data_1dr4_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 1dr4 _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 1.5 m . . . . . 0 N--CA 1.48 1.07 0 N-CA-C 108.615 -0.883 . . . . 71.68 108.615 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . . . -65.24 -41.31 94.45 Favored 'General case' 0 C--O 1.252 1.229 0 N-CA-C 115.16 1.541 . . . . 70.94 115.16 -176.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' SER . . . . . 0.634 ' CA ' ' CD1' ' A' ' 129' ' ' ILE . 88.1 p -164.33 150.14 10.65 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 106.802 -1.555 . . . . 57.45 106.802 -176.817 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . 0.3 35.8 mt -101.1 163.75 12.13 Favored 'General case' 0 C--O 1.252 1.216 0 O-C-N 126.765 2.54 . . . . 36.41 109.137 -179.254 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 36.5 m-80 -133.2 140.51 47.59 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 105.774 -1.935 . . . . 31.47 105.774 171.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 5.9 m -129.57 148.02 51.43 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 105.76 -1.941 . . . . 22.32 105.76 175.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ILE . . . . . . . . . . . . . 8.0 tt -140.21 136.39 37.31 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 N-CA-C 106.863 -1.532 . . . . 26.06 106.863 179.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 10.6 p -155.65 156.39 4.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 O-C-N 127.624 3.078 . . . . 21.92 108.24 -179.11 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -116.24 127.57 54.86 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 126.677 2.485 . . . . 22.52 104.397 172.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 13.4 m -126.96 156.34 38.25 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 O-C-N 127.711 3.132 . . . . 21.56 110.209 179.277 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' CYS . . . . . 0.487 ' SG ' ' CZ3' ' A' ' 24' ' ' TRP 0.851 9.8 p -100.38 -175.0 2.8 Favored 'General case' 0 C--O 1.248 1.002 0 CA-C-N 111.766 -2.47 . . . . 43.94 111.268 175.039 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . 0.712 5.1 mt-30 -52.98 -36.28 60.06 Favored 'General case' 0 C--O 1.263 1.774 0 N-CA-C 116.551 2.056 . . . . 66.43 116.551 -175.101 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' ASN . . . . . 0.446 ' N ' ' O ' ' A' ' 705' ' ' HOH . 0.5 OUTLIER -100.25 25.25 7.74 Favored 'General case' 0 N--CA 1.506 2.34 0 C-N-CA 116.017 -2.273 . . . . 61.6 109.011 -179.139 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' MET . . . . . 0.564 ' N ' ' O ' ' A' ' 705' ' ' HOH . . . 63.77 26.96 14.57 Favored 'General case' 0 C--O 1.264 1.847 0 O-C-N 124.761 1.288 . . . . 36.79 114.047 -176.96 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLY . . . . . 0.626 ' N ' ' O ' ' A' ' 705' ' ' HOH . . . -82.42 148.83 26.85 Favored Glycine 0 N--CA 1.496 2.688 0 N-CA-C 109.253 -1.539 . . . . 22.37 109.253 -179.829 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 30.2 pt -124.49 -3.75 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.245 0 N-CA-C 114.751 1.389 . . . . 22.19 114.751 178.008 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -172.43 165.19 37.69 Favored Glycine 0 N--CA 1.497 2.76 0 C-N-CA 118.11 -1.995 . . . . 27.77 110.554 -178.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 4.4 tttt -153.78 128.54 9.43 Favored 'General case' 0 C--O 1.258 1.542 0 CA-C-N 113.117 -1.542 . . . . 53.89 110.242 177.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 55.72 38.74 30.48 Favored 'General case' 0 C--O 1.267 2.006 0 O-C-N 125.209 1.568 . . . . 55.87 112.492 176.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 84.38 2.39 89.1 Favored Glycine 0 C--O 1.258 1.601 0 C-N-CA 120.397 -0.906 . . . . 43.11 114.588 175.55 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 25.4 t30 -139.27 -169.79 2.74 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-N 119.16 1.48 . . . . 73.97 111.37 177.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 32.8 mt -78.55 145.21 66.96 Favored Pre-proline 0 C--N 1.319 -0.721 0 O-C-N 127.781 3.175 . . . . 36.02 109.279 178.915 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 6.4 Cg_endo -69.71 -19.83 35.87 Favored 'Trans proline' 0 C--N 1.309 -1.541 0 O-C-N 124.569 1.826 . . . . 32.78 114.324 179.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' TRP . . . . . 0.487 ' CZ3' ' SG ' ' A' ' 11' ' ' CYS . 3.2 p90 -112.9 154.81 44.81 Favored Pre-proline 0 N--CA 1.493 1.695 0 CA-C-N 121.87 2.123 . . . . 31.01 107.958 179.75 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -62.07 178.59 0.77 Allowed 'Trans proline' 0 C--O 1.253 1.251 0 N-CA-C 103.898 -3.155 . . . . 32.82 103.898 170.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -69.7 133.25 25.23 Favored 'Trans proline' 0 C--N 1.308 -1.585 0 O-C-N 124.871 1.985 . . . . 