data_2ext_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 2ext _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 ' 7' ' ' SER . . . . . . . . . . . . . 12.1 t . . . . . 0 N--CA 1.492 1.645 0 N-CA-C 112.172 0.434 . . . . 34.289999999999999 112.172 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' ASP . . . . . 0.52 ' OD2' ' NH2' ' A' ' 66' ' ' ARG . 2.9 m-20 -56.59 148.43 19.81 Favored 'General case' 0 C--O 1.247 0.928 0 C-N-CA 125.157 1.383 . . . . 38.030000000000001 110.354 179.253 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 48.8 p90 -149.91 164.15 36.19 Favored 'General case' 0 C--O 1.253 1.267 0 O-C-N 124.241 0.963 . . . . 25.620000000000001 111.199 -177.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 48.4 t -125.54 143.93 37.37 Favored 'Isoleucine or valine' 0 C--O 1.245 0.859 0 N-CA-C 106.117 -1.808 . . . . 18.379999999999999 106.117 -176.992 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 60.2 t -110.38 124.61 67.29 Favored 'Isoleucine or valine' 0 C--O 1.249 1.051 0 N-CA-C 106.191 -1.781 . . . . 13.76 106.191 173.235 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.6 mp -121.51 121.02 63.5 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 O-C-N 123.934 0.772 . . . . 14.9 110.756 177.389 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -111.13 122.09 46.99 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 109.485 -0.561 . . . . 32.299999999999997 109.485 173.518 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -74.87 135.82 41.53 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 108.26 -1.015 . . . . 14.49 108.26 -175.451 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 56.6 mt -108.27 2.12 22.47 Favored 'General case' 0 C--O 1.263 1.797 0 O-C-N 123.802 0.689 . . . . 20.27 111.613 176.5 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -147.27 168.71 21.06 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 107.083 -1.451 . . . . 28.530000000000001 107.083 173.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -74.26 150.3 40.31 Favored 'General case' 0 CA--C 1.505 -0.781 0 C-N-CA 119.121 -1.032 . . . . 16.699999999999999 110.649 174.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 82.85 19.66 62.9 Favored Glycine 0 N--CA 1.444 -0.804 0 C-N-CA 118.589 -1.767 . . . . 14.77 114.184 168.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 59.2 t -65.95 135.93 27.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 N-CA-C 107.89 -1.152 . . . . 14.68 107.89 173.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -114.91 124.23 51.17 Favored 'General case' 0 C--O 1.24 0.586 0 N-CA-C 105.998 -1.853 . . . . 24.09 105.998 -176.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 88.0 t -105.31 115.04 46.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 N-CA-C 104.835 -2.283 . . . . 12.449999999999999 104.835 175.745 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 44.4 mt -111.82 122.18 65.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 108.666 -0.864 . . . . 17.449999999999999 108.666 -163.127 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -98.29 128.92 9.72 Favored Glycine 0 C--O 1.245 0.796 0 N-CA-C 109.367 -1.493 . . . . 13.32 109.367 179.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 63.0 mt -102.21 140.39 36.56 Favored 'General case' 0 C--O 1.25 1.099 0 CA-C-O 120.938 0.399 . . . . 17.0 110.25 -179.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 38.7 p -64.37 133.6 52.92 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 114.245 1.202 . . . . 13.41 114.245 -174.154 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 59.6 ttm-85 -72.3 136.02 46.12 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 108.141 -1.059 . . . . 14.539999999999999 108.141 167.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 140.06 -170.33 24.36 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.632 -0.987 . . . . 15.619999999999999 110.632 172.924 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.32 -30.65 71.75 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 120.232 -0.587 . . . . 17.260000000000002 111.75 177.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -101.18 147.17 26.56 Favored 'General case' 0 C--O 1.215 -0.713 0 CA-C-O 118.954 -0.546 . . . . 34.259999999999998 110.214 -176.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 66.4 m -122.91 108.83 13.41 Favored 'General case' 0 C--O 1.251 1.163 0 O-C-N 124.436 1.085 . . . . 15.470000000000001 111.499 178.097 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 41.7 ptt85 -140.74 162.47 35.34 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 106.524 -1.658 . . . . 41.670000000000002 106.524 172.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -80.81 137.94 36.23 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 116.995 -1.882 . . . . 26.629999999999999 109.898 172.242 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 33.2 p80 -109.34 -16.38 14.04 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-N 115.981 -0.554 . . . . 15.85 109.802 178.848 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 77.0 t60 -158.06 139.8 13.85 Favored 'General case' 0 CA--C 1.516 -0.332 0 C-N-CA 119.978 -0.689 . . . . 15.26 109.792 -178.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 47.9 t -126.67 120.18 28.84 Favored 'General case' 0 C--O 1.248 1.023 0 N-CA-C 107.909 -1.145 . . . . 19.34 107.909 168.599 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -98.81 120.58 39.48 Favored 'General case' 0 C--O 1.249 1.045 0 N-CA-C 106.939 -1.504 . . . . 17.640000000000001 106.939 -179.112 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.7 ttmt -86.05 137.33 32.77 Favored 'General case' 0 C--O 1.245 0.867 0 C-N-CA 119.636 -0.825 . . . . 21.719999999999999 111.786 179.38 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 86.5 mt -120.37 131.69 54.94 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 109.845 -0.428 . . . . 17.02 109.845 175.687 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -87.91 164.92 15.61 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 119.091 -1.043 . . . . 21.780000000000001 109.888 170.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -53.2 131.76 37.54 Favored 'General case' 0 N--CA 1.444 -0.758 0 N-CA-C 112.504 0.557 . . . . 22.350000000000001 112.504 -172.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 88.42 -15.66 55.86 Favored Glycine 0 CA--C 1.529 0.968 0 N-CA-C 115.907 1.123 . . . . 14.34 115.907 -178.349 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 75.3 mt-10 -77.24 153.82 33.63 Favored 'General case' 0 C--O 1.246 0.871 0 CA-C-N 117.695 0.747 . . . . 20.879999999999999 109.447 179.604 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 95.8 t -125.43 135.27 64.51 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.266 0 O-C-N 123.961 0.788 . . . . 12.789999999999999 109.263 -175.173 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 26.1 tp -118.98 135.77 54.44 Favored 'General case' 0 C--O 1.257 1.47 0 N-CA-C 106.614 -1.624 . . . . 15.08 106.614 169.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 3.3 mp -117.18 114.22 45.09 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 N-CA-C 103.786 -2.672 . . . . 12.76 103.786 172.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -129.02 131.92 47.43 Favored 'General case' 0 C--O 1.219 -0.524 0 N-CA-C 109.501 -0.555 . . . . 12.0 109.501 -167.347 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -87.8 161.34 17.61 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 121.425 0.631 . . . . 13.720000000000001 112.488 177.951 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -83.03 148.87 27.29 Favored 'General case' 0 C--O 1.241 0.609 0 N-CA-C 105.255 -2.128 . . . . 15.27 105.255 160.157 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 62.7 p -149.39 -176.86 5.55 Favored 'General case' 0 C--O 1.215 -0.721 0 C-N-CA 120.998 -0.281 . . . . 11.99 110.463 -165.644 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 77.1 tt0 -58.53 -30.32 67.0 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.149 -0.478 . . . . 29.219999999999999 111.26 175.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 80.8 m80 -102.42 -15.47 16.5 Favored 'General case' 0 C--O 1.22 -0.45 0 N-CA-C 114.943 1.46 . . . . 17.760000000000002 114.943 -174.45 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 58.8 m -128.81 113.87 15.83 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 109.369 -0.604 . . . . 11.85 109.369 -172.197 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 85.9 p -116.46 0.16 12.66 Favored 'General case' 0 C--O 1.212 -0.92 0 N-CA-C 114.371 1.249 . . . . 11.06 114.371 -179.541 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -152.95 143.47 22.65 Favored 'General case' 0 CA--C 1.509 -0.598 0 N-CA-C 106.789 -1.56 . . . . 11.35 106.789 174.325 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 77.8 mt -127.74 131.93 69.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 108.575 -0.898 . . . . 11.970000000000001 108.575 179.154 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' LYS . . . . . . . . . . . . . 57.7 tttt -113.69 135.76 53.58 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 108.717 -0.846 . . . . 23.52 108.717 177.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 60.4 t -117.41 123.03 71.24 Favored 'Isoleucine or valine' 0 C--O 1.248 0.991 0 N-CA-C 105.865 -1.902 . . . . 15.32 105.865 179.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.5 ttm180 -117.26 118.85 33.42 Favored 'General case' 0 CA--C 1.517 -0.314 0 O-C-N 124.214 0.946 . . . . 43.170000000000002 109.228 179.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 119.05 154.08 9.51 Favored Glycine 0 C--O 1.253 1.302 0 N-CA-C 108.76 -1.736 . . . . 19.859999999999999 108.76 -175.381 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 9.9 tttt -65.7 126.01 27.07 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 117.197 0.499 . . . . 42.450000000000003 112.187 -176.58 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -153.01 147.65 26.16 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 109.086 -0.709 . . . . 16.629999999999999 109.086 -168.547 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -97.6 123.88 41.66 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 105.835 -1.913 . . . . 33.850000000000001 105.835 166.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 97.3 mt -122.21 131.89 72.2 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 O-C-N 123.556 0.535 . . . . 16.969999999999999 110.443 -171.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -118.87 136.73 53.88 Favored 'General case' 0 C--O 1.247 0.931 0 N-CA-C 108.771 -0.826 . . . . 27.059999999999999 108.771 173.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 22.5 p -131.74 179.7 5.9 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 107.578 -1.267 . . . . 25.949999999999999 107.578 168.639 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' ARG . . . . . 0.52 ' NH2' ' OD2' ' A' ' 8' ' ' ASP . 10.4 ttm180 -46.96 -29.52 2.1 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 116.011 1.856 . . . . 51.829999999999998 116.011 168.405 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -84.75 -13.26 51.8 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.222 1.193 . . . . 40.450000000000003 114.222 -177.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 130.61 -158.77 22.66 Favored Glycine 0 CA--C 1.529 0.915 0 O-C-N 122.824 0.077 . . . . 39.310000000000002 113.064 -174.977 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 2.9 p . . . . . 0 N--CA 1.469 0.482 0 C-N-CA 123.143 0.577 . . . . 41.68 112.378 -179.836 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 7' ' ' SER . . . . . . . . . . . . . 10.4 t . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.196 0.046 . . . . 38.149999999999999 111.054 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -65.16 147.53 53.29 Favored 'General case' 0 C--O 1.242 0.677 0 O-C-N 124.129 0.893 . . . . 39.630000000000003 111.023 179.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 47.9 p90 -151.03 160.6 43.81 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 123.557 0.536 . . . . 25.309999999999999 110.801 -176.543 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 10' ' ' VAL . . . . . . . . . . . . . 94.2 t -123.14 141.33 43.87 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.711 0 N-CA-C 106.411 -1.7 . . . . 17.41 106.411 -174.293 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 99.1 t -109.71 128.09 66.04 Favored 'Isoleucine or valine' 0 C--O 1.245 0.821 0 N-CA-C 107.208 -1.405 . . . . 14.5 107.208 173.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 12' ' ' ILE . . . . . . . . . . . . . 3.0 mp -125.29 119.76 56.32 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.77 0 N-CA-C 108.941 -0.763 . . . . 19.27 108.941 179.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 13' ' ' LYS . . . . . . . . . . . . . 28.1 tttt -112.5 125.95 54.79 Favored 'General case' 0 C--O 1.246 0.887 0 N-CA-C 109.469 -0.567 . . . . 33.710000000000001 109.469 171.864 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -74.51 133.06 42.34 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 107.884 -1.154 . . . . 16.370000000000001 107.884 -176.45 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 15' ' ' LEU . . . . . . . . . . . . . 81.6 mt -102.6 0.86 33.98 Favored 'General case' 0 C--O 1.252 1.22 0 O-C-N 123.715 0.634 . . . . 19.969999999999999 111.107 177.265 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -155.82 169.44 24.38 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 106.377 -1.712 . . . . 28.829999999999998 106.377 176.99 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -73.55 152.88 40.47 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 120.777 -0.369 . . . . 28.050000000000001 111.006 175.049 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 18' ' ' GLY . . . . . . . . . . . . . . . 87.49 11.42 68.87 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 116.572 1.389 . . . . 21.170000000000002 116.572 173.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 51.5 t -66.86 137.92 23.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 N-CA-C 107.642 -1.244 . . . . 18.859999999999999 107.642 178.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 20' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -120.15 132.69 55.49 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 119.84 -0.744 . . . . 34.469999999999999 109.852 176.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 98.4 t -113.3 122.72 67.98 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.742 0 N-CA-C 105.764 -1.939 . . . . 15.81 105.764 173.961 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 20.0 mt -119.44 130.6 73.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 108.747 -0.834 . . . . 21.289999999999999 108.747 -168.255 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -93.96 134.75 12.21 Favored Glycine 0 C--O 1.245 0.822 0 N-CA-C 110.18 -1.168 . . . . 14.18 110.18 175.611 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 24' ' ' LEU . . . . . . . . . . . . . 10.1 mp -107.73 135.81 48.53 Favored 'General case' 0 C--N 1.342 0.249 0 N-CA-C 107.254 -1.388 . . . . 17.510000000000002 107.254 179.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 46.7 p -65.91 137.63 57.3 Favored 'General case' 0 C--O 1.244 0.774 0 N-CA-C 114.367 1.247 . . . . 14.050000000000001 114.367 -173.896 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 56.8 ttm-85 -75.06 137.54 41.53 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 115.18 -0.918 . . . . 14.82 108.845 171.825 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 134.19 -168.33 23.42 Favored Glycine 0 C--O 1.254 1.359 0 C-N-CA 120.321 -0.942 . . . . 