . . . . . . . . 88.7 165.31 41.15 Favored Glycine 0 C--N 1.277 -2.699 0 C-N-CA 129.118 3.247 . . . . 16.16 113.83 178.522 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -96.53 -50.96 4.52 Favored 'General case' 0 C--N 1.31 -1.148 0 O-C-N 127.702 2.648 . . . . 16.940000000000001 110.869 176.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' THR . . . . . . . . . . . . . 39.7 p -89.55 171.75 9.47 Favored 'General case' 0 CA--C 1.507 -0.674 0 O-C-N 119.959 -1.713 . . . . 18.57 110.224 -176.986 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -69.08 -29.78 67.95 Favored 'General case' 0 N--CA 1.478 0.951 0 O-C-N 126.506 2.379 . . . . 20.789999999999999 108.698 178.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 2.3 tt0 -65.78 -54.96 20.03 Favored 'General case' 0 C--O 1.255 1.391 0 CA-C-O 123.188 1.471 . . . . 33.299999999999997 108.735 -178.647 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 82.5 mt-30 -54.98 -42.69 72.77 Favored 'General case' 0 C--O 1.255 1.353 0 CA-C-N 114.42 -1.264 . . . . 21.09 111.979 178.408 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 37.6 t80 -66.84 -40.24 87.89 Favored 'General case' 0 C--O 1.253 1.26 0 O-C-N 124.228 0.955 . . . . 19.68 112.083 -178.243 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' HIS . . . . . 0.412 ' ND1' ' HE2' ' A' ' 77' ' ' LYS . 6.7 m-70 -67.41 -42.2 83.64 Favored 'General case' 0 C--N 1.313 -1.01 0 O-C-N 125.109 1.506 . . . . 31.379999999999999 109.35 -179.529 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 73.8 mtt85 -61.5 -44.13 97.62 Favored 'General case' 0 C--N 1.306 -1.311 0 O-C-N 125.982 2.051 . . . . 32.689999999999998 109.892 179.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' HIS . . . . . . . . . . . . . 39.8 t-80 -57.27 -47.29 81.81 Favored 'General case' 0 C--N 1.321 -0.649 0 O-C-N 127.419 2.949 . . . . 16.91 111.162 179.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' LYS . . . . . 0.412 ' HE2' ' ND1' ' A' ' 74' ' ' HIS . 42.1 mtmt -58.25 -40.0 80.65 Favored 'General case' 0 CA--C 1.553 1.088 0 O-C-N 126.571 2.42 . . . . 30.199999999999999 109.072 -178.408 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.881 HE22 HH21 ' A' ' 81' ' ' ARG . 0.8 OUTLIER -72.11 -38.58 69.28 Favored 'General case' 0 C--N 1.315 -0.9 0 O-C-N 126.682 2.489 . . . . 31.199999999999999 109.577 -177.16 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.8 tp -60.7 -50.58 72.9 Favored 'General case' 0 N--CA 1.441 -0.903 0 CA-C-O 115.361 -2.256 . . . . 16.190000000000001 107.098 176.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.404 ' O ' ' HG3' ' A' ' 84' ' ' LYS 0.253 25.7 mm -60.97 -39.32 81.76 Favored 'Isoleucine or valine' 0 C--O 1.256 1.42 0 O-C-N 125.511 1.757 . . . . 14.789999999999999 113.048 -179.326 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' ARG . . . . . 0.881 HH21 HE22 ' A' ' 78' ' ' GLN . 0.8 OUTLIER -57.32 -53.43 58.26 Favored 'General case' 0 C--N 1.301 -1.533 0 C-N-CA 126.64 1.976 . . . . 29.309999999999999 109.97 178.669 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' PHE . . . . . . . . . . . . . 22.2 m-30 -64.46 -40.58 95.98 Favored 'General case' 0 N--CA 1.467 0.403 0 C-N-CA 125.772 1.629 . . . . 21.469999999999999 113.867 -179.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.437 ' O ' ' HB2' ' A' ' 87' ' ' ASP . 57.9 mt -61.74 -37.88 85.9 Favored 'General case' 0 C--O 1.264 1.842 0 O-C-N 124.421 1.076 . . . . 