31.28 116.982 -169.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 36.9 mt -111.28 99.98 8.69 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 105.277 -2.12 . . . . 30.23 105.277 173.174 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ARG . . . . . 0.862 ' CZ ' ' NZ ' ' A' ' 32' ' ' LYS . 6.8 ttt180 -50.34 -59.05 4.36 Favored 'General case' 0 C--O 1.261 1.706 0 O-C-N 125.859 1.975 . . . . 65.94 111.847 -179.179 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . 0.315 68.4 m-80 -58.93 -44.36 91.32 Favored 'General case' 0 C--O 1.266 1.967 0 C-N-CA 127.696 2.399 . . . . 51.83 114.063 -179.891 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -62.15 -42.23 99.05 Favored 'General case' 0 N--CA 1.482 1.147 0 O-C-N 120.25 -1.531 . . . . 27.67 109.892 176.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . 0.441 43.0 t80 -62.85 -40.02 96.16 Favored 'General case' 0 N--CA 1.443 -0.809 0 O-C-N 124.768 1.292 . . . . 69.63 111.982 179.267 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LYS . . . . . 0.862 ' NZ ' ' CZ ' ' A' ' 28' ' ' ARG . 18.4 mttp -68.67 -30.23 68.87 Favored 'General case' 0 C--O 1.246 0.874 0 N-CA-C 109.148 -0.686 . . . . 62.43 109.148 -179.749 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -65.18 -45.75 83.6 Favored 'General case' 0 C--N 1.307 -1.252 0 O-C-N 124.036 0.835 . . . . 39.42 109.201 178.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -63.03 -46.28 88.32 Favored 'General case' 0 C--O 1.242 0.701 0 C-N-CA 124.994 1.318 . . . . 25.89 110.447 -179.294 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLN . . . . . 0.423 ' NE2' ' NH1' ' A' ' 70' ' ' ARG . 2.3 mm-40 -58.25 -57.64 11.98 Favored 'General case' 0 C--O 1.252 1.215 0 CA-C-N 114.204 -1.362 . . . . 51.83 110.215 177.586 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 36.1 ttp85 -55.14 -50.75 68.47 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 125.08 1.352 . . . . 70.37 110.586 -179.805 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 21.2 mmm -59.48 -51.19 70.92 Favored 'General case' 0 C--O 1.246 0.874 0 CA-C-N 116.758 -0.201 . . . . 37.27 110.602 -178.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 71.4 p -72.93 -29.0 62.77 Favored 'General case' 0 CA--C 1.499 -0.988 0 N-CA-C 113.342 0.868 . . . . 26.84 113.342 -174.544 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 66.9 m -83.45 -27.83 29.22 Favored 'General case' 0 C--O 1.252 1.191 0 CA-C-O 116.403 -1.76 . . . . 39.82 115.302 -177.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' THR . . . . . 0.517 ' O ' ' CE ' ' A' ' 111' ' ' MET . 63.3 m -85.31 109.74 18.59 Favored 'General case' 0 C--N 1.307 -1.253 0 N-CA-C 114.69 1.367 . . . . 32.42 114.69 -170.425 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -101.91 153.86 19.47 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 126.442 2.339 . . . . 43.31 106.403 178.113 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' HIS . . . . . . . . . . . . . 11.7 m80 -112.67 47.65 1.07 Allowed 'General case' 0 C--O 1.255 1.361 0 O-C-N 125.362 1.664 . . . . 68.25 111.568 -178.153 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' VAL . . . . . . . . . . . . . 2.3 t -160.67 119.79 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 N-CA-C 104.767 -2.308 . . . . 55.74 104.767 -177.532 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . 0.433 4.9 pt-20 -64.26 137.69 58.05 Favored 'General case' 0 C--O 1.252 1.191 0 CA-C-O 123.195 1.474 . . . . 84.64 110.899 -178.658 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 89.22 1.53 78.74 Favored Glycine 0 C--O 1.27 2.385 0 CA-C-N 114.462 -1.245 . . . . 62.02 112.633 179.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' LYS . . . . . . . . . . . . . 21.0 mttt -117.82 156.92 27.53 Favored 'General case' 0 N--CA 1.496 1.861 0 C-N-CA 117.896 -1.522 . . . . 63.04 109.943 177.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -123.37 162.39 22.84 Favored 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 105.176 -2.157 . . . . 53.85 105.176 177.062 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' ASN . . . . . 0.468 ' ND2' ' CE ' ' A' ' 111' ' ' MET . 87.9 m-20 -91.02 157.03 17.5 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 126.657 2.473 . . . . 34.96 104.486 179.21 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -109.59 142.17 41.07 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 128.908 3.88 . . . . 29.79 105.709 175.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 26.8 m -119.93 130.28 74.41 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.195 0 O-C-N 126.059 2.099 . . . . 27.71 108.819 174.247 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 13.1 mt -112.57 140.21 33.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 125.076 1.485 . . . . 