15.619999999999999 113.13 176.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.64 -34.96 79.44 Favored 'General case' 0 C--O 1.243 0.712 0 CA-C-O 122.327 1.061 . . . . 18.879999999999999 110.499 -179.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 81.0 m-20 -98.24 151.41 20.49 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 115.207 -0.906 . . . . 35.780000000000001 111.466 179.256 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 30' ' ' THR . . . . . . . . . . . . . 59.4 m -125.11 109.17 12.57 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.059 -0.973 . . . . 18.539999999999999 110.305 179.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 13.0 ptt85 -137.47 160.93 37.74 Favored 'General case' 0 C--O 1.219 -0.51 0 N-CA-C 109.392 -0.596 . . . . 41.840000000000003 109.392 172.4 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 32' ' ' PHE . . . . . . . . . . . . . 15.1 m-30 -72.31 127.69 33.33 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 105.562 -2.014 . . . . 30.190000000000001 105.562 174.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 33' ' ' HIS . . . . . . . . . . . . . 25.1 p80 -108.59 -17.46 13.96 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 113.335 0.865 . . . . 16.0 113.335 176.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 34' ' ' HIS . . . . . . . . . . . . . 86.2 t60 -161.44 141.55 10.65 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 109.608 -0.516 . . . . 17.359999999999999 109.608 179.151 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 35' ' ' SER . . . . . . . . . . . . . 45.6 t -125.48 122.77 37.6 Favored 'General case' 0 C--O 1.248 1.019 0 N-CA-C 108.405 -0.961 . . . . 21.73 108.405 169.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 39.9 tp10 -103.27 126.94 50.69 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 106.252 -1.759 . . . . 26.43 106.252 177.837 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 23.4 tttp -90.18 142.07 28.08 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.384 -0.371 . . . . 39.200000000000003 111.318 177.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 76.5 mt -127.05 129.78 48.68 Favored 'General case' 0 CA--C 1.508 -0.668 0 N-CA-C 106.874 -1.528 . . . . 20.920000000000002 106.874 178.321 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 61.8 m-20 -88.24 167.48 13.54 Favored 'General case' 0 CA--C 1.502 -0.867 0 C-N-CA 118.78 -1.168 . . . . 33.619999999999997 109.3 169.755 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -48.62 125.44 9.95 Favored 'General case' 0 C--O 1.238 0.484 0 N-CA-C 112.795 0.665 . . . . 24.57 112.795 -175.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 41' ' ' GLY . . . . . . . . . . . . . . . 89.35 -8.66 79.36 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-O 119.334 -0.703 . . . . 18.879999999999999 114.449 174.663 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -74.29 151.21 39.88 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 118.004 0.902 . . . . 33.280000000000001 110.416 174.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 43' ' ' VAL . . . . . . . . . . . . . 82.9 t -126.03 133.54 68.68 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 N-CA-C 108.294 -1.002 . . . . 15.16 108.294 -173.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 46.9 tp -117.53 128.42 54.95 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 108.878 -0.786 . . . . 15.19 108.878 172.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 3.3 mp -112.02 110.79 33.48 Favored 'Isoleucine or valine' 0 C--O 1.245 0.818 0 N-CA-C 105.092 -2.188 . . . . 14.43 105.092 173.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . -122.92 130.13 52.46 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 113.489 0.922 . . . . 14.529999999999999 113.489 -171.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -86.29 159.44 19.43 Favored 'General case' 0 N--CA 1.444 -0.728 0 N-CA-C 112.977 0.732 . . . . 14.99 112.977 176.24 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -82.25 144.69 30.47 Favored 'General case' 0 C--O 1.239 0.521 0 N-CA-C 105.203 -2.147 . . . . 14.98 105.203 160.074 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 57.8 p -146.35 -179.38 6.71 Favored 'General case' 0 C--O 1.222 -0.389 0 O-C-N 123.575 0.547 . . . . 13.1 110.065 -166.322 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 64.2 tt0 -54.46 -32.06 56.85 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 116.215 -0.448 . . . . 29.59 112.067 173.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 51' ' ' HIS . . . . . . . . . . . . . 80.4 m80 -103.6 -13.91 16.36 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.892 1.071 . . . . 17.82 113.892 -174.466 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 44.9 m -126.83 115.93 20.1 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 108.275 -1.009 . . . . 11.869999999999999 108.275 -173.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 53' ' ' SER . . . . . . . . . . . . . 78.3 p -116.97 -1.39 11.96 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 114.063 1.134 . . . . 12.130000000000001 114.063 178.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -151.98 148.88 28.26 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 108.981 -0.748 . . . . 11.44 108.981 173.1 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 94.7 mt -133.52 131.54 57.35 Favored 'Isoleucine or valine' 0 C--O 1.247 0.951 0 N-CA-C 107.264 -1.384 . . . . 12.800000000000001 107.264 -176.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 56' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -114.91 136.16 53.41 Favored 'General case' 0 CA--C 1.501 -0.932 0 N-CA-C 107.377 -1.342 . . . . 21.18 107.377 -178.746 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 57' ' ' VAL . . . . . . . . . . . . . 51.7 t -122.31 125.33 72.68 Favored 'Isoleucine or valine' 0 C--O 1.256 1.412 0 N-CA-C 106.992 -1.485 . . . . 15.640000000000001 106.992 -179.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 71.1 mtp180 -118.43 127.27 53.5 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-N 115.537 -0.756 . . . . 40.200000000000003 109.073 178.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.55 167.58 15.79 Favored Glycine 0 N--CA 1.445 -0.731 0 N-CA-C 109.891 -1.283 . . . . 20.129999999999999 109.891 -179.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 60' ' ' LYS . . . . . . . . . . . . . 25.8 tttm -75.32 121.78 22.74 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 108.165 -1.05 . . . . 37.329999999999998 108.165 -173.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -149.87 151.8 34.05 Favored 'General case' 0 C--O 1.254 1.292 0 N-CA-C 113.143 0.794 . . . . 16.940000000000001 113.143 -173.806 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 62' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -99.72 123.79 44.33 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 104.994 -2.224 . . . . 38.509999999999998 104.994 172.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 63' ' ' ILE . . . . . . . . . . . . . 85.7 mt -123.26 130.72 74.14 Favored 'Isoleucine or valine' 0 C--O 1.241 0.633 0 O-C-N 123.291 0.369 . . . . 17.75 110.352 -172.677 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 64' ' ' GLN . . . . . . . . . . . . . 82.0 mt-30 -121.63 135.24 54.99 Favored 'General case' 0 CA--C 1.504 -0.794 0 C-N-CA 120.711 -0.396 . . . . 31.640000000000001 110.35 174.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 65' ' ' THR . . . . . . . . . . . . . 44.8 p -133.01 -179.49 5.52 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 107.275 -1.38 . . . . 24.82 107.275 168.653 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 66' ' ' ARG . . . . . . . . . . . . . 1.9 ttp85 -49.93 -27.63 5.57 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 114.486 1.291 . . . . 50.520000000000003 114.486 167.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 67' ' ' HIS . . . . . . . . . . . . . 5.3 m-70 -81.27 -17.15 50.38 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 113.552 0.945 . . . . 32.030000000000001 113.552 -176.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 68' ' ' GLY . . . . . . . . . . . . . . . 131.88 -154.27 20.88 Favored Glycine 0 N--CA 1.448 -0.506 0 N-CA-C 111.409 -0.676 . . . . 33.090000000000003 111.409 -176.832 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 69' ' ' VAL . . . . . . . . . . . . . 15.6 m -121.58 143.79 32.87 Favored 'Isoleucine or valine' 0 C--O 1.246 0.906 0 O-C-N 123.967 0.451 . . . . 36.140000000000001 111.947 -170.412 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 70' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -131.3 119.72 44.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 N-CA-C 108.844 -0.798 . . . . 39.390000000000001 108.844 168.025 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -117.51 120.86 39.37 Favored 'General case' 0 C--O 1.244 0.764 0 C-N-CA 122.686 0.394 . . . . 41.170000000000002 110.559 -178.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 72' ' ' SER . . . . . . . . . . . . . 29.1 m . . . . . 0 N--CA 1.467 0.418 0 N-CA-C 112.87 0.692 . . . . 37.460000000000001 112.87 -179.826 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 1.3 t . . . . . 0 N--CA 1.497 1.877 0 CA-C-O 120.353 0.12 . . . . 38.020000000000003 111.307 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 8' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -60.45 145.13 49.38 Favored 'General case' 0 C--O 1.247 0.944 0 O-C-N 124.7 1.25 . . . . 39.490000000000002 109.282 176.223 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 9' ' ' PHE . . . . . . . . . . . . . 38.2 p90 -146.13 160.68 41.6 Favored 'General case' 0 C--O 1.236 0.343 0 O-C-N 123.975 0.797 . . . . 27.379999999999999 110.593 -178.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 12.9 m -123.93 143.33 37.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 107.378 -1.341 . . . . 19.98 107.378 -176.407 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 11' ' ' VAL . . . . . . . . . . . . . 63.0 t -110.81 126.11 68.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 107.595 -1.261 . . . . 15.24 107.595 174.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 2.6 mp -123.49 118.36 54.19 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.489 0 O-C-N 124.168 0.918 . . . . 18.530000000000001 109.973 -178.876 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 13' ' ' LYS . . . . . . . . . . . . . 69.6 tttt -111.48 122.73 48.59 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 110.138 -0.319 . . . . 32.740000000000002 110.138 172.376 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.85 131.79 42.71 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 107.447 -1.316 . . . . 18.719999999999999 107.447 -176.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 15' ' ' LEU . . . . . . . . . . . . . 42.2 mt -101.53 0.66 36.96 Favored 'General case' 0 C--O 1.247 0.963 0 N-CA-C 113.283 0.846 . . . . 24.399999999999999 113.283 175.357 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 18.1 pt-20 -151.84 168.75 24.12 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 124.274 1.03 . . . . 30.620000000000001 108.295 175.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 17' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -71.2 151.61 44.18 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.336 0.588 . . . . 28.989999999999998 111.613 176.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 18' ' ' GLY . . . . . . . . . . . . . . . 78.39 21.4 69.95 Favored Glycine 0 CA--C 1.523 0.56 0 N-CA-C 115.817 1.087 . . . . 20.850000000000001 115.817 170.089 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 19' ' ' VAL . . . . . . . . . . . . . 54.1 t -66.05 146.42 13.24 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.237 0 N-CA-C 107.567 -1.272 . . . . 18.239999999999998 107.567 172.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 20' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -122.71 131.44 53.8 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 108.173 -1.047 . . . . 34.93 108.173 177.15 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 21' ' ' VAL . . . . . . . . . . . . . 98.6 t -111.92 120.42 62.25 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.511 0 N-CA-C 104.225 -2.509 . . . . 13.73 104.225 173.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 22' ' ' ILE . . . . . . . . . . . . . 26.7 mt -115.32 129.55 71.37 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.854 0 O-C-N 124.297 0.998 . . . . 20.079999999999998 111.134 -170.727 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 23' ' ' GLY . . . . . . . . . . . . . . . -95.01 130.36 10.26 Favored Glycine 0 C--N 1.34 0.766 0 N-CA-C 110.402 -1.079 . . . . 12.67 110.402 175.663 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 24' ' ' LEU . . . . . . . . . . . . . 8.1 mp -102.3 141.34 35.29 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 108.004 -1.11 . . . . 17.350000000000001 108.004 177.704 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 44.6 p -69.14 139.54 54.69 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 113.519 0.933 . . . . 12.25 113.519 -172.921 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 26' ' ' ARG . . . . . . . . . . . . . 59.3 ttm-85 -78.01 140.37 39.16 Favored 'General case' 0 C--O 1.255 1.352 0 N-CA-C 107.822 -1.177 . . . . 12.31 107.822 171.584 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 129.42 -168.04 21.14 Favored Glycine 0 C--O 1.254 1.39 0 N-CA-C 111.802 -0.519 . . . . 12.33 111.802 171.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.92 -34.41 77.39 Favored 'General case' 0 C--O 1.246 0.885 0 C-N-CA 119.674 -0.81 . . . . 15.83 111.164 179.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 29' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 -96.34 152.85 18.2 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 119.58 -0.848 . . . . 32.840000000000003 111.211 177.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 30' ' ' THR . . . . . . . . . . . . . 85.3 m -132.11 111.69 11.68 Favored 'General case' 0 C--O 1.243 0.721 0 N-CA-C 108.445 -0.946 . . . . 16.690000000000001 108.445 -177.468 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 31' ' ' ARG . . . . . . . . . . . . . 11.1 ptp85 -145.91 167.05 24.21 Favored 'General case' 0 C--O 1.242 0.71 0 N-CA-C 107.601 -1.259 . . . . 26.949999999999999 107.601 170.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 32' ' ' PHE . . . . . . . . . . . . . 18.4 m-30 -74.88 129.54 37.85 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 107.654 -1.239 . . . . 26.09 107.654 177.296 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 33' ' ' HIS . . . . . . . . . . . . . 25.3 p80 -107.73 -13.49 15.01 Favored 'General case' 0 C--O 1.243 0.727 0 O-C-N 121.27 -0.894 . . . . 15.34 112.8 176.263 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 34' ' ' HIS . . . . . . . . . . . . . 83.0 t60 -165.18 138.86 4.72 Favored 'General case' 0 CA--C 1.499 -1.014 0 N-CA-C 109.867 -0.42 . . . . 18.100000000000001 109.867 -178.655 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 35' ' ' SER . . . . . . . . . . . . . 42.0 t -125.53 121.56 34.03 Favored 'General case' 0 C--O 1.259 1.573 0 N-CA-C 106.489 -1.671 . . . . 18.34 106.489 171.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 31.6 tp10 -101.79 124.24 47.09 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 107.081 -1.452 . . . . 18.82 107.081 179.009 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 37' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -87.58 137.93 31.91 Favored 'General case' 0 C--O 1.248 1.004 0 C-N-CA 120.135 -0.626 . . . . 35.899999999999999 111.276 177.