14.94 110.337 176.658 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.404 ' HG3' ' O ' ' A' ' 80' ' ' ILE . 90.0 mttt -72.62 -36.32 68.04 Favored 'General case' 0 C--N 1.312 -1.027 0 C-N-CA 124.015 0.926 . . . . 20.559999999999999 111.034 179.506 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' ARG . . . . . . . . . . . . . 24.5 ttm180 -62.71 -49.22 75.93 Favored 'General case' 0 N--CA 1.435 -1.185 0 C-N-CA 124.264 1.025 . . . . 23.739999999999998 110.619 176.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' LEU . . . . . . . . . . . . . 25.5 tp -65.77 -45.37 82.74 Favored 'General case' 0 C--N 1.303 -1.455 0 C-N-CA 127.728 2.411 . . . . 16.059999999999999 108.405 -179.217 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ASP . . . . . 0.437 ' HB2' ' O ' ' A' ' 83' ' ' LEU . 3.2 t70 -60.11 -48.96 79.53 Favored 'General case' 0 C--O 1.258 1.517 0 CA-C-O 126.291 2.948 . . . . 18.02 114.07 178.884 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ARG . . . . . 0.417 HH11 ' HD3' ' A' ' 88' ' ' ARG . 0.0 OUTLIER -60.6 -34.55 74.38 Favored 'General case' 0 N--CA 1.495 1.788 0 CA-C-N 113.278 -1.783 . . . . 28.77 110.245 178.934 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' ASN . . . . . . . . . . . . . 52.0 m-20 -66.51 -46.04 77.54 Favored 'General case' 0 C--O 1.22 -0.476 0 O-C-N 120.321 -1.487 . . . . 16.199999999999999 110.042 178.557 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.507 ' HB3' ' HB2' ' A' ' 49' ' ' ALA . 0.3 OUTLIER -60.69 -52.14 66.39 Favored 'General case' 0 C--N 1.291 -1.961 0 C-N-CA 127.609 2.364 . . . . 17.239999999999998 107.287 -178.017 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' TRP . . . . . . . . . . . . . 53.3 m95 -59.75 -39.57 85.21 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 115.79 -0.641 . . . . 18.66 111.381 178.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' GLY . . . . . . . . . . . . . . . -66.56 -32.15 80.73 Favored Glycine 0 CA--C 1.525 0.706 0 CA-C-O 117.928 -1.485 . . . . 18.68 110.014 -179.431 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.446 ' HA ' HD12 ' A' ' 93' ' ' LEU . 1.3 tp -79.29 -39.12 33.7 Favored 'General case' 0 C--N 1.303 -1.415 0 CA-C-O 124.866 2.269 . . . . 27.32 113.263 179.878 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ALA . . . . . . . . . . . . . . . -60.99 -54.98 38.31 Favored 'General case' 0 N--CA 1.446 -0.644 0 O-C-N 119.514 -1.991 . . . . 30.539999999999999 108.076 178.066 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLY . . . . . . . . . . . . . . . 63.75 28.54 72.76 Favored Glycine 0 CA--C 1.539 1.589 0 N-CA-C 105.401 -3.079 . . . . 32.270000000000003 105.401 -177.53 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . 0.276 7.6 tp -143.87 131.45 21.16 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 101.233 -3.617 . . . . 36.380000000000003 101.233 -177.771 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -117.73 8.12 12.68 Favored 'General case' 0 C--N 1.308 -1.232 0 O-C-N 126.104 2.128 . . . . 35.920000000000002 114.624 -173.285 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -153.83 124.81 7.31 Favored 'General case' 0 C--N 1.306 -1.302 0 O-C-N 127.921 3.263 . . . . 41.479999999999997 106.198 179.886 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -152.4 161.59 28.88 Favored Pre-proline 0 C--N 1.298 -1.639 0 N-CA-C 105.025 -2.213 . . . . 