29.0 108.756 176.72 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 18.5 ptp -155.6 157.26 36.47 Favored 'General case' 0 C--O 1.259 1.561 0 O-C-N 124.494 1.121 . . . . 25.42 108.063 -177.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -79.2 174.04 55.27 Favored Glycine 0 CA--C 1.539 1.584 0 CA-C-O 116.484 -2.287 . . . . 26.78 108.172 179.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' LYS . . . . . 0.449 ' NZ ' ' O3X' ' A' ' 191' ' ' NAP . 22.1 ttpt -67.17 -49.12 65.85 Favored 'General case' 0 C--O 1.266 1.973 0 O-C-N 126.307 1.828 . . . . 31.43 112.583 -171.302 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' LYS . . . . . 0.83 ' CD ' ' O ' ' A' ' 667' ' ' HOH . 25.2 mtpt -59.93 -43.84 94.69 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 114.29 -1.323 . . . . 42.03 108.701 -178.272 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 94.3 m -60.51 -41.05 93.54 Favored 'General case' 0 C--O 1.277 2.513 0 C-N-CA 117.418 -1.713 . . . . 25.42 112.66 179.364 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' TRP . . . . . . . . . . . . . 22.1 t-105 -62.09 -47.74 83.28 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 108.407 -0.961 . . . . 23.0 108.407 -178.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . 0.328 53.7 m-85 -69.28 -18.67 63.87 Favored 'General case' 0 C--O 1.26 1.609 0 CA-C-N 114.859 -1.064 . . . . 36.5 110.565 -176.537 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 11.1 p -69.47 -17.18 63.59 Favored 'General case' 0 C--O 1.278 2.576 0 CA-C-O 122.264 1.03 . . . . 29.73 111.518 179.626 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 39.0 mt -86.25 132.23 43.92 Favored Pre-proline 0 N--CA 1.504 2.245 0 C-N-CA 118.292 -1.363 . . . . 33.36 107.635 -177.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -46.65 131.07 15.72 Favored 'Trans proline' 0 N--CA 1.488 1.16 0 O-C-N 126.821 3.011 . . . . 34.63 108.485 175.683 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -50.64 -44.11 57.3 Favored 'General case' 0 C--N 1.308 -1.202 0 C-N-CA 125.218 1.407 . . . . 72.7 113.636 -174.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 11.7 mmtp -66.93 -17.11 64.75 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-N 113.565 -1.652 . . . . 45.5 112.375 179.402 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -100.03 14.79 29.41 Favored 'General case' 0 C--O 1.271 2.206 0 CA-C-O 117.966 -1.016 . . . . 53.38 112.798 -178.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 23.1 mtt180 -104.26 138.98 19.68 Favored Pre-proline 0 CA--C 1.545 0.764 0 C-N-CA 124.957 1.303 . . . . 42.38 111.583 -179.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_endo -88.17 172.18 31.71 Favored 'Cis proline' 0 C--N 1.315 -1.193 0 CA-C-O 125.116 2.048 . . . . 33.32 110.307 -2.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 27.6 mt -54.03 112.62 0.99 Allowed 'General case' 0 C--O 1.255 1.38 0 CA-C-N 112.605 -2.088 . . . . 30.87 107.071 177.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 8.9 tttm -48.31 137.5 11.01 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 113.86 -1.518 . . . . 73.77 110.694 -179.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 41.1 m-20 68.07 14.98 9.42 Favored 'General case' 0 C--O 1.25 1.108 0 N-CA-C 117.757 2.502 . . . . 51.77 117.757 172.145 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' ARG . . . . . 0.423 ' NH1' ' NE2' ' A' ' 35' ' ' GLN . 16.8 mtm180 -136.41 154.3 50.84 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 104.473 -2.417 . . . . 32.82 104.473 178.161 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' ILE . . . . . . . . . . . . . 27.5 mt -86.75 113.09 23.9 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.706 0 N-CA-C 104.161 -2.533 . . . . 32.09 104.161 177.393 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' ASN . . . . . 0.459 ' N ' ' ND1' ' A' ' 87' ' ' HIS . 0.8 OUTLIER -85.8 117.57 24.75 Favored 'General case' 0 C--O 1.261 1.664 0 O-C-N 124.728 1.268 . . . . 34.04 111.504 178.629 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 73.6 mt -117.18 125.27 73.85 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.879 0 N-CA-C 105.818 -1.919 . . . . 27.5 105.818 174.964 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 86.6 t -104.64 143.53 15.99 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.961 0 C-N-CA 123.653 0.781 . . . . 33.68 110.127 175.5 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' LEU . . . . . . . . . . . . . 18.4 mt -107.22 140.77 39.57 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 107.314 -1.365 . . . . 31.62 107.314 176.001 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' SER . . . . . 0.419 ' OG ' ' O3X' ' A' ' 191' ' ' NAP . 31.1 t -167.03 140.99 3.77 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 125.736 1.898 . . . . 