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 87.4 mt -125.4 126.51 45.09 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.351 -0.981 . . . . 21.16 108.351 177.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 39' ' ' ASP . . . . . . . . . . . . . 68.5 m-20 -90.84 169.95 10.51 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 120.349 -0.54 . . . . 29.41 110.373 172.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 40' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -55.02 128.8 35.31 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 120.521 -0.471 . . . . 35.380000000000003 110.801 -167.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.72 -11.74 70.82 Favored Glycine 0 CA--C 1.531 1.083 0 N-CA-C 115.152 0.821 . . . . 19.870000000000001 115.152 176.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 42' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -78.86 151.18 31.97 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.125 -0.694 . . . . 25.25 109.125 179.843 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 43' ' ' VAL . . . . . . . . . . . . . 73.4 t -127.84 139.52 51.67 Favored 'Isoleucine or valine' 0 C--O 1.24 0.574 0 N-CA-C 107.753 -1.203 . . . . 15.5 107.753 -171.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 44' ' ' LEU . . . . . . . . . . . . . 25.7 tp -123.38 131.12 53.55 Favored 'General case' 0 C--O 1.241 0.609 0 N-CA-C 108.529 -0.915 . . . . 15.720000000000001 108.529 169.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 45' ' ' ILE . . . . . . . . . . . . . 3.5 mp -113.98 115.44 49.67 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.733 0 N-CA-C 104.919 -2.252 . . . . 15.1 104.919 174.152 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 46' ' ' ALA . . . . . . . . . . . . . . . -131.14 129.74 42.2 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 109.159 -0.682 . . . . 14.84 109.159 -165.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 47' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -85.16 159.75 20.07 Favored 'General case' 0 C--O 1.241 0.635 0 N-CA-C 114.011 1.115 . . . . 16.100000000000001 114.011 175.735 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 48' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -81.91 146.55 29.75 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 106.242 -1.762 . . . . 14.4 106.242 158.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 49' ' ' THR . . . . . . . . . . . . . 48.4 p -148.19 -178.57 6.37 Favored 'General case' 0 C--O 1.219 -0.52 0 C-N-CA 119.851 -0.74 . . . . 12.91 109.101 -165.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 50' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -57.19 -31.12 65.12 Favored 'General case' 0 C--O 1.242 0.704 0 O-C-N 123.701 0.626 . . . . 29.84 111.313 173.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 51' ' ' HIS . . . . . . . . . . . . . 80.8 m80 -101.93 -12.76 17.97 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 115.482 1.66 . . . . 18.809999999999999 115.482 -175.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 52' ' ' THR . . . . . . . . . . . . . 45.8 m -130.08 115.82 17.62 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 108.678 -0.86 . . . . 12.130000000000001 108.678 -171.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 87.0 p -119.39 1.01 11.21 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 113.715 1.006 . . . . 11.109999999999999 113.715 179.738 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 54' ' ' ALA . . . . . . . . . . . . . . . -152.9 146.96 25.44 Favored 'General case' 0 CA--C 1.51 -0.57 0 N-CA-C 107.145 -1.428 . . . . 10.800000000000001 107.145 172.07 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 55' ' ' ILE . . . . . . . . . . . . . 76.8 mt -130.1 128.79 65.01 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.887 0 CA-C-N 115.634 -0.712 . . . . 12.99 109.19 -177.019 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 56' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -111.83 135.47 52.4 Favored 'General case' 0 C--O 1.219 -0.543 0 N-CA-C 109.053 -0.721 . . . . 21.620000000000001 109.053 -177.671 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 57' ' ' VAL . . . . . . . . . . . . . 61.1 t -118.89 124.42 73.14 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 N-CA-C 107.722 -1.214 . . . . 14.529999999999999 107.722 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 58' ' ' ARG . . . . . . . . . . . . . 80.4 mtp180 -118.16 125.6 50.54 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.358 -0.837 . . . . 39.07 109.461 177.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.42 160.72 13.4 Favored Glycine 0 CA--C 1.497 -1.075 0 N-CA-C 107.826 -2.11 . . . . 20.210000000000001 107.826 179.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 60' ' ' LYS . . . . . . . . . . . . . 48.4 tttp -65.72 117.94 8.87 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 109.403 -0.592 . . . . 37.520000000000003 109.403 -176.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 61' ' ' ALA . . . . . . . . . . . . . . . -144.66 150.77 37.93 Favored 'General case' 0 C--O 1.242 0.699 0 CA-C-O 121.018 0.437 . . . . 18.440000000000001 111.142 -174.829 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 62' ' ' TYR . . . . . . . . . . . . . 63.3 t80 -100.01 123.65 44.49 Favored 'General case' 0 C--O 1.218 -0.555 0 N-CA-C 105.214 -2.143 . . . . 35.649999999999999 105.214 168.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 63' ' ' ILE . . . . . . . . . . . . . 75.8 mt -124.51 135.02 65.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 O-C-N 123.57 0.544 . . . . 20.010000000000002 110.028 -173.106 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 64' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -123.02 135.01 54.29 Favored 'General case' 0 N--CA 1.462 0.142 0 O-C-N 123.642 0.589 . . . . 29.23 110.603 172.909 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 65' ' ' THR . . . . . . . . . . . . . 32.9 p -133.57 -178.0 4.8 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 107.235 -1.394 . . . . 25.579999999999998 107.235 170.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 66' ' ' ARG . . . . . . . . . . . . . 10.2 ttp180 -55.46 -26.8 44.42 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 112.323 0.49 . . . . 48.189999999999998 112.323 172.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 67' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -81.18 -10.67 59.59 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 115.171 1.545 . . . . 32.68 115.171 -178.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 68' ' ' GLY . . . . . . . . . . . . . . . 125.65 -155.15 18.88 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.302 -0.951 . . . . 31.609999999999999 112.428 -179.78 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 69' ' ' VAL . . . . . . . . . . . . . 27.6 t -110.32 148.94 13.48 Favored 'Isoleucine or valine' 0 C--O 1.24 0.565 0 CA-C-O 121.487 0.661 . . . . 34.0 111.267 -172.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 70' ' ' ILE . . . . . . . . . . . . 0.253 11.6 tt -143.39 112.2 1.95 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.2 0 CA-C-N 115.073 -0.967 . . . . 39.899999999999999 108.971 171.246 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' C' C ' 71' ' ' GLU . . . . . . . . . . . . . 27.7 tt0 -126.84 126.2 42.94 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 114.572 1.323 . . . . 44.280000000000001 114.572 -170.041 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 72' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.476 0.838 0 C-N-CA 123.485 0.714 . . . . 47.07 109.708 162.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 100' ' ' TRP . . . . . . . . . . . . . 66.1 t-105 . . . . . 0 N--CA 1.517 2.922 0 CA-C-O 118.409 -0.805 . . . . 14.35 110.586 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1100 ' ' TRP . . . . . . . . . . . . . 70.3 t-105 . . . . . 0 N--CA 1.488 1.442 0 CA-C-O 121.204 0.526 . . . . 13.68 110.091 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2100 ' ' TRP . . . . . . . . . . . . . 65.9 t-105 . . . . . 0 N--CA 1.513 2.689 0 CA-C-O 120.912 0.387 . . . . 13.49 111.145 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2101 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2102 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2103 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2104 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2105 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2106 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2107 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2108 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2109 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2110 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2111 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2112 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2113 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2114 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2115 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2116 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2117 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2118 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2119 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2120 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2121 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 2122 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 12.1 t . . . . . 0 N--CA 1.492 1.645 0 N-CA-C 112.172 0.434 . . . . 34.289999999999999 112.172 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 8' ' ' ASP . . . . . 0.407 ' OD2' ' NH2' ' A' ' 66' ' ' ARG . 2.9 m-20 -56.59 148.43 19.81 Favored 'General case' 0 C--O 1.247 0.928 0 C-N-CA 125.157 1.383 . . . . 38.030000000000001 110.354 179.253 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 48.8 p90 -149.91 164.15 36.19 Favored 'General case' 0 C--O 1.253 1.267 0 O-C-N 124.241 0.963 . . . . 25.620000000000001 111.199 -177.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 48.4 t -125.54 143.93 37.37 Favored 'Isoleucine or valine' 0 C--O 1.245 0.859 0 N-CA-C 106.117 -1.808 . . . . 18.379999999999999 106.117 -176.992 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 60.2 t -110.38 124.61 67.29 Favored 'Isoleucine or valine' 0 C--O 1.249 1.051 0 N-CA-C 106.191 -1.781 . . . . 13.76 106.191 173.235 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.6 mp -121.51 121.02 63.5 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 O-C-N 123.934 0.772 . . . . 14.9 110.756 177.389 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -111.13 122.09 46.99 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 109.485 -0.561 . . . . 32.299999999999997 109.485 173.518 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -74.87 135.82 41.53 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 108.26 -1.015 . . . . 14.49 108.26 -175.451 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 56.6 mt -108.27 2.12 22.47 Favored 'General case' 0 C--O 1.263 1.797 0 O-C-N 123.802 0.689 . . . . 20.27 111.613 176.5 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -147.27 168.71 21.06 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 107.083 -1.451 . . . . 28.530000000000001 107.083 173.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -74.26 150.3 40.31 Favored 'General case' 0 CA--C 1.505 -0.781 0 C-N-CA 119.121 -1.032 . . . . 16.699999999999999 110.649 174.367 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 82.85 19.66 62.9 Favored Glycine 0 N--CA 1.444 -0.804 0 C-N-CA 118.589 -1.767 . . . . 14.77 114.184 168.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 59.2 t -65.95 135.93 27.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 N-CA-C 107.89 -1.152 . . . . 14.68 107.89 173.368 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 17.7 m-20 -114.91 124.23 51.17 Favored 'General case' 0 C--O 1.24 0.586 0 N-CA-C 105.998 -1.853 . . . . 24.09 105.998 -176.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 88.0 t -105.31 115.04 46.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 N-CA-C 104.835 -2.283 . . . . 12.449999999999999 104.835 175.745 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 44.4 mt -111.82 122.18 65.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 108.666 -0.864 . . . . 17.449999999999999 108.666 -163.127 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -98.29 128.92 9.72 Favored Glycine 0 C--O 1.245 0.796 0 N-CA-C 109.367 -1.493 . . . . 13.32 109.367 179.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 63.0 mt -102.21 140.39 36.56 Favored 'General case' 0 C--O 1.25 1.099 0 CA-C-O 120.938 0.399 . . . . 17.0 110.25 -179.3 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 38.7 p -64.37 133.6 52.92 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 114.245 1.202 . . . . 13.41 114.245 -174.154 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 59.6 ttm-85 -72.3 136.02 46.12 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 108.141 -1.059 . . . . 14.539999999999999 108.141 167.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 140.06 -170.33 24.36 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.632 -0.987 . . . . 15.619999999999999 110.632 172.924 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.32 -30.65 71.75 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 120.232 -0.587 . . . . 17.260000000000002 111.75 177.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -101.18 147.17 26.56 Favored 'General case' 0 C--O 1.215 -0.713 0 CA-C-O 118.954 -0.546 . . . . 34.259999999999998 110.214 -176.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' THR . . . . . 0.622 ' HG1' ' N ' ' B' 1100 ' ' TRP . 66.4 m -122.91 108.83 13.41 Favored 'General case' 0 C--O 1.251 1.163 0 O-C-N 124.436 1.085 . . . . 15.470000000000001 111.499 178.097 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 41.7 ptt85 -140.74 162.47 35.34 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 106.524 -1.658 . . . . 41.670000000000002 106.524 172.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -80.81 137.94 36.23 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 116.995 -1.882 . . . . 26.629999999999999 109.898 172.242 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 33.2 p80 -109.34 -16.38 14.04 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-N 115.981 -0.554 . . . . 15.85 109.802 178.848 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 77.0 t60 -158.06 139.8 13.85 Favored 'General case' 0 CA--C 1.516 -0.332 0 C-N-CA 119.978 -0.689 . . . . 15.26 109.792 -178.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 47.9 t -126.67 120.18 28.84 Favored 'General case' 0 C--O 1.248 1.023 0 N-CA-C 107.909 -1.145 . . . . 19.34 107.909 168.599 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -98.81 120.58 39.48 Favored 'General case' 0 C--O 1.249 1.045 0 N-CA-C 106.939 -1.504 . . . . 17.640000000000001 106.939 -179.112 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.7 ttmt -86.05 137.33 32.77 Favored 'General case' 0 C--O 1.245 0.867 0 C-N-CA 119.636 -0.825 . . . . 21.719999999999999 111.786 179.38 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 86.5 mt -120.37 131.69 54.94 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 109.845 -0.428 . . . . 17.02 109.845 175.687 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -87.91 164.92 15.61 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 119.091 -1.043 . . . . 21.780000000000001 109.888 170.137 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -53.2 131.76 37.54 Favored 'General case' 0 N--CA 1.444 -0.758 0 N-CA-C 112.504 0.557 . . . . 22.350000000000001 112.504 -172.