37.810000000000002 105.025 -179.138 33.477 -102.715 -80.74 107.496 2.058 100.114 -84.506 -176.908 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' PRO . . . . . 0.586 ' O ' ' NH1' ' A' ' 47' ' ' ARG . 1.6 Cg_endo -98.28 122.16 0.15 Allowed 'Trans proline' 0 C--N 1.309 -1.54 1 C-N-CA 125.788 4.325 . . . . 38.149999999999999 113.694 -177.967 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.801 HG13 HD11 ' A' ' 32' ' ' ILE 0.265 2.3 t -111.88 110.32 31.75 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.581 0 N-CA-C 103.09 -2.93 . . . . 37.189999999999998 103.09 179.704 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' LYS . . . . . . . . . . . . . 53.3 pttt -124.89 0.98 8.05 Favored 'General case' 0 C--O 1.249 1.075 0 N-CA-C 117.301 2.334 . . . . 40.710000000000001 117.301 -174.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 42.5 mp0 -67.35 167.08 13.16 Favored 'General case' 0 C--N 1.308 -1.238 0 CA-C-O 124.525 2.107 . . . . 39.969999999999999 110.146 179.097 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' ALA . . . . . . . . . . . . . . . -129.27 -22.71 3.06 Favored 'General case' 0 N--CA 1.483 1.198 0 CA-C-O 117.311 -1.328 . . . . 32.890000000000001 110.521 -178.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ASN . . . . . . . . . . . . . 20.7 t-20 -67.16 150.5 49.04 Favored 'General case' 0 CA--C 1.568 1.657 1 N-CA-C 98.386 -4.672 . . . . 31.890000000000001 98.386 176.867 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' GLN . . . . . 0.658 ' OE1' HG23 ' A' ' 28' ' ' THR . 61.5 mm-40 -121.77 153.22 38.57 Favored 'General case' 0 C--N 1.283 -2.284 0 O-C-N 128.565 3.665 . . . . 25.699999999999999 103.485 -178.803 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 2.3 p -135.15 169.96 16.65 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 101.547 -3.501 . . . . 24.77 101.547 176.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' THR . . . . . . . . . . . . . 77.4 p -72.6 164.1 27.0 Favored 'General case' 0 N--CA 1.502 2.168 0 N-CA-C 106.467 -1.679 . . . . 19.109999999999999 106.467 176.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' LEU . . . . . 0.68 HD13 HD22 ' A' ' 113' ' ' LEU . 0.8 OUTLIER -60.84 -39.18 88.12 Favored 'General case' 0 N--CA 1.49 1.54 0 CA-C-O 123.219 1.485 . . . . 18.079999999999998 107.536 178.14 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' GLU . . . . . . . . . . . . . 67.7 tt0 -52.81 -49.57 65.37 Favored 'General case' 0 C--O 1.267 1.998 0 C-N-CA 126.887 2.075 . . . . 30.800000000000001 113.266 179.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -67.44 -44.47 78.64 Favored 'General case' 0 C--N 1.307 -1.273 0 CA-C-N 122.532 2.424 . . . . 24.329999999999998 111.299 177.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' PHE . . . . . . . . . . . . . 75.8 t80 -53.56 -47.09 70.38 Favored 'General case' 0 C--N 1.297 -1.688 0 C-N-CA 128.133 2.573 . . . . 19.960000000000001 110.32 177.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' LEU . . . . . 0.68 HD22 HD13 ' A' ' 109' ' ' LEU . 0.1 OUTLIER -70.76 -33.75 71.12 Favored 'General case' 0 C--N 1.281 -2.378 0 C-N-CA 129.728 3.211 . . . . 16.73 111.913 -178.559 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' GLU . . . . . . . . . . . . . 3.5 tp10 -73.5 -39.66 64.67 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 113.564 -1.653 . . . . 30.399999999999999 108.659 178.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' ARG . . . . . 