34.11 106.881 178.025 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' ARG . . . . . 0.414 ' CD ' ' O ' ' A' ' 393' ' ' HOH . 10.4 mtt180 -94.0 -12.15 29.29 Favored 'General case' 0 C--N 1.291 -1.972 0 O-C-N 125.498 1.749 . . . . 77.78 107.843 176.602 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -97.58 -47.68 5.55 Favored 'General case' 0 C--O 1.273 2.302 0 N-CA-C 116.764 2.135 . . . . 44.16 116.764 -177.433 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 35.1 mt -63.71 147.79 50.74 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 120.187 1.358 . . . . 40.4 110.272 -176.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 14.2 tptt -96.68 -29.22 13.93 Favored 'General case' 0 N--CA 1.485 1.284 0 O-C-N 127.647 3.092 . . . . 84.4 108.308 -177.999 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . . . -136.44 157.63 46.33 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 112.843 -1.981 . . . . 54.07 111.045 178.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' ALA . . . . . . . . . . . . . . . -58.89 137.81 87.26 Favored Pre-proline 0 C--N 1.318 -0.765 0 C-N-CA 125.728 1.611 . . . . 44.21 108.417 176.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' PRO . . . . . . . . . . . . . 18.4 Cg_exo -68.92 152.7 73.45 Favored 'Trans proline' 0 N--CA 1.497 1.688 1 N-CA-C 101.487 -4.082 . . . . 40.37 101.487 -179.439 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 6.6 tptp -52.2 119.59 4.55 Favored 'General case' 0 C--N 1.282 -2.33 0 O-C-N 126.932 2.645 . . . . 63.65 109.627 179.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 97.41 -24.53 31.06 Favored Glycine 0 C--O 1.26 1.74 0 C-N-CA 126.601 2.048 . . . . 38.09 114.796 179.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.09 151.81 46.93 Favored 'General case' 0 N--CA 1.507 2.393 0 N-CA-C 105.648 -1.982 . . . . 31.93 105.648 176.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' HIS . . . . . 0.459 ' ND1' ' N ' ' A' ' 72' ' ' ASN . 39.9 m80 -84.09 -41.9 16.66 Favored 'General case' 0 C--O 1.248 1.019 0 O-C-N 124.908 1.38 . . . . 37.72 109.685 179.333 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -145.62 158.46 43.84 Favored 'General case' 0 C--O 1.249 1.076 0 C-N-CA 118.246 -1.382 . . . . 43.28 109.485 -179.27 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' LEU . . . . . . . . . . . . . 5.4 tp -124.41 138.8 54.33 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 129.044 3.965 . . . . 40.48 105.026 179.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 9.2 m -140.62 149.21 42.04 Favored 'General case' 0 C--N 1.313 -1.022 1 O-C-N 129.683 4.364 . . . . 37.8 112.188 178.512 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -85.6 -21.36 28.51 Favored 'General case' 0 C--O 1.265 1.872 0 O-C-N 126.012 2.07 . . . . 61.4 113.932 -176.224 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 83.0 p -156.28 170.36 22.44 Favored 'General case' 0 N--CA 1.514 2.773 0 CA-C-O 115.757 -2.068 . . . . 31.26 105.971 176.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 20.2 tp -64.94 -37.83 88.93 Favored 'General case' 0 N--CA 1.504 2.248 0 O-C-N 126.938 2.649 . . . . 43.25 105.373 179.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' ASP . . . . . 0.617 ' OD1' ' NZ ' ' A' ' 127' ' ' LYS . 21.9 m-20 -54.25 -54.23 42.94 Favored 'General case' 0 N--CA 1.485 1.286 0 O-C-N 128.333 3.521 . . . . 55.98 110.064 179.175 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -55.57 -42.95 75.44 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 126.234 2.209 . . . . 53.17 107.438 179.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' ALA . . . . . . . . . . . . . . . -59.32 -48.9 79.9 Favored 'General case' 0 C--O 1.275 2.425 0 O-C-N 121.46 -0.775 . . . . 35.98 109.283 -179.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . 0.374 30.6 mt -65.25 -39.62 92.89 Favored 'General case' 0 N--CA 1.508 2.429 0 C-N-CA 115.567 -2.453 . . . . 38.28 111.533 -175.987 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -58.3 -49.79 75.89 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 107.602 -1.259 . . . . 44.75 107.602 179.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 16.7 tp -52.68 -47.45 67.2 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 122.276 1.036 . . . . 50.38 109.751 -179.708 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' LEU . . . . . . . . . . . . . 11.2 mt -55.01 -38.33 67.76 Favored 'General case' 0 C--O 1.246 0.895 0 CA-C-N 114.364 -1.289 . . . . 56.12 111.453 -175.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . 0.281 76.8 m-20 -73.11 -23.29 60.48 Favored 'General case' 0 C--O 1.251 1.182 0 CA-C-O 116.297 -1.811 . . . . 68.32 112.959 177.746 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . 0.304 2.1 p -51.41 158.98 1.26 Allowed Pre-proline 0 N--CA 1.482 1.169 0 O-C-N 125.019 1.449 . . . . 