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 88.42 -15.66 55.86 Favored Glycine 0 CA--C 1.529 0.968 0 N-CA-C 115.907 1.123 . . . . 14.34 115.907 -178.349 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 75.3 mt-10 -77.24 153.82 33.63 Favored 'General case' 0 C--O 1.246 0.871 0 CA-C-N 117.695 0.747 . . . . 20.879999999999999 109.447 179.604 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 95.8 t -125.43 135.27 64.51 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.266 0 O-C-N 123.961 0.788 . . . . 12.789999999999999 109.263 -175.173 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 26.1 tp -118.98 135.77 54.44 Favored 'General case' 0 C--O 1.257 1.47 0 N-CA-C 106.614 -1.624 . . . . 15.08 106.614 169.16 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 3.3 mp -117.18 114.22 45.09 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 N-CA-C 103.786 -2.672 . . . . 12.76 103.786 172.887 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -129.02 131.92 47.43 Favored 'General case' 0 C--O 1.219 -0.524 0 N-CA-C 109.501 -0.555 . . . . 12.0 109.501 -167.347 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -87.8 161.34 17.61 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 121.425 0.631 . . . . 13.720000000000001 112.488 177.951 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -83.03 148.87 27.29 Favored 'General case' 0 C--O 1.241 0.609 0 N-CA-C 105.255 -2.128 . . . . 15.27 105.255 160.157 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 62.7 p -149.39 -176.86 5.55 Favored 'General case' 0 C--O 1.215 -0.721 0 C-N-CA 120.998 -0.281 . . . . 11.99 110.463 -165.644 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 77.1 tt0 -58.53 -30.32 67.0 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.149 -0.478 . . . . 29.219999999999999 111.26 175.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 80.8 m80 -102.42 -15.47 16.5 Favored 'General case' 0 C--O 1.22 -0.45 0 N-CA-C 114.943 1.46 . . . . 17.760000000000002 114.943 -174.45 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 58.8 m -128.81 113.87 15.83 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 109.369 -0.604 . . . . 11.85 109.369 -172.197 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 85.9 p -116.46 0.16 12.66 Favored 'General case' 0 C--O 1.212 -0.92 0 N-CA-C 114.371 1.249 . . . . 11.06 114.371 -179.541 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -152.95 143.47 22.65 Favored 'General case' 0 CA--C 1.509 -0.598 0 N-CA-C 106.789 -1.56 . . . . 11.35 106.789 174.325 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 77.8 mt -127.74 131.93 69.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 108.575 -0.898 . . . . 11.970000000000001 108.575 179.154 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' LYS . . . . . 0.539 ' HE3' HD23 ' B' ' 38' ' ' LEU . 57.7 tttt -113.69 135.76 53.58 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 108.717 -0.846 . . . . 23.52 108.717 177.73 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 60.4 t -117.41 123.03 71.24 Favored 'Isoleucine or valine' 0 C--O 1.248 0.991 0 N-CA-C 105.865 -1.902 . . . . 15.32 105.865 179.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.5 ttm180 -117.26 118.85 33.42 Favored 'General case' 0 CA--C 1.517 -0.314 0 O-C-N 124.214 0.946 . . . . 43.170000000000002 109.228 179.288 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 119.05 154.08 9.51 Favored Glycine 0 C--O 1.253 1.302 0 N-CA-C 108.76 -1.736 . . . . 19.859999999999999 108.76 -175.381 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 9.9 tttt -65.7 126.01 27.07 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 117.197 0.499 . . . . 42.450000000000003 112.187 -176.58 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -153.01 147.65 26.16 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 109.086 -0.709 . . . . 16.629999999999999 109.086 -168.547 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -97.6 123.88 41.66 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 105.835 -1.913 . . . . 33.850000000000001 105.835 166.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 97.3 mt -122.21 131.89 72.2 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 O-C-N 123.556 0.535 . . . . 16.969999999999999 110.443 -171.899 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -118.87 136.73 53.88 Favored 'General case' 0 C--O 1.247 0.931 0 N-CA-C 108.771 -0.826 . . . . 27.059999999999999 108.771 173.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 22.5 p -131.74 179.7 5.9 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 107.578 -1.267 . . . . 25.949999999999999 107.578 168.639 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' ARG . . . . . 0.407 ' NH2' ' OD2' ' A' ' 8' ' ' ASP . 10.4 ttm180 -46.96 -29.52 2.1 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 116.011 1.856 . . . . 51.829999999999998 116.011 168.405 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -84.75 -13.26 51.8 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.222 1.193 . . . . 40.450000000000003 114.222 -177.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 130.61 -158.77 22.66 Favored Glycine 0 CA--C 1.529 0.915 0 O-C-N 122.824 0.077 . . . . 39.310000000000002 113.064 -174.977 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 2.9 p . . . . . 0 N--CA 1.469 0.482 0 C-N-CA 123.143 0.577 . . . . 41.68 112.378 -179.836 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 7' ' ' SER . . . . . . . . . . . . . 10.4 t . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.196 0.046 . . . . 38.149999999999999 111.054 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -65.16 147.53 53.29 Favored 'General case' 0 C--O 1.242 0.677 0 O-C-N 124.129 0.893 . . . . 39.630000000000003 111.023 179.505 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 47.9 p90 -151.03 160.6 43.81 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 123.557 0.536 . . . . 25.309999999999999 110.801 -176.543 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 10' ' ' VAL . . . . . . . . . . . . . 94.2 t -123.14 141.33 43.87 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.711 0 N-CA-C 106.411 -1.7 . . . . 17.41 106.411 -174.293 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 99.1 t -109.71 128.09 66.04 Favored 'Isoleucine or valine' 0 C--O 1.245 0.821 0 N-CA-C 107.208 -1.405 . . . . 14.5 107.208 173.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 12' ' ' ILE . . . . . . . . . . . . . 3.0 mp -125.29 119.76 56.32 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.77 0 N-CA-C 108.941 -0.763 . . . . 19.27 108.941 179.485 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 13' ' ' LYS . . . . . . . . . . . . . 28.1 tttt -112.5 125.95 54.79 Favored 'General case' 0 C--O 1.246 0.887 0 N-CA-C 109.469 -0.567 . . . . 33.710000000000001 109.469 171.864 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -74.51 133.06 42.34 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 107.884 -1.154 . . . . 16.370000000000001 107.884 -176.45 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 15' ' ' LEU . . . . . 0.634 ' HB2' ' HG2' ' B' ' 60' ' ' LYS . 81.6 mt -102.6 0.86 33.98 Favored 'General case' 0 C--O 1.252 1.22 0 O-C-N 123.715 0.634 . . . . 19.969999999999999 111.107 177.265 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -155.82 169.44 24.38 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 106.377 -1.712 . . . . 28.829999999999998 106.377 176.99 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -73.55 152.88 40.47 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 120.777 -0.369 . . . . 28.050000000000001 111.006 175.049 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 18' ' ' GLY . . . . . . . . . . . . . . . 87.49 11.42 68.87 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 116.572 1.389 . . . . 21.170000000000002 116.572 173.188 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 51.5 t -66.86 137.92 23.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 N-CA-C 107.642 -1.244 . . . . 18.859999999999999 107.642 178.915 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 20' ' ' ASN . . . . . . . . . . . . . 78.3 m-20 -120.15 132.69 55.49 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 119.84 -0.744 . . . . 34.469999999999999 109.852 176.199 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 98.4 t -113.3 122.72 67.98 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.742 0 N-CA-C 105.764 -1.939 . . . . 15.81 105.764 173.961 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 20.0 mt -119.44 130.6 73.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 108.747 -0.834 . . . . 21.289999999999999 108.747 -168.255 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -93.96 134.75 12.21 Favored Glycine 0 C--O 1.245 0.822 0 N-CA-C 110.18 -1.168 . . . . 14.18 110.18 175.611 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 24' ' ' LEU . . . . . . . . . . . . . 10.1 mp -107.73 135.81 48.53 Favored 'General case' 0 C--N 1.342 0.249 0 N-CA-C 107.254 -1.388 . . . . 17.510000000000002 107.254 179.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 46.7 p -65.91 137.63 57.3 Favored 'General case' 0 C--O 1.244 0.774 0 N-CA-C 114.367 1.247 . . . . 14.050000000000001 114.367 -173.896 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 56.8 ttm-85 -75.06 137.54 41.53 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 115.18 -0.918 . . . . 14.82 108.845 171.825 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 134.19 -168.33 23.42 Favored Glycine 0 C--O 1.254 1.359 0 C-N-CA 120.321 -0.942 . . . . 15.619999999999999 113.13 176.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.64 -34.96 79.44 Favored 'General case' 0 C--O 1.243 0.712 0 CA-C-O 122.327 1.061 . . . . 18.879999999999999 110.499 -179.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 81.0 m-20 -98.24 151.41 20.49 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 115.207 -0.906 . . . . 35.780000000000001 111.466 179.256 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 30' ' ' THR . . . . . 0.602 ' HG1' ' N ' ' B' 2100 ' ' TRP . 59.4 m -125.11 109.17 12.57 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.059 -0.973 . . . . 18.539999999999999 110.305 179.282 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 13.0 ptt85 -137.47 160.93 37.74 Favored 'General case' 0 C--O 1.219 -0.51 0 N-CA-C 109.392 -0.596 . . . . 41.840000000000003 109.392 172.4 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 32' ' ' PHE . . . . . . . . . . . . . 15.1 m-30 -72.31 127.69 33.33 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 105.562 -2.014 . . . . 30.190000000000001 105.562 174.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 33' ' ' HIS . . . . . . . . . . . . . 25.1 p80 -108.59 -17.46 13.96 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 113.335 0.865 . . . . 16.0 113.335 176.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 34' ' ' HIS . . . . . . . . . . . . . 86.2 t60 -161.44 141.55 10.65 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 109.608 -0.516 . . . . 17.359999999999999 109.608 179.151 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 35' ' ' SER . . . . . . . . . . . . . 45.6 t -125.48 122.77 37.6 Favored 'General case' 0 C--O 1.248 1.019 0 N-CA-C 108.405 -0.961 . . . . 21.73 108.405 169.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 39.9 tp10 -103.27 126.94 50.69 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 106.252 -1.759 . . . . 26.43 106.252 177.837 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 23.4 tttp -90.18 142.07 28.08 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.384 -0.371 . . . . 39.200000000000003 111.318 177.082 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 38' ' ' LEU . . . . . 0.539 HD23 ' HE3' ' A' ' 56' ' ' LYS . 76.5 mt -127.05 129.78 48.68 Favored 'General case' 0 CA--C 1.508 -0.668 0 N-CA-C 106.874 -1.528 . . . . 20.920000000000002 106.874 178.321 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 61.8 m-20 -88.24 167.48 13.54 Favored 'General case' 0 CA--C 1.502 -0.867 0 C-N-CA 118.78 -1.168 . . . . 33.619999999999997 109.3 169.755 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -48.62 125.44 9.95 Favored 'General case' 0 C--O 1.238 0.484 0 N-CA-C 112.795 0.665 . . . . 24.57 112.795 -175.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 41' ' ' GLY . . . . . . . . . . . . . . . 89.35 -8.66 79.36 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-O 119.334 -0.703 . . . . 18.879999999999999 114.449 174.663 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -74.29 151.21 39.88 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 118.004 0.902 . . . . 33.280000000000001 110.416 174.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 43' ' ' VAL . . . . . . . . . . . . . 82.9 t -126.03 133.54 68.68 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 N-CA-C 108.294 -1.002 . . . . 15.16 108.294 -173.357 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 46.9 tp -117.53 128.42 54.95 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 108.878 -0.786 . . . . 15.19 108.878 172.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 3.3 mp -112.02 110.79 33.48 Favored 'Isoleucine or valine' 0 C--O 1.245 0.818 0 N-CA-C 105.092 -2.188 . . . . 14.43 105.092 173.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . -122.92 130.13 52.46 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 113.489 0.922 . . . . 14.529999999999999 113.489 -171.185 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -86.29 159.44 19.43 Favored 'General case' 0 N--CA 1.444 -0.728 0 N-CA-C 112.977 0.732 . . . . 14.99 112.977 176.24 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -82.25 144.69 30.47 Favored 'General case' 0 C--O 1.239 0.521 0 N-CA-C 105.203 -2.147 . . . . 14.98 105.203 160.074 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 57.8 p -146.35 -179.38 6.71 Favored 'General case' 0 C--O 1.222 -0.389 0 O-C-N 123.575 0.547 . . . . 13.1 110.065 -166.322 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 64.2 tt0 -54.46 -32.06 56.85 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 116.215 -0.448 . . . . 29.59 112.067 173.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 51' ' ' HIS . . . . . . . . . . . . . 80.4 m80 -103.6 -13.91 16.36 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.892 1.071 . . . . 17.82 113.892 -174.466 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 44.9 m -126.83 115.93 20.1 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 108.275 -1.009 . . . . 11.869999999999999 108.275 -173.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 53' ' ' SER . . . . . . . . . . . . . 78.3 p -116.97 -1.39 11.96 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 114.063 1.134 . . . . 12.130000000000001 114.063 178.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -151.98 148.88 28.26 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 108.981 -0.748 . . . . 11.44 108.981 173.1 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 94.7 mt -133.52 131.54 57.35 Favored 'Isoleucine or valine' 0 C--O 1.247 0.951 0 N-CA-C 107.264 -1.384 . . . . 12.800000000000001 107.264 -176.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 56' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -114.91 136.16 53.41 Favored 'General case' 0 CA--C 1.501 -0.932 0 N-CA-C 107.377 -1.342 . . . . 21.18 107.377 -178.746 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 57' ' ' VAL . . . . . . . . . . . . . 51.7 t -122.31 125.33 72.68 Favored 'Isoleucine or valine' 0 C--O 1.256 1.412 0 N-CA-C 106.992 -1.485 . . . . 15.640000000000001 106.992 -179.645 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 71.1 mtp180 -118.43 127.27 53.5 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-N 115.537 -0.756 . . . . 