0.522 ' NH2' ' CG2' ' A' ' 118' ' ' THR . 5.5 tpm_? -64.75 -51.4 62.51 Favored 'General case' 0 C--N 1.313 -1.022 0 O-C-N 119.084 -2.26 . . . . 33.240000000000002 108.79 178.962 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 42.9 tp -56.26 -40.05 73.59 Favored 'General case' 0 C--O 1.252 1.209 0 C-N-CA 125.132 1.373 . . . . 15.279999999999999 109.844 179.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' LYS . . . . . 0.515 ' HD3' HD21 ' A' ' 15' ' ' ASN . 13.8 ttmt -57.86 -42.78 85.2 Favored 'General case' 0 C--O 1.251 1.165 0 N-CA-C 108.564 -0.902 . . . . 23.440000000000001 108.564 179.157 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' THR . . . . . 0.522 ' CG2' ' NH2' ' A' ' 115' ' ' ARG . 41.0 m -64.81 -45.03 87.96 Favored 'General case' 0 N--CA 1.465 0.283 0 CA-C-O 114.378 -2.725 . . . . 18.129999999999999 111.642 -179.124 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ILE . . . . . 0.748 HD12 ' HD2' ' A' ' 123' ' ' LYS 0.255 0.7 OUTLIER -71.28 -29.7 37.02 Favored 'Isoleucine or valine' 0 C--O 1.257 1.5 0 O-C-N 125.202 1.564 . . . . 20.460000000000001 109.272 179.674 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' MET . . . . . . . . . . . . . 89.8 mmm -67.75 -43.45 79.84 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 119.732 -1.855 . . . . 18.57 107.015 179.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' ARG . . . . . 0.566 HH21 HD21 ' A' ' 15' ' ' ASN . 53.9 mtt-85 -71.25 -26.09 62.76 Favored 'General case' 0 C--N 1.301 -1.536 0 CA-C-N 120.984 1.72 . . . . 37.229999999999997 111.163 176.542 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.406 ' O ' ' C ' ' A' ' 123' ' ' LYS . 37.9 tp10 -70.47 -48.06 57.62 Favored 'General case' 0 C--N 1.311 -1.078 0 N-CA-C 102.921 -2.992 . . . . 22.190000000000001 102.921 176.503 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' LYS . . . . . 0.799 ' N ' ' HE3' ' A' ' 123' ' ' LYS . 0.0 OUTLIER -51.13 -53.5 33.77 Favored 'General case' 0 N--CA 1.488 1.447 0 C-N-CA 116.85 -1.94 . . . . 24.710000000000001 107.45 179.09 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' TYR . . . . . . . . . . . . . 5.9 t80 -50.29 -48.45 55.05 Favored 'General case' 0 C--N 1.305 -1.341 0 CA-C-O 116.724 -1.608 . . . . 19.370000000000001 112.198 -179.422 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 39.1 m -56.92 -45.4 82.72 Favored 'General case' 0 C--N 1.304 -1.374 0 C-N-CA 127.052 2.141 . . . . 22.620000000000001 113.743 177.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' LYS . . . . . 0.45 ' N ' ' HD2' ' A' ' 126' ' ' LYS . 9.2 mmmt -67.36 -11.22 57.14 Favored 'General case' 0 C--O 1.249 1.051 0 O-C-N 119.881 -1.762 . . . . 30.870000000000001 110.785 179.297 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' CYS . . . . . 0.458 ' SG ' ' CE1' ' A' ' 1' ' ' HIS . 15.9 m -95.95 -31.27 13.18 Favored 'General case' 0 C--O 1.246 0.88 0 N-CA-C 114.751 1.389 . . . . 21.640000000000001 114.751 -178.743 -81.816 -69.469 -76.527 109.532 2.017 104.368 -65.524 -65.493 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' SER . . . . . . . . . . . . . 20.2 p -116.13 154.83 29.3 Favored 'General case' 0 N--CA 1.443 -0.792 0 O-C-N 124.728 1.268 . . . . 29.02 111.745 -179.102 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' SER . . . . . . . . . . . . . 4.3 p . . . . . 0 C--N 1.302 -1.483 0 N-CA-C 100.226 -3.99 . . . . 33.399999999999999 100.226 175.126 . . . . . . . . 0 0 . 1 stop_ save_