68.34 108.113 -179.487 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -62.74 -45.09 14.55 Favored 'Trans proline' 0 C--O 1.258 1.514 0 C-N-CA 123.791 2.994 . . . . 76.02 113.616 -175.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . . . -51.67 -41.88 61.72 Favored 'General case' 0 C--O 1.259 1.598 0 N-CA-C 113.659 0.985 . . . . 83.04 113.659 179.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' LEU . . . . . 0.63 ' O ' ' N ' ' A' ' 108' ' ' LYS . 0.3 OUTLIER -90.17 -55.32 3.65 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 124.814 1.246 . . . . 73.22 113.045 -178.551 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' LYS . . . . . 0.452 ' C ' ' O ' ' A' ' 105' ' ' LEU . . . -22.61 -55.78 0.03 OUTLIER 'General case' 0 C--O 1.253 1.262 0 CA-C-N 114.542 -1.208 . . . . 71.89 110.526 -176.737 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 3.3 p -75.93 -13.79 60.25 Favored 'General case' 0 C--O 1.264 1.836 0 N-CA-C 115.774 1.768 . . . . 71.87 115.774 -177.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' LYS . . . . . 0.63 ' N ' ' O ' ' A' ' 105' ' ' LEU . 0.6 OUTLIER -100.36 -8.88 22.84 Favored 'General case' 0 C--O 1.249 1.058 0 N-CA-C 115.85 1.796 . . . . 75.43 115.85 -177.799 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' VAL . . . . . . . . . . . . . 77.9 t -119.77 127.71 75.88 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.381 0 N-CA-C 116.058 1.873 . . . . 40.89 116.058 -171.412 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 37.4 t0 -93.08 -83.85 0.3 Allowed 'General case' 0 N--CA 1.492 1.658 0 CA-C-N 112.714 -2.039 . . . . 42.36 108.029 177.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' MET . . . . . 0.625 ' CE ' ' O ' ' A' ' 240' ' ' HOH . 18.2 mtm -101.59 147.38 26.48 Favored 'General case' 0 C--O 1.249 1.035 0 CA-C-O 124.295 1.998 . . . . 46.38 113.221 -177.286 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 95.9 t -108.57 121.77 62.11 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.017 0 CA-C-N 113.858 -1.519 . . . . 29.31 108.321 175.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' TRP . . . . . . . . . . . . . 87.7 m95 -116.09 136.8 52.7 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 127.551 3.032 . . . . 31.76 109.389 178.84 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ILE . . . . . . . . . . . . . 32.3 mm -100.06 123.9 53.18 Favored 'Isoleucine or valine' 0 C--O 1.253 1.281 0 N-CA-C 105.433 -2.062 . . . . 26.14 105.433 173.178 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . 0.26 5.3 m -119.81 23.07 5.14 Favored 'Isoleucine or valine' 0 C--O 1.266 1.924 0 O-C-N 127.932 3.27 . . . . 22.55 114.904 -177.356 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 87.54 -176.79 46.65 Favored Glycine 0 N--CA 1.483 1.806 0 O-C-N 127.111 2.757 . . . . 22.32 115.732 168.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -85.79 -148.29 10.98 Favored Glycine 0 N--CA 1.406 -3.318 1 C-N-CA 132.595 4.902 . . . . 23.79 115.933 6.474 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' THR . . . . . . . . . . . . . 84.8 m -46.58 -62.34 1.42 Allowed 'General case' 0 C--O 1.253 1.276 0 N-CA-C 115.774 1.768 . . . . 24.2 115.774 -173.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -55.53 -41.32 73.01 Favored 'General case' 0 C--O 1.252 1.185 0 CA-C-O 116.876 -1.535 . . . . 35.16 111.086 179.781 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' VAL . . . . . . . . . . . . . 22.8 t -64.76 -47.52 88.3 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.779 0 C-N-CA 118.101 -1.439 . . . . 27.12 114.03 -179.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -57.63 -45.31 85.59 Favored 'General case' 0 C--O 1.212 -0.888 0 CA-C-O 117.173 -1.394 . . . . 25.9 107.367 179.051 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 30.1 tttm -56.76 -54.58 44.72 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 127.514 3.009 . . . . 53.91 112.358 -177.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -51.57 -51.11 58.13 Favored 'General case' 0 C--N 1.311 -1.079 0 O-C-N 126.039 2.087 . . . . 29.55 107.949 178.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.8 -43.66 98.2 Favored 'General case' 0 N--CA 1.485 1.292 0 O-C-N 126.609 2.443 . . . . 27.57 109.821 -176.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' MET . . . . . . . . . . . . 0.385 61.1 mtm -56.54 -40.69 75.55 Favored 'General case' 0 C--O 1.248 0.985 0 O-C-N 126.354 2.284 . . . . 52.73 114.276 177.565 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -76.2 -18.82 58.89 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 115.664 1.727 . . . . 57.52 115.664 -179.952 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' LYS . . . . . 0.617 ' NZ ' ' OD1' ' A' ' 94' ' ' ASP . 5.5 mmtp -59.29 125.94 80.44 Favored Pre-proline 0 C--N 1.294 -1.817 0 C-N-CA 126.243 1.817 . . . . 