40.200000000000003 109.073 178.108 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.55 167.58 15.79 Favored Glycine 0 N--CA 1.445 -0.731 0 N-CA-C 109.891 -1.283 . . . . 20.129999999999999 109.891 -179.922 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 60' ' ' LYS . . . . . 0.68 ' HG3' ' CB ' ' B' ' 72' ' ' SER . 25.8 tttm -75.32 121.78 22.74 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 108.165 -1.05 . . . . 37.329999999999998 108.165 -173.712 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -149.87 151.8 34.05 Favored 'General case' 0 C--O 1.254 1.292 0 N-CA-C 113.143 0.794 . . . . 16.940000000000001 113.143 -173.806 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 62' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -99.72 123.79 44.33 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 104.994 -2.224 . . . . 38.509999999999998 104.994 172.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 63' ' ' ILE . . . . . . . . . . . . . 85.7 mt -123.26 130.72 74.14 Favored 'Isoleucine or valine' 0 C--O 1.241 0.633 0 O-C-N 123.291 0.369 . . . . 17.75 110.352 -172.677 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 64' ' ' GLN . . . . . 0.601 ' HG2' HG12 ' B' ' 69' ' ' VAL . 82.0 mt-30 -121.63 135.24 54.99 Favored 'General case' 0 CA--C 1.504 -0.794 0 C-N-CA 120.711 -0.396 . . . . 31.640000000000001 110.35 174.957 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 65' ' ' THR . . . . . . . . . . . . . 44.8 p -133.01 -179.49 5.52 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 107.275 -1.38 . . . . 24.82 107.275 168.653 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 66' ' ' ARG . . . . . . . . . . . . . 1.9 ttp85 -49.93 -27.63 5.57 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 114.486 1.291 . . . . 50.520000000000003 114.486 167.628 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 67' ' ' HIS . . . . . . . . . . . . . 5.3 m-70 -81.27 -17.15 50.38 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 113.552 0.945 . . . . 32.030000000000001 113.552 -176.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 68' ' ' GLY . . . . . . . . . . . . . . . 131.88 -154.27 20.88 Favored Glycine 0 N--CA 1.448 -0.506 0 N-CA-C 111.409 -0.676 . . . . 33.090000000000003 111.409 -176.832 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 69' ' ' VAL . . . . . 0.601 HG12 ' HG2' ' B' ' 64' ' ' GLN . 15.6 m -121.58 143.79 32.87 Favored 'Isoleucine or valine' 0 C--O 1.246 0.906 0 O-C-N 123.967 0.451 . . . . 36.140000000000001 111.947 -170.412 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 70' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -131.3 119.72 44.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 N-CA-C 108.844 -0.798 . . . . 39.390000000000001 108.844 168.025 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -117.51 120.86 39.37 Favored 'General case' 0 C--O 1.244 0.764 0 C-N-CA 122.686 0.394 . . . . 41.170000000000002 110.559 -178.137 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 72' ' ' SER . . . . . 0.68 ' CB ' ' HG3' ' B' ' 60' ' ' LYS . 29.1 m . . . . . 0 N--CA 1.467 0.418 0 N-CA-C 112.87 0.692 . . . . 37.460000000000001 112.87 -179.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 1.3 t . . . . . 0 N--CA 1.497 1.877 0 CA-C-O 120.353 0.12 . . . . 38.020000000000003 111.307 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 8' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -60.45 145.13 49.38 Favored 'General case' 0 C--O 1.247 0.944 0 O-C-N 124.7 1.25 . . . . 39.490000000000002 109.282 176.223 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 9' ' ' PHE . . . . . . . . . . . . . 38.2 p90 -146.13 160.68 41.6 Favored 'General case' 0 C--O 1.236 0.343 0 O-C-N 123.975 0.797 . . . . 27.379999999999999 110.593 -178.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 12.9 m -123.93 143.33 37.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 107.378 -1.341 . . . . 19.98 107.378 -176.407 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 11' ' ' VAL . . . . . . . . . . . . . 63.0 t -110.81 126.11 68.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 107.595 -1.261 . . . . 15.24 107.595 174.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 2.6 mp -123.49 118.36 54.19 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.489 0 O-C-N 124.168 0.918 . . . . 18.530000000000001 109.973 -178.876 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 13' ' ' LYS . . . . . . . . . . . . . 69.6 tttt -111.48 122.73 48.59 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 110.138 -0.319 . . . . 32.740000000000002 110.138 172.376 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.85 131.79 42.71 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 107.447 -1.316 . . . . 18.719999999999999 107.447 -176.365 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 15' ' ' LEU . . . . . 0.789 ' HB2' ' HG2' ' C' ' 60' ' ' LYS . 42.2 mt -101.53 0.66 36.96 Favored 'General case' 0 C--O 1.247 0.963 0 N-CA-C 113.283 0.846 . . . . 24.399999999999999 113.283 175.357 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 18.1 pt-20 -151.84 168.75 24.12 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 124.274 1.03 . . . . 30.620000000000001 108.295 175.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 17' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -71.2 151.61 44.18 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.336 0.588 . . . . 28.989999999999998 111.613 176.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 18' ' ' GLY . . . . . . . . . . . . . . . 78.39 21.4 69.95 Favored Glycine 0 CA--C 1.523 0.56 0 N-CA-C 115.817 1.087 . . . . 20.850000000000001 115.817 170.089 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 19' ' ' VAL . . . . . . . . . . . . . 54.1 t -66.05 146.42 13.24 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.237 0 N-CA-C 107.567 -1.272 . . . . 18.239999999999998 107.567 172.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 20' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -122.71 131.44 53.8 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 108.173 -1.047 . . . . 34.93 108.173 177.15 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 21' ' ' VAL . . . . . . . . . . . . . 98.6 t -111.92 120.42 62.25 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.511 0 N-CA-C 104.225 -2.509 . . . . 13.73 104.225 173.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 22' ' ' ILE . . . . . . . . . . . . . 26.7 mt -115.32 129.55 71.37 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.854 0 O-C-N 124.297 0.998 . . . . 20.079999999999998 111.134 -170.727 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 23' ' ' GLY . . . . . . . . . . . . . . . -95.01 130.36 10.26 Favored Glycine 0 C--N 1.34 0.766 0 N-CA-C 110.402 -1.079 . . . . 12.67 110.402 175.663 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 24' ' ' LEU . . . . . . . . . . . . . 8.1 mp -102.3 141.34 35.29 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 108.004 -1.11 . . . . 17.350000000000001 108.004 177.704 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 44.6 p -69.14 139.54 54.69 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 113.519 0.933 . . . . 12.25 113.519 -172.921 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 26' ' ' ARG . . . . . . . . . . . . . 59.3 ttm-85 -78.01 140.37 39.16 Favored 'General case' 0 C--O 1.255 1.352 0 N-CA-C 107.822 -1.177 . . . . 12.31 107.822 171.584 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 129.42 -168.04 21.14 Favored Glycine 0 C--O 1.254 1.39 0 N-CA-C 111.802 -0.519 . . . . 12.33 111.802 171.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.92 -34.41 77.39 Favored 'General case' 0 C--O 1.246 0.885 0 C-N-CA 119.674 -0.81 . . . . 15.83 111.164 179.999 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 29' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 -96.34 152.85 18.2 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 119.58 -0.848 . . . . 32.840000000000003 111.211 177.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 30' ' ' THR . . . . . . . . . . . . . 85.3 m -132.11 111.69 11.68 Favored 'General case' 0 C--O 1.243 0.721 0 N-CA-C 108.445 -0.946 . . . . 16.690000000000001 108.445 -177.468 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 31' ' ' ARG . . . . . . . . . . . . . 11.1 ptp85 -145.91 167.05 24.21 Favored 'General case' 0 C--O 1.242 0.71 0 N-CA-C 107.601 -1.259 . . . . 26.949999999999999 107.601 170.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 32' ' ' PHE . . . . . . . . . . . . . 18.4 m-30 -74.88 129.54 37.85 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 107.654 -1.239 . . . . 26.09 107.654 177.296 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 33' ' ' HIS . . . . . . . . . . . . . 25.3 p80 -107.73 -13.49 15.01 Favored 'General case' 0 C--O 1.243 0.727 0 O-C-N 121.27 -0.894 . . . . 15.34 112.8 176.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 34' ' ' HIS . . . . . . . . . . . . . 83.0 t60 -165.18 138.86 4.72 Favored 'General case' 0 CA--C 1.499 -1.014 0 N-CA-C 109.867 -0.42 . . . . 18.100000000000001 109.867 -178.655 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 35' ' ' SER . . . . . . . . . . . . . 42.0 t -125.53 121.56 34.03 Favored 'General case' 0 C--O 1.259 1.573 0 N-CA-C 106.489 -1.671 . . . . 18.34 106.489 171.92 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 31.6 tp10 -101.79 124.24 47.09 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 107.081 -1.452 . . . . 18.82 107.081 179.009 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 37' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -87.58 137.93 31.91 Favored 'General case' 0 C--O 1.248 1.004 0 C-N-CA 120.135 -0.626 . . . . 35.899999999999999 111.276 177.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 87.4 mt -125.4 126.51 45.09 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.351 -0.981 . . . . 21.16 108.351 177.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 39' ' ' ASP . . . . . . . . . . . . . 68.5 m-20 -90.84 169.95 10.51 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 120.349 -0.54 . . . . 29.41 110.373 172.826 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 40' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -55.02 128.8 35.31 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 120.521 -0.471 . . . . 35.380000000000003 110.801 -167.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.72 -11.74 70.82 Favored Glycine 0 CA--C 1.531 1.083 0 N-CA-C 115.152 0.821 . . . . 19.870000000000001 115.152 176.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 42' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -78.86 151.18 31.97 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.125 -0.694 . . . . 25.25 109.125 179.843 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 43' ' ' VAL . . . . . . . . . . . . . 73.4 t -127.84 139.52 51.67 Favored 'Isoleucine or valine' 0 C--O 1.24 0.574 0 N-CA-C 107.753 -1.203 . . . . 15.5 107.753 -171.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 44' ' ' LEU . . . . . . . . . . . . . 25.7 tp -123.38 131.12 53.55 Favored 'General case' 0 C--O 1.241 0.609 0 N-CA-C 108.529 -0.915 . . . . 15.720000000000001 108.529 169.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 45' ' ' ILE . . . . . . . . . . . . . 3.5 mp -113.98 115.44 49.67 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.733 0 N-CA-C 104.919 -2.252 . . . . 15.1 104.919 174.152 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 46' ' ' ALA . . . . . . . . . . . . . . . -131.14 129.74 42.2 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 109.159 -0.682 . . . . 14.84 109.159 -165.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 47' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -85.16 159.75 20.07 Favored 'General case' 0 C--O 1.241 0.635 0 N-CA-C 114.011 1.115 . . . . 16.100000000000001 114.011 175.735 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 48' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -81.91 146.55 29.75 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 106.242 -1.762 . . . . 14.4 106.242 158.21 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 49' ' ' THR . . . . . . . . . . . . . 48.4 p -148.19 -178.57 6.37 Favored 'General case' 0 C--O 1.219 -0.52 0 C-N-CA 119.851 -0.74 . . . . 12.91 109.101 -165.067 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 50' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -57.19 -31.12 65.12 Favored 'General case' 0 C--O 1.242 0.704 0 O-C-N 123.701 0.626 . . . . 29.84 111.313 173.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 51' ' ' HIS . . . . . . . . . . . . . 80.8 m80 -101.93 -12.76 17.97 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 115.482 1.66 . . . . 18.809999999999999 115.482 -175.999 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 52' ' ' THR . . . . . . . . . . . . . 45.8 m -130.08 115.82 17.62 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 108.678 -0.86 . . . . 12.130000000000001 108.678 -171.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 87.0 p -119.39 1.01 11.21 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 113.715 1.006 . . . . 11.109999999999999 113.715 179.738 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 54' ' ' ALA . . . . . . . . . . . . . . . -152.9 146.96 25.44 Favored 'General case' 0 CA--C 1.51 -0.57 0 N-CA-C 107.145 -1.428 . . . . 10.800000000000001 107.145 172.07 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 55' ' ' ILE . . . . . . . . . . . . . 76.8 mt -130.1 128.79 65.01 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.887 0 CA-C-N 115.634 -0.712 . . . . 12.99 109.19 -177.019 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 56' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -111.83 135.47 52.4 Favored 'General case' 0 C--O 1.219 -0.543 0 N-CA-C 109.053 -0.721 . . . . 21.620000000000001 109.053 -177.671 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 57' ' ' VAL . . . . . . . . . . . . . 61.1 t -118.89 124.42 73.14 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 N-CA-C 107.722 -1.214 . . . . 14.529999999999999 107.722 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 58' ' ' ARG . . . . . . . . . . . . . 80.4 mtp180 -118.16 125.6 50.54 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.358 -0.837 . . . . 39.07 109.461 177.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.42 160.72 13.4 Favored Glycine 0 CA--C 1.497 -1.075 0 N-CA-C 107.826 -2.11 . . . . 20.210000000000001 107.826 179.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 60' ' ' LYS . . . . . 0.789 ' HG2' ' HB2' ' C' ' 15' ' ' LEU . 48.4 tttp -65.72 117.94 8.87 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 109.403 -0.592 . . . . 37.520000000000003 109.403 -176.054 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 61' ' ' ALA . . . . . . . . . . . . . . . -144.66 150.77 37.93 Favored 'General case' 0 C--O 1.242 0.699 0 CA-C-O 121.018 0.437 . . . . 18.440000000000001 111.142 -174.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 62' ' ' TYR . . . . . 0.418 ' CD1' ' HB2' ' C' ' 71' ' ' GLU . 63.3 t80 -100.01 123.65 44.49 Favored 'General case' 0 C--O 1.218 -0.555 0 N-CA-C 105.214 -2.143 . . . . 35.649999999999999 105.214 168.366 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 63' ' ' ILE . . . . . 0.425 ' HB ' HG23 ' C' ' 70' ' ' ILE . 75.8 mt -124.51 135.02 65.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 O-C-N 123.57 0.544 . . . . 20.010000000000002 110.028 -173.106 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 64' ' ' GLN . . . . . 0.449 ' HG2' HG22 ' C' ' 69' ' ' VAL . 95.5 mt-30 -123.02 135.01 54.29 Favored 'General case' 0 N--CA 1.462 0.142 0 O-C-N 123.642 0.589 . . . . 29.23 110.603 172.909 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 65' ' ' THR . . . . . . . . . . . . . 