61.88 106.308 174.61 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -84.29 69.74 6.13 Favored 'Trans proline' 0 C--N 1.317 -1.088 0 N-CA-C 105.372 -2.588 . . . . 49.03 105.372 179.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' ILE . . . . . 0.634 ' CD1' ' CA ' ' A' ' 3' ' ' SER . 0.0 OUTLIER -135.74 162.71 36.53 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.283 0 CA-C-N 112.576 -2.102 . . . . 52.37 105.448 174.853 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' ASN . . . . . 0.589 ' OD1' ' N ' ' A' ' 186' ' ' VAL . 4.1 m-20 -64.25 130.93 45.81 Favored 'General case' 0 C--N 1.295 -1.802 1 O-C-N 130.009 4.568 . . . . 53.66 105.701 179.543 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' HIS . . . . . . . . . . . . . 4.7 t-160 -150.21 132.45 15.45 Favored 'General case' 0 C--O 1.253 1.281 0 O-C-N 126.622 2.451 . . . . 30.58 111.801 -172.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' ARG . . . . . 0.564 ' NH1' ' OE1' ' A' ' 183' ' ' GLN . 42.8 mtm-85 -117.1 128.06 54.76 Favored 'General case' 0 CA--C 1.558 1.253 0 CA-C-N 112.896 -1.956 . . . . 57.38 107.662 176.12 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 13.1 tp -114.5 116.03 28.18 Favored 'General case' 0 C--N 1.3 -1.557 0 CA-C-N 112.321 -2.218 . . . . 29.04 110.101 -175.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' PHE . . . . . . . . . . . . . 51.4 m-85 -101.6 105.97 16.98 Favored 'General case' 0 C--N 1.308 -1.198 0 O-C-N 126.147 2.154 . . . . 26.89 105.324 179.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 61.2 t -111.64 133.68 56.5 Favored 'Isoleucine or valine' 0 C--O 1.264 1.861 0 O-C-N 127.548 3.03 . . . . 27.92 108.758 179.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 78.4 m -104.86 116.88 32.74 Favored 'General case' 0 C--O 1.271 2.223 0 N-CA-C 105.08 -2.193 . . . . 18.67 105.08 171.437 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 5.5 mtt180 -92.6 105.13 17.35 Favored 'General case' 0 C--O 1.257 1.492 0 O-C-N 127.208 2.818 . . . . 35.2 113.403 176.505 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' ILE . . . . . . . . . . . . . 4.3 mt -89.68 116.23 30.71 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.561 0 N-CA-C 106.529 -1.656 . . . . 25.84 106.529 179.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' LEU . . . . . 0.699 ' C ' ' CD2' ' A' ' 140' ' ' HIS . 33.5 mt -80.08 53.18 1.67 Allowed 'General case' 0 C--N 1.298 -1.655 0 C-N-CA 126.284 1.834 . . . . 34.22 111.829 -171.07 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' HIS . . . . . 0.699 ' CD2' ' C ' ' A' ' 139' ' ' LEU . 26.1 m-70 -157.69 160.51 38.02 Favored 'General case' 0 C--N 1.285 -2.207 0 O-C-N 125.993 2.058 . . . . 61.17 106.336 -178.892 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 83.0 mt-10 -113.35 126.13 55.03 Favored 'General case' 0 C--N 1.311 -1.084 0 O-C-N 125.294 1.621 . . . . 74.83 108.335 -177.589 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -125.8 149.54 48.52 Favored 'General case' 0 CA--C 1.551 0.999 0 O-C-N 127.422 2.951 . . . . 45.52 105.668 174.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . 0.312 16.8 pt-20 -60.8 127.57 32.25 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 126.581 2.425 . . . . 75.2 109.888 175.126 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 144' ' ' SER . . . . . 0.626 ' N ' ' O ' ' A' ' 623' ' ' HOH . 2.6 m -135.31 144.35 46.69 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 113.734 -1.576 . . . . 31.33 108.028 -178.116 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 39.7 p30 -114.55 -2.72 13.07 Favored 'General case' 0 N--CA 1.481 1.098 0 O-C-N 126.055 2.097 . . . . 36.18 108.066 177.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 78.6 m -132.38 147.37 52.38 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-O 114.591 -2.623 . . . . 27.3 106.835 -179.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -137.94 156.84 47.45 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 128.835 3.834 . . . . 35.03 114.56 -174.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' PHE . . . . . . . . . . . . . 39.9 t80 -80.54 134.67 54.09 Favored Pre-proline 0 N--CA 1.42 -1.959 0 CA-C-N 110.534 -3.03 . . . . 25.63 107.886 179.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_endo -64.25 162.81 28.55 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 O-C-N 126.358 2.767 . . . . 29.98 108.581 178.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -68.72 128.73 37.71 Favored 'General case' 0 C--N 1.307 -1.275 0 C-N-CA 125.142 1.377 . . . . 56.59 113.353 178.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' ILE . . . . . 0.634 ' CD1' ' C ' ' A' ' 151' ' ' ILE 0.348 0.0 OUTLIER -88.82 126.62 41.91 Favored 'Isoleucine or valine' 0 C--O 1.252 1.234 0 CA-C-O 123.63 1.681 . . . . 45.92 109.643 177.069 . . . . . . . . 4 4 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' ASP . . . . . 