32.9 p -133.57 -178.0 4.8 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 107.235 -1.394 . . . . 25.579999999999998 107.235 170.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 66' ' ' ARG . . . . . . . . . . . . . 10.2 ttp180 -55.46 -26.8 44.42 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 112.323 0.49 . . . . 48.189999999999998 112.323 172.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 67' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -81.18 -10.67 59.59 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 115.171 1.545 . . . . 32.68 115.171 -178.379 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 68' ' ' GLY . . . . . . . . . . . . . . . 125.65 -155.15 18.88 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.302 -0.951 . . . . 31.609999999999999 112.428 -179.78 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 69' ' ' VAL . . . . . 0.449 HG22 ' HG2' ' C' ' 64' ' ' GLN . 27.6 t -110.32 148.94 13.48 Favored 'Isoleucine or valine' 0 C--O 1.24 0.565 0 CA-C-O 121.487 0.661 . . . . 34.0 111.267 -172.105 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 70' ' ' ILE . . . . . 0.425 HG23 ' HB ' ' C' ' 63' ' ' ILE 0.253 11.6 tt -143.39 112.2 1.95 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.2 0 CA-C-N 115.073 -0.967 . . . . 39.899999999999999 108.971 171.246 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' C' C ' 71' ' ' GLU . . . . . 0.499 ' O ' ' HB2' ' C' ' 72' ' ' SER . 27.7 tt0 -126.84 126.2 42.94 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 114.572 1.323 . . . . 44.280000000000001 114.572 -170.041 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 72' ' ' SER . . . . . 0.499 ' HB2' ' O ' ' C' ' 71' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.476 0.838 0 C-N-CA 123.485 0.714 . . . . 47.07 109.708 162.995 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 100' ' ' TRP . . . . . . . . . . . . . 66.1 t-105 . . . . . 0 N--CA 1.517 2.922 0 CA-C-O 118.409 -0.805 . . . . 14.35 110.586 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1100 ' ' TRP . . . . . 0.622 ' N ' ' HG1' ' A' ' 30' ' ' THR . 70.3 t-105 . . . . . 0 N--CA 1.488 1.442 0 CA-C-O 121.204 0.526 . . . . 13.68 110.091 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 2100 ' ' TRP . . . . . 0.602 ' N ' ' HG1' ' B' ' 30' ' ' THR . 65.9 t-105 . . . . . 0 N--CA 1.513 2.689 0 CA-C-O 120.912 0.387 . . . . 13.49 111.145 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2101 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2102 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2103 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2104 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2105 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2106 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2107 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2108 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2109 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2110 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2111 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2112 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2113 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2114 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2115 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2116 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2117 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2118 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2119 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2120 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2121 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 2122 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 12.1 t . . . . . 0 N--CA 1.492 1.645 0 N-CA-C 112.172 0.434 . . . . 34.29 112.172 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' ASP . . . . . 0.407 ' OD2' ' NH2' ' A' ' 66' ' ' ARG . 2.9 m-20 -56.59 148.43 19.81 Favored 'General case' 0 C--O 1.247 0.928 0 C-N-CA 125.157 1.383 . . . . 38.03 110.354 179.253 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' PHE . . . . . . . . . . . . . 48.8 p90 -149.91 164.15 36.19 Favored 'General case' 0 C--O 1.253 1.267 0 O-C-N 124.241 0.963 . . . . 25.62 111.199 -177.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 48.4 t -125.54 143.93 37.37 Favored 'Isoleucine or valine' 0 C--O 1.245 0.859 0 N-CA-C 106.117 -1.808 . . . . 18.38 106.117 -176.992 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' VAL . . . . . . . . . . . . . 60.2 t -110.38 124.61 67.29 Favored 'Isoleucine or valine' 0 C--O 1.249 1.051 0 N-CA-C 106.191 -1.781 . . . . 13.76 106.191 173.235 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ILE . . . . . . . . . . . . . 2.6 mp -121.51 121.02 63.5 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.331 0 O-C-N 123.934 0.772 . . . . 14.9 110.756 177.389 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 76.5 tttt -111.13 122.09 46.99 Favored 'General case' 0 N--CA 1.472 0.64 0 N-CA-C 109.485 -0.561 . . . . 32.3 109.485 173.518 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -74.87 135.82 41.53 Favored 'General case' 0 N--CA 1.464 0.243 0 N-CA-C 108.26 -1.015 . . . . 14.49 108.26 -175.451 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 56.6 mt -108.27 2.12 22.47 Favored 'General case' 0 C--O 1.263 1.797 0 O-C-N 123.802 0.689 . . . . 20.27 111.613 176.5 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -147.27 168.71 21.06 Favored 'General case' 0 N--CA 1.473 0.702 0 N-CA-C 107.083 -1.451 . . . . 28.53 107.083 173.509 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -74.26 150.3 40.31 Favored 'General case' 0 CA--C 1.505 -0.781 0 C-N-CA 119.121 -1.032 . . . . 16.7 110.649 174.367 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 82.85 19.66 62.9 Favored Glycine 0 N--CA 1.444 -0.804 0 C-N-CA 118.589 -1.767 . . . . 14.77 114.184 168.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 59.2 t -65.95 135.93 27.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 N-CA-C 107.89 -1.152 . . . . 14.68 107.89 173.368 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 5.2 m120 -114.91 124.23 51.17 Favored 'General case' 0 C--O 1.24 0.586 0 N-CA-C 105.998 -1.853 . . . . 24.09 105.998 -176.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' VAL . . . . . . . . . . . . . 88.0 t -105.31 115.04 46.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.585 0 N-CA-C 104.835 -2.283 . . . . 12.45 104.835 175.745 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 44.4 mt -111.82 122.18 65.68 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.703 0 N-CA-C 108.666 -0.864 . . . . 17.45 108.666 -163.127 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . -98.29 128.92 9.72 Favored Glycine 0 C--O 1.245 0.796 0 N-CA-C 109.367 -1.493 . . . . 13.32 109.367 179.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' LEU . . . . . . . . . . . . . 63.0 mt -102.21 140.39 36.56 Favored 'General case' 0 C--O 1.25 1.099 0 CA-C-O 120.938 0.399 . . . . 17.0 110.25 -179.3 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' THR . . . . . . . . . . . . . 38.7 p -64.37 133.6 52.92 Favored 'General case' 0 C--O 1.232 0.159 0 N-CA-C 114.245 1.202 . . . . 13.41 114.245 -174.154 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 59.6 ttm-85 -72.3 136.02 46.12 Favored 'General case' 0 CA--C 1.545 0.763 0 N-CA-C 108.141 -1.059 . . . . 14.54 108.141 167.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . 140.06 -170.33 24.36 Favored Glycine 0 CA--C 1.524 0.62 0 N-CA-C 110.632 -0.987 . . . . 15.62 110.632 172.924 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ALA . . . . . . . . . . . . . . . -63.32 -30.65 71.75 Favored 'General case' 0 N--CA 1.472 0.656 0 C-N-CA 120.232 -0.587 . . . . 17.26 111.75 177.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 67.0 m-20 -101.18 147.17 26.56 Favored 'General case' 0 C--O 1.215 -0.713 0 CA-C-O 118.954 -0.546 . . . . 34.26 110.214 -176.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' THR . . . . . 0.622 ' HG1' ' N ' ' B' 1100 ' ' TRP . 66.4 m -122.91 108.83 13.41 Favored 'General case' 0 C--O 1.251 1.163 0 O-C-N 124.436 1.085 . . . . 15.47 111.499 178.097 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' ARG . . . . . . . . . . . . . 41.7 ptt85 -140.74 162.47 35.34 Favored 'General case' 0 C--N 1.329 -0.321 0 N-CA-C 106.524 -1.658 . . . . 41.67 106.524 172.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -80.81 137.94 36.23 Favored 'General case' 0 N--CA 1.444 -0.772 0 C-N-CA 116.995 -1.882 . . . . 26.63 109.898 172.242 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' HIS . . . . . . . . . . . . . 33.2 p80 -109.34 -16.38 14.04 Favored 'General case' 0 C--O 1.22 -0.482 0 CA-C-N 115.981 -0.554 . . . . 15.85 109.802 178.848 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' HIS . . . . . . . . . . . . . 77.0 t60 -158.06 139.8 13.85 Favored 'General case' 0 CA--C 1.516 -0.332 0 C-N-CA 119.978 -0.689 . . . . 15.26 109.792 -178.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' SER . . . . . . . . . . . . . 47.9 t -126.67 120.18 28.84 Favored 'General case' 0 C--O 1.248 1.023 0 N-CA-C 107.909 -1.145 . . . . 19.34 107.909 168.599 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' GLU . . . . . . . . . . . . . 37.9 tp10 -98.81 120.58 39.48 Favored 'General case' 0 C--O 1.249 1.045 0 N-CA-C 106.939 -1.504 . . . . 17.64 106.939 -179.112 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LYS . . . . . . . . . . . . . 2.7 ttmt -86.05 137.33 32.77 Favored 'General case' 0 C--O 1.245 0.867 0 C-N-CA 119.636 -0.825 . . . . 21.72 111.786 179.38 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 86.5 mt -120.37 131.69 54.94 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 109.845 -0.428 . . . . 17.02 109.845 175.687 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -87.91 164.92 15.61 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 119.091 -1.043 . . . . 21.78 109.888 170.137 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? -53.2 131.76 37.54 Favored 'General case' 0 N--CA 1.444 -0.758 0 N-CA-C 112.504 0.557 . . . . 22.35 112.504 -172.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLY . . . . . . . . . . . . . . . 88.42 -15.66 55.86 Favored Glycine 0 CA--C 1.529 0.968 0 N-CA-C 115.907 1.123 . . . . 14.34 115.907 -178.349 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLU . . . . . . . . . . . . . 75.3 mt-10 -77.24 153.82 33.63 Favored 'General case' 0 C--O 1.246 0.871 0 CA-C-N 117.695 0.747 . . . . 20.88 109.447 179.604 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 95.8 t -125.43 135.27 64.51 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.266 0 O-C-N 123.961 0.788 . . . . 12.79 109.263 -175.173 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 26.1 tp -118.98 135.77 54.44 Favored 'General case' 0 C--O 1.257 1.47 0 N-CA-C 106.614 -1.624 . . . . 15.08 106.614 169.16 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ILE . . . . . . . . . . . . . 3.3 mp -117.18 114.22 45.09 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.678 0 N-CA-C 103.786 -2.672 . . . . 12.76 103.786 172.887 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -129.02 131.92 47.43 Favored 'General case' 0 C--O 1.219 -0.524 0 N-CA-C 109.501 -0.555 . . . . 12.0 109.501 -167.347 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -87.8 161.34 17.61 Favored 'General case' 0 N--CA 1.45 -0.434 0 CA-C-O 121.425 0.631 . . . . 13.72 112.488 177.951 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -83.03 148.87 27.29 Favored 'General case' 0 C--O 1.241 0.609 0 N-CA-C 105.255 -2.128 . . . . 15.27 105.255 160.157 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' THR . . . . . . . . . . . . . 62.7 p -149.39 -176.86 5.55 Favored 'General case' 0 C--O 1.215 -0.721 0 C-N-CA 120.998 -0.281 . . . . 11.99 110.463 -165.644 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 77.1 tt0 -58.53 -30.32 67.0 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 116.149 -0.478 . . . . 29.22 111.26 175.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' HIS . . . . . . . . . . . . . 80.8 m80 -102.42 -15.47 16.5 Favored 'General case' 0 C--O 1.22 -0.45 0 N-CA-C 114.943 1.46 . . . . 17.76 114.943 -174.45 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 58.8 m -128.81 113.87 15.83 Favored 'General case' 0 N--CA 1.468 0.459 0 N-CA-C 109.369 -0.604 . . . . 11.85 109.369 -172.197 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 85.9 p -116.46 0.16 12.66 Favored 'General case' 0 C--O 1.212 -0.92 0 N-CA-C 114.371 1.249 . . . . 11.06 114.371 -179.541 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -152.95 143.47 22.65 Favored 'General case' 0 CA--C 1.509 -0.598 0 N-CA-C 106.789 -1.56 . . . . 11.35 106.789 174.325 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ILE . . . . . . . . . . . . . 77.8 mt -127.74 131.93 69.44 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.503 0 N-CA-C 108.575 -0.898 . . . . 11.97 108.575 179.154 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' LYS . . . . . 0.539 ' HE3' HD23 ' B' ' 38' ' ' LEU . 57.7 tttt -113.69 135.76 53.58 Favored 'General case' 0 N--CA 1.472 0.665 0 N-CA-C 108.717 -0.846 . . . . 23.52 108.717 177.73 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 60.4 t -117.41 123.03 71.24 Favored 'Isoleucine or valine' 0 C--O 1.248 0.991 0 N-CA-C 105.865 -1.902 . . . . 15.32 105.865 179.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 1.5 ttm180 -117.26 118.85 33.42 Favored 'General case' 0 CA--C 1.517 -0.314 0 O-C-N 124.214 0.946 . . . . 43.17 109.228 179.288 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLY . . . . . . . . . . . . . . . 119.05 154.08 9.51 Favored Glycine 0 C--O 1.253 1.302 0 N-CA-C 108.76 -1.736 . . . . 19.86 108.76 -175.381 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 9.9 tttt -65.7 126.01 27.07 Favored 'General case' 0 N--CA 1.472 0.671 0 CA-C-N 117.197 0.499 . . . . 42.45 112.187 -176.58 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -153.01 147.65 26.16 Favored 'General case' 0 CA--C 1.512 -0.492 0 N-CA-C 109.086 -0.709 . . . . 16.63 109.086 -168.547 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' TYR . . . . . . . . . . . . . 57.2 t80 -97.6 123.88 41.66 Favored 'General case' 0 C--N 1.315 -0.907 0 N-CA-C 105.835 -1.913 . . . . 33.85 105.835 166.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' ILE . . . . . . . . . . . . . 97.3 mt -122.21 131.89 72.2 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 O-C-N 123.556 0.535 . . . . 16.97 110.443 -171.899 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 87.8 mt-30 -118.87 136.73 53.88 Favored 'General case' 0 C--O 1.247 0.931 0 N-CA-C 108.771 -0.826 . . . . 27.06 108.771 173.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' THR . . . . . . . . . . . . . 22.5 p -131.74 179.7 5.9 Favored 'General case' 0 CA--C 1.548 0.875 0 N-CA-C 107.578 -1.267 . . . . 25.95 107.578 168.639 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' ARG . . . . . 0.407 ' NH2' ' OD2' ' A' ' 8' ' ' ASP . 10.4 ttm180 -46.96 -29.52 2.1 Favored 'General case' 0 N--CA 1.486 1.356 0 N-CA-C 116.011 1.856 . . . . 51.83 116.011 168.405 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' HIS . . . . . . . . . . . . . 6.0 m-70 -84.75 -13.26 51.8 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 114.222 1.193 . . . . 40.45 114.222 -177.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' GLY . . . . . . . . . . . . . . . 130.61 -158.77 22.66 Favored Glycine 0 CA--C 1.529 0.915 0 O-C-N 122.824 0.077 . . . . 39.31 113.064 -174.977 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 2.9 p . . . . . 0 N--CA 1.469 0.482 0 C-N-CA 123.143 0.577 . . . . 41.68 112.378 -179.836 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 7' ' ' SER . . . . . . . . . . . . . 10.4 t . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.196 0.046 . . . . 38.15 111.054 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 8' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -65.16 147.53 53.29 Favored 'General case' 0 C--O 1.242 0.677 0 O-C-N 124.129 0.893 . . . . 39.63 111.023 179.505 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 9' ' ' PHE . . . . . . . . . . . . . 47.9 p90 -151.03 160.6 43.81 Favored 'General case' 0 C--O 1.237 0.402 0 O-C-N 123.557 0.536 . . . . 25.31 110.801 -176.543 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 10' ' ' VAL . . . . . . . . . . . . . 94.2 t -123.14 141.33 43.87 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.711 0 N-CA-C 106.411 -1.7 . . . . 17.41 106.411 -174.293 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 11' ' ' VAL . . . . . . . . . . . . . 99.1 t -109.71 128.09 66.04 Favored 'Isoleucine or valine' 0 C--O 1.245 0.821 0 N-CA-C 107.208 -1.405 . . . . 14.5 107.208 173.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 12' ' ' ILE . . . . . . . . . . . . . 3.0 mp -125.29 119.76 56.32 Favored 'Isoleucine or valine' 0 CA--C 1.505 -0.77 0 N-CA-C 108.941 -0.763 . . . . 19.27 108.941 179.485 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 13' ' ' LYS . . . . . . . . . . . . . 28.1 tttt -112.5 125.95 54.79 Favored 'General case' 0 C--O 1.246 0.887 0 N-CA-C 109.469 -0.567 . . . . 33.71 109.469 171.864 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 14' ' ' ALA . . . . . . . . . . . . . . . -74.51 133.06 42.34 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 107.884 -1.154 . . . . 16.37 107.884 -176.45 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 15' ' ' LEU . . . . . 0.634 ' HB2' ' HG2' ' B' ' 60' ' ' LYS . 81.6 mt -102.6 0.86 33.98 Favored 'General case' 0 C--O 1.252 1.22 0 O-C-N 123.715 0.634 . . . . 19.97 111.107 177.265 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 16' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -155.82 169.44 24.38 Favored 'General case' 0 CA--C 1.508 -0.67 0 N-CA-C 106.377 -1.712 . . . . 28.83 106.377 176.99 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 17' ' ' ASP . . . . . . . . . . . . . 99.1 m-20 -73.55 152.88 40.47 Favored 'General case' 0 N--CA 1.452 -0.366 0 C-N-CA 120.777 -0.369 . . . . 28.05 111.006 175.049 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 18' ' ' GLY . . . . . . . . . . . . . . . 87.49 11.42 68.87 Favored Glycine 0 CA--C 1.524 0.616 0 N-CA-C 116.572 1.389 . . . . 21.17 116.572 173.188 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 19' ' ' VAL . . . . . . . . . . . . . 51.5 t -66.86 137.92 23.91 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.692 0 N-CA-C 107.642 -1.244 . . . . 18.86 107.642 178.915 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 20' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -120.15 132.69 55.49 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 119.84 -0.744 . . . . 34.47 109.852 176.199 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 21' ' ' VAL . . . . . . . . . . . . . 98.4 t -113.3 122.72 67.98 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.742 0 N-CA-C 105.764 -1.939 . . . . 15.81 105.764 173.961 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 22' ' ' ILE . . . . . . . . . . . . . 20.0 mt -119.44 130.6 73.81 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.584 0 N-CA-C 108.747 -0.834 . . . . 21.29 108.747 -168.255 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 23' ' ' GLY . . . . . . . . . . . . . . . -93.96 134.75 12.21 Favored Glycine 0 C--O 1.245 0.822 0 N-CA-C 110.18 -1.168 . . . . 14.18 110.18 175.611 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 24' ' ' LEU . . . . . . . . . . . . . 10.1 mp -107.73 135.81 48.53 Favored 'General case' 0 C--N 1.342 0.249 0 N-CA-C 107.254 -1.388 . . . . 17.51 107.254 179.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 25' ' ' THR . . . . . . . . . . . . . 46.7 p -65.91 137.63 57.3 Favored 'General case' 0 C--O 1.244 0.774 0 N-CA-C 114.367 1.247 . . . . 14.05 114.367 -173.896 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 56.8 ttm-85 -75.06 137.54 41.53 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-N 115.18 -0.918 . . . . 14.82 108.845 171.825 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . 134.19 -168.33 23.42 Favored Glycine 0 C--O 1.254 1.359 0 C-N-CA 120.321 -0.942 . . . . 15.62 113.13 176.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 28' ' ' ALA . . . . . . . . . . . . . . . -65.64 -34.96 79.44 Favored 'General case' 0 C--O 1.243 0.712 0 CA-C-O 122.327 1.061 . . . . 18.88 110.499 -179.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 29' ' ' ASP . . . . . . . . . . . . . 81.0 m-20 -98.24 151.41 20.49 Favored 'General case' 0 N--CA 1.447 -0.575 0 CA-C-N 115.207 -0.906 . . . . 35.78 111.466 179.256 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 30' ' ' THR . . . . . 0.602 ' HG1' ' N ' ' B' 2100 ' ' TRP . 59.4 m -125.11 109.17 12.57 Favored 'General case' 0 C--N 1.314 -0.945 0 CA-C-N 115.059 -0.973 . . . . 18.54 110.305 179.282 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 31' ' ' ARG . . . . . . . . . . . . . 13.0 ptt85 -137.47 160.93 37.74 Favored 'General case' 0 C--O 1.219 -0.51 0 N-CA-C 109.392 -0.596 . . . . 41.84 109.392 172.4 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 32' ' ' PHE . . . . . . . . . . . . . 15.1 m-30 -72.31 127.69 33.33 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 105.562 -2.014 . . . . 30.19 105.562 174.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 33' ' ' HIS . . . . . . . . . . . . . 25.1 p80 -108.59 -17.46 13.96 Favored 'General case' 0 CA--C 1.538 0.502 0 N-CA-C 113.335 0.865 . . . . 16.0 113.335 176.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 34' ' ' HIS . . . . . . . . . . . . . 86.2 t60 -161.44 141.55 10.65 Favored 'General case' 0 CA--C 1.503 -0.848 0 N-CA-C 109.608 -0.516 . . . . 17.36 109.608 179.151 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 35' ' ' SER . . . . . . . . . . . . . 45.6 t -125.48 122.77 37.6 Favored 'General case' 0 C--O 1.248 1.019 0 N-CA-C 108.405 -0.961 . . . . 21.73 108.405 169.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 36' ' ' GLU . . . . . . . . . . . . . 39.9 tp10 -103.27 126.94 50.69 Favored 'General case' 0 CA--C 1.51 -0.566 0 N-CA-C 106.252 -1.759 . . . . 26.43 106.252 177.837 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 37' ' ' LYS . . . . . . . . . . . . . 23.4 tttp -90.18 142.07 28.08 Favored 'General case' 0 N--CA 1.464 0.239 0 CA-C-N 116.384 -0.371 . . . . 39.2 111.318 177.082 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 38' ' ' LEU . . . . . 0.539 HD23 ' HE3' ' A' ' 56' ' ' LYS . 76.5 mt -127.05 129.78 48.68 Favored 'General case' 0 CA--C 1.508 -0.668 0 N-CA-C 106.874 -1.528 . . . . 20.92 106.874 178.321 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 39' ' ' ASP . . . . . . . . . . . . . 61.8 m-20 -88.24 167.48 13.54 Favored 'General case' 0 CA--C 1.502 -0.867 0 C-N-CA 118.78 -1.168 . . . . 33.62 109.3 169.755 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 40' ' ' LYS . . . . . . . . . . . . . 78.4 tttt -48.62 125.44 9.95 Favored 'General case' 0 C--O 1.238 0.484 0 N-CA-C 112.795 0.665 . . . . 24.57 112.795 -175.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 41' ' ' GLY . . . . . . . . . . . . . . . 89.35 -8.66 79.36 Favored Glycine 0 CA--C 1.531 1.037 0 CA-C-O 119.334 -0.703 . . . . 18.88 114.449 174.663 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 42' ' ' GLU . . . . . . . . . . . . . 93.8 mt-10 -74.29 151.21 39.88 Favored 'General case' 0 N--CA 1.468 0.432 0 CA-C-N 118.004 0.902 . . . . 33.28 110.416 174.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 43' ' ' VAL . . . . . . . . . . . . . 82.9 t -126.03 133.54 68.68 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.488 0 N-CA-C 108.294 -1.002 . . . . 15.16 108.294 -173.357 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 44' ' ' LEU . . . . . . . . . . . . . 46.9 tp -117.53 128.42 54.95 Favored 'General case' 0 N--CA 1.465 0.314 0 N-CA-C 108.878 -0.786 . . . . 15.19 108.878 172.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 45' ' ' ILE . . . . . . . . . . . . . 3.3 mp -112.02 110.79 33.48 Favored 'Isoleucine or valine' 0 C--O 1.245 0.818 0 N-CA-C 105.092 -2.188 . . . . 14.43 105.092 173.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 46' ' ' ALA . . . . . . . . . . . . . . . -122.92 130.13 52.46 Favored 'General case' 0 N--CA 1.465 0.283 0 N-CA-C 113.489 0.922 . . . . 14.53 113.489 -171.185 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 47' ' ' GLN . . . . . . . . . . . . . 88.1 mt-30 -86.29 159.44 19.43 Favored 'General case' 0 N--CA 1.444 -0.728 0 N-CA-C 112.977 0.732 . . . . 14.99 112.977 176.24 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 48' ' ' PHE . . . . . . . . . . . . . 60.1 m-85 -82.25 144.69 30.47 Favored 'General case' 0 C--O 1.239 0.521 0 N-CA-C 105.203 -2.147 . . . . 14.98 105.203 160.074 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 49' ' ' THR . . . . . . . . . . . . . 57.8 p -146.35 -179.38 6.71 Favored 'General case' 0 C--O 1.222 -0.389 0 O-C-N 123.575 0.547 . . . . 13.1 110.065 -166.322 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 50' ' ' GLU . . . . . . . . . . . . . 64.2 tt0 -54.46 -32.06 56.85 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 116.215 -0.448 . . . . 29.59 112.067 173.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 51' ' ' HIS . . . . . . . . . . . . . 80.4 m80 -103.6 -13.91 16.36 Favored 'General case' 0 CA--C 1.538 0.498 0 N-CA-C 113.892 1.071 . . . . 17.82 113.892 -174.466 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 52' ' ' THR . . . . . . . . . . . . . 44.9 m -126.83 115.93 20.1 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 108.275 -1.009 . . . . 11.87 108.275 -173.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 53' ' ' SER . . . . . . . . . . . . . 78.3 p -116.97 -1.39 11.96 Favored 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 114.063 1.134 . . . . 12.13 114.063 178.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 54' ' ' ALA . . . . . . . . . . . . . . . -151.98 148.88 28.26 Favored 'General case' 0 C--N 1.318 -0.768 0 N-CA-C 108.981 -0.748 . . . . 11.44 108.981 173.1 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 55' ' ' ILE . . . . . . . . . . . . . 94.7 mt -133.52 131.54 57.35 Favored 'Isoleucine or valine' 0 C--O 1.247 0.951 0 N-CA-C 107.264 -1.384 . . . . 12.8 107.264 -176.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 56' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -114.91 136.16 53.41 Favored 'General case' 0 CA--C 1.501 -0.932 0 N-CA-C 107.377 -1.342 . . . . 21.18 107.377 -178.746 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 57' ' ' VAL . . . . . . . . . . . . . 51.7 t -122.31 125.33 72.68 Favored 'Isoleucine or valine' 0 C--O 1.256 1.412 0 N-CA-C 106.992 -1.485 . . . . 15.64 106.992 -179.645 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 71.1 mtp180 -118.43 127.27 53.5 Favored 'General case' 0 CA--C 1.508 -0.671 0 CA-C-N 115.537 -0.756 . . . . 40.2 109.073 178.108 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.55 167.58 15.79 Favored Glycine 0 N--CA 1.445 -0.731 0 N-CA-C 109.891 -1.283 . . . . 20.13 109.891 -179.922 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 60' ' ' LYS . . . . . 0.68 ' HG3' ' CB ' ' B' ' 72' ' ' SER . 25.8 tttm -75.32 121.78 22.74 Favored 'General case' 0 C--O 1.218 -0.603 0 N-CA-C 108.165 -1.05 . . . . 37.33 108.165 -173.712 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 61' ' ' ALA . . . . . . . . . . . . . . . -149.87 151.8 34.05 Favored 'General case' 0 C--O 1.254 1.292 0 N-CA-C 113.143 0.794 . . . . 16.94 113.143 -173.806 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 62' ' ' TYR . . . . . . . . . . . . . 64.8 t80 -99.72 123.79 44.33 Favored 'General case' 0 N--CA 1.453 -0.279 0 N-CA-C 104.994 -2.224 . . . . 38.51 104.994 172.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 63' ' ' ILE . . . . . . . . . . . . . 85.7 mt -123.26 130.72 74.14 Favored 'Isoleucine or valine' 0 C--O 1.241 0.633 0 O-C-N 123.291 0.369 . . . . 17.75 110.352 -172.677 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 64' ' ' GLN . . . . . 0.601 ' HG2' HG12 ' B' ' 69' ' ' VAL . 82.0 mt-30 -121.63 135.24 54.99 Favored 'General case' 0 CA--C 1.504 -0.794 0 C-N-CA 120.711 -0.396 . . . . 31.64 110.35 174.957 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 65' ' ' THR . . . . . . . . . . . . . 44.8 p -133.01 -179.49 5.52 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 107.275 -1.38 . . . . 24.82 107.275 168.653 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 66' ' ' ARG . . . . . . . . . . . . . 1.9 ttp85 -49.93 -27.63 5.57 Favored 'General case' 0 N--CA 1.481 1.087 0 N-CA-C 114.486 1.291 . . . . 50.52 114.486 167.628 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 67' ' ' HIS . . . . . . . . . . . . . 5.3 m-70 -81.27 -17.15 50.38 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 113.552 0.945 . . . . 32.03 113.552 -176.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 68' ' ' GLY . . . . . . . . . . . . . . . 131.88 -154.27 20.88 Favored Glycine 0 N--CA 1.448 -0.506 0 N-CA-C 111.409 -0.676 . . . . 33.09 111.409 -176.832 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 69' ' ' VAL . . . . . 0.601 HG12 ' HG2' ' B' ' 64' ' ' GLN . 15.6 m -121.58 143.79 32.87 Favored 'Isoleucine or valine' 0 C--O 1.246 0.906 0 O-C-N 123.967 0.451 . . . . 36.14 111.947 -170.412 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 70' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -131.3 119.72 44.4 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 N-CA-C 108.844 -0.798 . . . . 39.39 108.844 168.025 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 71' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -117.51 120.86 39.37 Favored 'General case' 0 C--O 1.244 0.764 0 C-N-CA 122.686 0.394 . . . . 41.17 110.559 -178.137 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 72' ' ' SER . . . . . 0.68 ' CB ' ' HG3' ' B' ' 60' ' ' LYS . 29.1 m . . . . . 0 N--CA 1.467 0.418 0 N-CA-C 112.87 0.692 . . . . 37.46 112.87 -179.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 7' ' ' SER . . . . . . . . . . . . . 1.3 t . . . . . 0 N--CA 1.497 1.877 0 CA-C-O 120.353 0.12 . . . . 38.02 111.307 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 8' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -60.45 145.13 49.38 Favored 'General case' 0 C--O 1.247 0.944 0 O-C-N 124.7 1.25 . . . . 39.49 109.282 176.223 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 9' ' ' PHE . . . . . . . . . . . . . 38.2 p90 -146.13 160.68 41.6 Favored 'General case' 0 C--O 1.236 0.343 0 O-C-N 123.975 0.797 . . . . 27.38 110.593 -178.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 10' ' ' VAL . . . . . . . . . . . . . 12.9 m -123.93 143.33 37.54 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.365 0 N-CA-C 107.378 -1.341 . . . . 19.98 107.378 -176.407 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 11' ' ' VAL . . . . . . . . . . . . . 63.0 t -110.81 126.11 68.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 N-CA-C 107.595 -1.261 . . . . 15.24 107.595 174.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 12' ' ' ILE . . . . . . . . . . . . . 2.6 mp -123.49 118.36 54.19 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.489 0 O-C-N 124.168 0.918 . . . . 18.53 109.973 -178.876 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 13' ' ' LYS . . . . . . . . . . . . . 69.6 tttt -111.48 122.73 48.59 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 110.138 -0.319 . . . . 