0.49 ' N ' ' CD1' ' A' ' 151' ' ' ILE 0.257 42.6 t0 -72.88 92.67 1.63 Allowed 'General case' 0 N--CA 1.44 -0.938 0 C-N-CA 124.474 1.11 . . . . 37.62 109.06 175.734 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' TYR . . . . . . . . . . . . . 21.9 m-30 -56.76 -12.2 1.77 Allowed 'General case' 0 C--O 1.254 1.308 0 O-C-N 126.434 2.334 . . . . 38.54 112.09 179.413 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' LYS . . . . . . . . . . . . . 6.7 mtmm -79.73 -40.97 27.67 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 126.614 2.446 . . . . 43.75 108.882 177.532 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -85.96 -46.92 10.09 Favored 'General case' 0 C--O 1.248 1.006 0 N-CA-C 114.235 1.198 . . . . 47.77 114.235 179.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' PHE . . . . . . . . . . . . . 78.4 m-85 -93.83 104.82 16.87 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 115.567 -0.742 . . . . 37.16 109.082 -176.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 15.1 mmtt -92.3 132.95 36.29 Favored 'General case' 0 C--N 1.309 -1.156 0 O-C-N 127.592 3.058 . . . . 73.68 107.746 177.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 13.8 tp -78.07 121.37 24.18 Favored 'General case' 0 C--O 1.254 1.292 0 O-C-N 126.774 2.546 . . . . 38.98 107.573 -178.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 17.2 mt -73.95 149.13 41.56 Favored 'General case' 0 CA--C 1.548 0.903 0 O-C-N 125.254 1.596 . . . . 43.59 106.914 173.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 41.8 p -86.62 -18.75 30.6 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 113.348 -1.751 . . . . 53.2 109.569 176.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' GLU . . . . . . . . . . . . . 5.2 tt0 -159.14 149.23 19.17 Favored 'General case' 0 C--O 1.25 1.125 0 O-C-N 124.809 1.318 . . . . 76.98 112.472 177.125 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' TYR . . . . . . . . . . . . . 32.3 t80 -149.96 134.37 9.25 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-O 122.375 1.083 . . . . 46.92 109.717 178.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' PRO . . . . . . . . . . . . . 80.1 Cg_exo -48.87 112.12 0.59 Allowed 'Trans proline' 0 C--O 1.255 1.35 0 C-N-CA 122.194 1.93 . . . . 52.65 115.749 178.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 88.76 11.07 66.26 Favored Glycine 0 C--O 1.264 1.981 0 C-N-CA 120.232 -0.985 . . . . 51.8 113.444 174.198 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 13.4 t -113.62 112.07 48.63 Favored Pre-proline 0 N--CA 1.489 1.481 0 N-CA-C 106.045 -1.835 . . . . 43.38 106.045 176.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_exo -46.95 144.63 8.08 Favored 'Trans proline' 0 N--CA 1.513 2.636 0 O-C-N 124.955 2.029 . . . . 40.06 107.798 -179.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' ALA . . . . . . . . . . . . . . . -90.84 -42.11 10.82 Favored 'General case' 0 C--O 1.255 1.361 0 N-CA-C 114.919 1.451 . . . . 48.2 114.919 -179.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' ASP . . . . . . . . . . . . . 23.8 m-20 -68.61 163.28 24.04 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.442 1.097 . . . . 75.04 111.075 -175.209 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' ILE . . . . . . . . . . . . . 3.9 mt -68.63 132.34 32.99 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.551 0 N-CA-C 105.625 -1.991 . . . . 46.16 105.625 171.655 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -95.66 161.87 13.86 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 126.257 2.223 . . . . 38.7 107.204 177.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 85.2 tt0 -141.49 139.41 33.29 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 106.146 -1.798 . . . . 59.96 106.146 176.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 172' ' ' GLU . . . . . . . . . . . . 0.254 28.4 tt0 -158.31 141.14 14.69 Favored 'General case' 0 N--CA 1.522 3.13 0 N-CA-C 103.181 -2.896 . . . . 41.24 103.181 175.01 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 46.84 37.17 4.51 Favored 'General case' 0 N--CA 1.428 -1.531 0 CA-C-O 113.284 -3.246 . . . . 38.88 112.153 -175.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . 79.8 2.95 88.98 Favored Glycine 0 C--N 1.289 -2.028 0 O-C-N 127.454 2.971 . . . . 26.58 113.598 175.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 175' ' ' ILE . . . . . . . . . . . . 0.279 46.5 mm -106.51 139.23 28.59 Favored 'Isoleucine or valine' 0 C--O 1.266 1.96 0 O-C-N 125.421 1.307 . . . . 31.72 109.852 179.274 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 176' ' ' GLN . . . . . . . . . . . . . 62.7 mt-30 -105.45 148.42 27.19 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 122.084 0.945 . . . . 31.83 108.911 176.035 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 22.7 p90 -153.89 160.2 42.06 Favored 'General case' 0 C--O 1.286 3.015 0 CA-C-N 112.812 -1.994 . . . . 