32.74 110.138 172.376 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 14' ' ' ALA . . . . . . . . . . . . . . . -72.85 131.79 42.71 Favored 'General case' 0 N--CA 1.451 -0.387 0 N-CA-C 107.447 -1.316 . . . . 18.72 107.447 -176.365 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 15' ' ' LEU . . . . . 0.789 ' HB2' ' HG2' ' C' ' 60' ' ' LYS . 42.2 mt -101.53 0.66 36.96 Favored 'General case' 0 C--O 1.247 0.963 0 N-CA-C 113.283 0.846 . . . . 24.4 113.283 175.357 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 16' ' ' GLU . . . . . . . . . . . . . 18.1 pt-20 -151.84 168.75 24.12 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 124.274 1.03 . . . . 30.62 108.295 175.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 17' ' ' ASP . . . . . . . . . . . . . 91.4 m-20 -71.2 151.61 44.18 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.336 0.588 . . . . 28.99 111.613 176.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 18' ' ' GLY . . . . . . . . . . . . . . . 78.39 21.4 69.95 Favored Glycine 0 CA--C 1.523 0.56 0 N-CA-C 115.817 1.087 . . . . 20.85 115.817 170.089 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 19' ' ' VAL . . . . . . . . . . . . . 54.1 t -66.05 146.42 13.24 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.237 0 N-CA-C 107.567 -1.272 . . . . 18.24 107.567 172.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 20' ' ' ASN . . . . . . . . . . . . . 18.1 m120 -122.71 131.44 53.8 Favored 'General case' 0 N--CA 1.471 0.621 0 N-CA-C 108.173 -1.047 . . . . 34.93 108.173 177.15 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 21' ' ' VAL . . . . . . . . . . . . . 98.6 t -111.92 120.42 62.25 Favored 'Isoleucine or valine' 0 C--O 1.219 -0.511 0 N-CA-C 104.225 -2.509 . . . . 13.73 104.225 173.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 22' ' ' ILE . . . . . . . . . . . . . 26.7 mt -115.32 129.55 71.37 Favored 'Isoleucine or valine' 0 C--O 1.213 -0.854 0 O-C-N 124.297 0.998 . . . . 20.08 111.134 -170.727 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 23' ' ' GLY . . . . . . . . . . . . . . . -95.01 130.36 10.26 Favored Glycine 0 C--N 1.34 0.766 0 N-CA-C 110.402 -1.079 . . . . 12.67 110.402 175.663 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 24' ' ' LEU . . . . . . . . . . . . . 8.1 mp -102.3 141.34 35.29 Favored 'General case' 0 N--CA 1.473 0.715 0 N-CA-C 108.004 -1.11 . . . . 17.35 108.004 177.704 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 25' ' ' THR . . . . . . . . . . . . . 44.6 p -69.14 139.54 54.69 Favored 'General case' 0 CA--C 1.515 -0.38 0 N-CA-C 113.519 0.933 . . . . 12.25 113.519 -172.921 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 26' ' ' ARG . . . . . . . . . . . . . 59.3 ttm-85 -78.01 140.37 39.16 Favored 'General case' 0 C--O 1.255 1.352 0 N-CA-C 107.822 -1.177 . . . . 12.31 107.822 171.584 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 27' ' ' GLY . . . . . . . . . . . . . . . 129.42 -168.04 21.14 Favored Glycine 0 C--O 1.254 1.39 0 N-CA-C 111.802 -0.519 . . . . 12.33 111.802 171.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 28' ' ' ALA . . . . . . . . . . . . . . . -62.92 -34.41 77.39 Favored 'General case' 0 C--O 1.246 0.885 0 C-N-CA 119.674 -0.81 . . . . 15.83 111.164 179.999 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 29' ' ' ASP . . . . . . . . . . . . . 43.1 m-20 -96.34 152.85 18.2 Favored 'General case' 0 N--CA 1.466 0.374 0 C-N-CA 119.58 -0.848 . . . . 32.84 111.211 177.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 30' ' ' THR . . . . . . . . . . . . . 85.3 m -132.11 111.69 11.68 Favored 'General case' 0 C--O 1.243 0.721 0 N-CA-C 108.445 -0.946 . . . . 16.69 108.445 -177.468 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 31' ' ' ARG . . . . . . . . . . . . . 11.1 ptp85 -145.91 167.05 24.21 Favored 'General case' 0 C--O 1.242 0.71 0 N-CA-C 107.601 -1.259 . . . . 26.95 107.601 170.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 32' ' ' PHE . . . . . . . . . . . . . 18.4 m-30 -74.88 129.54 37.85 Favored 'General case' 0 CA--C 1.54 0.584 0 N-CA-C 107.654 -1.239 . . . . 26.09 107.654 177.296 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 33' ' ' HIS . . . . . . . . . . . . . 25.3 p80 -107.73 -13.49 15.01 Favored 'General case' 0 C--O 1.243 0.727 0 O-C-N 121.27 -0.894 . . . . 15.34 112.8 176.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 34' ' ' HIS . . . . . . . . . . . . . 83.0 t60 -165.18 138.86 4.72 Favored 'General case' 0 CA--C 1.499 -1.014 0 N-CA-C 109.867 -0.42 . . . . 18.1 109.867 -178.655 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 35' ' ' SER . . . . . . . . . . . . . 42.0 t -125.53 121.56 34.03 Favored 'General case' 0 C--O 1.259 1.573 0 N-CA-C 106.489 -1.671 . . . . 18.34 106.489 171.92 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 36' ' ' GLU . . . . . . . . . . . . . 31.6 tp10 -101.79 124.24 47.09 Favored 'General case' 0 C--N 1.322 -0.618 0 N-CA-C 107.081 -1.452 . . . . 18.82 107.081 179.009 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 37' ' ' LYS . . . . . . . . . . . . . 75.5 tttt -87.58 137.93 31.91 Favored 'General case' 0 C--O 1.248 1.004 0 C-N-CA 120.135 -0.626 . . . . 35.9 111.276 177.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 38' ' ' LEU . . . . . . . . . . . . . 87.4 mt -125.4 126.51 45.09 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.351 -0.981 . . . . 21.16 108.351 177.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 39' ' ' ASP . . . . . . . . . . . . . 68.5 m-20 -90.84 169.95 10.51 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 120.349 -0.54 . . . . 29.41 110.373 172.826 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 40' ' ' LYS . . . . . . . . . . . . . 72.6 tttt -55.02 128.8 35.31 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 120.521 -0.471 . . . . 35.38 110.801 -167.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 41' ' ' GLY . . . . . . . . . . . . . . . 90.72 -11.74 70.82 Favored Glycine 0 CA--C 1.531 1.083 0 N-CA-C 115.152 0.821 . . . . 19.87 115.152 176.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 42' ' ' GLU . . . . . . . . . . . . . 96.5 mt-10 -78.86 151.18 31.97 Favored 'General case' 0 C--N 1.329 -0.285 0 N-CA-C 109.125 -0.694 . . . . 25.25 109.125 179.843 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 43' ' ' VAL . . . . . . . . . . . . . 73.4 t -127.84 139.52 51.67 Favored 'Isoleucine or valine' 0 C--O 1.24 0.574 0 N-CA-C 107.753 -1.203 . . . . 15.5 107.753 -171.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 44' ' ' LEU . . . . . . . . . . . . . 25.7 tp -123.38 131.12 53.55 Favored 'General case' 0 C--O 1.241 0.609 0 N-CA-C 108.529 -0.915 . . . . 15.72 108.529 169.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 45' ' ' ILE . . . . . . . . . . . . . 3.5 mp -113.98 115.44 49.67 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.733 0 N-CA-C 104.919 -2.252 . . . . 15.1 104.919 174.152 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 46' ' ' ALA . . . . . . . . . . . . . . . -131.14 129.74 42.2 Favored 'General case' 0 CA--C 1.511 -0.554 0 N-CA-C 109.159 -0.682 . . . . 14.84 109.159 -165.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 47' ' ' GLN . . . . . . . . . . . . . 87.9 mt-30 -85.16 159.75 20.07 Favored 'General case' 0 C--O 1.241 0.635 0 N-CA-C 114.011 1.115 . . . . 16.1 114.011 175.735 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 48' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -81.91 146.55 29.75 Favored 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 106.242 -1.762 . . . . 14.4 106.242 158.21 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 49' ' ' THR . . . . . . . . . . . . . 48.4 p -148.19 -178.57 6.37 Favored 'General case' 0 C--O 1.219 -0.52 0 C-N-CA 119.851 -0.74 . . . . 12.91 109.101 -165.067 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 50' ' ' GLU . . . . . . . . . . . . . 81.0 tt0 -57.19 -31.12 65.12 Favored 'General case' 0 C--O 1.242 0.704 0 O-C-N 123.701 0.626 . . . . 29.84 111.313 173.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 51' ' ' HIS . . . . . . . . . . . . . 80.8 m80 -101.93 -12.76 17.97 Favored 'General case' 0 C--O 1.243 0.759 0 N-CA-C 115.482 1.66 . . . . 18.81 115.482 -175.999 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 52' ' ' THR . . . . . . . . . . . . . 45.8 m -130.08 115.82 17.62 Favored 'General case' 0 N--CA 1.476 0.842 0 N-CA-C 108.678 -0.86 . . . . 12.13 108.678 -171.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 53' ' ' SER . . . . . . . . . . . . . 87.0 p -119.39 1.01 11.21 Favored 'General case' 0 CA--C 1.547 0.832 0 N-CA-C 113.715 1.006 . . . . 11.11 113.715 179.738 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 54' ' ' ALA . . . . . . . . . . . . . . . -152.9 146.96 25.44 Favored 'General case' 0 CA--C 1.51 -0.57 0 N-CA-C 107.145 -1.428 . . . . 10.8 107.145 172.07 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 55' ' ' ILE . . . . . . . . . . . . . 76.8 mt -130.1 128.79 65.01 Favored 'Isoleucine or valine' 0 C--O 1.212 -0.887 0 CA-C-N 115.634 -0.712 . . . . 12.99 109.19 -177.019 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 56' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -111.83 135.47 52.4 Favored 'General case' 0 C--O 1.219 -0.543 0 N-CA-C 109.053 -0.721 . . . . 21.62 109.053 -177.671 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 57' ' ' VAL . . . . . . . . . . . . . 61.1 t -118.89 124.42 73.14 Favored 'Isoleucine or valine' 0 C--O 1.236 0.351 0 N-CA-C 107.722 -1.214 . . . . 14.53 107.722 179.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 58' ' ' ARG . . . . . . . . . . . . . 80.4 mtp180 -118.16 125.6 50.54 Favored 'General case' 0 N--CA 1.468 0.468 0 CA-C-N 115.358 -0.837 . . . . 39.07 109.461 177.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 59' ' ' GLY . . . . . . . . . . . . . . . 114.42 160.72 13.4 Favored Glycine 0 CA--C 1.497 -1.075 0 N-CA-C 107.826 -2.11 . . . . 20.21 107.826 179.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 60' ' ' LYS . . . . . 0.789 ' HG2' ' HB2' ' C' ' 15' ' ' LEU . 48.4 tttp -65.72 117.94 8.87 Favored 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 109.403 -0.592 . . . . 37.52 109.403 -176.054 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 61' ' ' ALA . . . . . . . . . . . . . . . -144.66 150.77 37.93 Favored 'General case' 0 C--O 1.242 0.699 0 CA-C-O 121.018 0.437 . . . . 18.44 111.142 -174.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 62' ' ' TYR . . . . . 0.418 ' CD1' ' HB2' ' C' ' 71' ' ' GLU . 63.3 t80 -100.01 123.65 44.49 Favored 'General case' 0 C--O 1.218 -0.555 0 N-CA-C 105.214 -2.143 . . . . 35.65 105.214 168.366 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 63' ' ' ILE . . . . . 0.425 ' HB ' HG23 ' C' ' 70' ' ' ILE . 75.8 mt -124.51 135.02 65.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 O-C-N 123.57 0.544 . . . . 20.01 110.028 -173.106 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 64' ' ' GLN . . . . . 0.449 ' HG2' HG22 ' C' ' 69' ' ' VAL . 95.5 mt-30 -123.02 135.01 54.29 Favored 'General case' 0 N--CA 1.462 0.142 0 O-C-N 123.642 0.589 . . . . 29.23 110.603 172.909 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 65' ' ' THR . . . . . . . . . . . . . 32.9 p -133.57 -178.0 4.8 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 107.235 -1.394 . . . . 25.58 107.235 170.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 66' ' ' ARG . . . . . . . . . . . . . 10.2 ttp180 -55.46 -26.8 44.42 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 112.323 0.49 . . . . 48.19 112.323 172.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 67' ' ' HIS . . . . . . . . . . . . . 5.9 m-70 -81.18 -10.67 59.59 Favored 'General case' 0 N--CA 1.479 1.013 0 N-CA-C 115.171 1.545 . . . . 32.68 115.171 -178.379 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 68' ' ' GLY . . . . . . . . . . . . . . . 125.65 -155.15 18.88 Favored Glycine 0 N--CA 1.448 -0.536 0 C-N-CA 120.302 -0.951 . . . . 31.61 112.428 -179.78 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 69' ' ' VAL . . . . . 0.449 HG22 ' HG2' ' C' ' 64' ' ' GLN . 27.6 t -110.32 148.94 13.48 Favored 'Isoleucine or valine' 0 C--O 1.24 0.565 0 CA-C-O 121.487 0.661 . . . . 34.0 111.267 -172.105 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 70' ' ' ILE . . . . . 0.425 HG23 ' HB ' ' C' ' 63' ' ' ILE 0.253 11.6 tt -143.39 112.2 1.95 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.2 0 CA-C-N 115.073 -0.967 . . . . 39.9 108.971 171.246 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' C' C ' 71' ' ' GLU . . . . . 0.499 ' O ' ' HB2' ' C' ' 72' ' ' SER . 27.7 tt0 -126.84 126.2 42.94 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 114.572 1.323 . . . . 44.28 114.572 -170.041 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 72' ' ' SER . . . . . 0.499 ' HB2' ' O ' ' C' ' 71' ' ' GLU . 0.1 OUTLIER . . . . . 0 N--CA 1.476 0.838 0 C-N-CA 123.485 0.714 . . . . 47.07 109.708 162.995 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 100' ' ' TRP . . . . . . . . . . . . . 66.1 t-105 . . . . . 0 N--CA 1.517 2.922 0 CA-C-O 118.409 -0.805 . . . . 14.35 110.586 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1100 ' ' TRP . . . . . 0.622 ' N ' ' HG1' ' A' ' 30' ' ' THR . 70.3 t-105 . . . . . 0 N--CA 1.488 1.442 0 CA-C-O 121.204 0.526 . . . . 13.68 110.091 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 2100 ' ' TRP . . . . . 0.602 ' N ' ' HG1' ' B' ' 30' ' ' THR . 65.9 t-105 . . . . . 0 N--CA 1.513 2.689 0 CA-C-O 120.912 0.387 . . . . 13.49 111.145 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2101 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2102 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2103 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2104 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2105 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2106 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2107 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2108 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2109 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2110 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2111 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2112 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2113 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2114 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2115 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2116 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2117 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2118 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2119 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2120 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2121 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 2122 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 81' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 82' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 83' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 84' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 85' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 86' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 87' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 88' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 89' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 90' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 91' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 92' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 93' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 94' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 95' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 96' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_