30.03 108.248 -179.504 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 4.6 pttp -137.8 141.65 40.85 Favored 'General case' 0 C--O 1.241 0.619 0 CA-C-O 123.916 1.817 . . . . 66.17 112.509 174.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 179' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 -87.52 130.55 34.68 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 112.701 -2.045 . . . . 30.83 108.742 176.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -129.71 153.88 47.73 Favored 'General case' 0 C--N 1.297 -1.684 0 O-C-N 125.781 1.926 . . . . 35.31 109.397 174.37 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 181' ' ' VAL . . . . . . . . . . . . . 6.5 t -134.61 126.31 47.93 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.472 0 C-N-CA 127.893 2.477 . . . . 27.87 109.431 177.479 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -118.13 149.51 40.92 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 111.375 -2.648 . . . . 31.79 105.697 177.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 183' ' ' GLN . . . . . 0.564 ' OE1' ' NH1' ' A' ' 132' ' ' ARG . 16.5 tt0 -134.39 132.39 39.35 Favored 'General case' 0 C--N 1.321 -0.641 0 O-C-N 127.635 3.085 . . . . 58.57 112.014 -177.832 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 19.6 tttt -114.59 121.13 42.49 Favored 'General case' 0 C--N 1.319 -0.756 0 O-C-N 128.326 3.516 . . . . 41.47 107.073 174.478 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 16.6 m -103.4 122.31 44.59 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 113.601 -1.636 . . . . 61.0 110.584 -179.276 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 186' ' ' VAL . . . . . 0.589 ' N ' ' OD1' ' A' ' 130' ' ' ASN . 0.1 OUTLIER . . . . . 0 C--O 1.26 1.628 1 CA-C-O 111.571 -4.062 . . . . 73.89 105.867 172.491 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 190' ' ' ' HG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 191' ' ' NAP . . . . . 0.449 ' O3X' ' NZ ' ' A' ' 54' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 198' ' ' HBI . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 240' ' ' HOH . . . . . 0.625 ' O ' ' CE ' ' A' ' 111' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 257' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 265' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 278' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 279' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 295' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 358' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 365' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 367' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 368' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 379' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 392' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 393' ' ' HOH . . . . . 0.414 ' O ' ' CD ' ' A' ' 77' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 440' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 455' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 463' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 493' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 539' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 546' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 547' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 551' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 584' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 585' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 601' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 602' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 603' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 604' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 605' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 606' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 607' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 608' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 609' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 610' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 611' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 612' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 613' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 614' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 615' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 617' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 618' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 619' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 620' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 621' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 622' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 623' ' ' HOH . . . . . 0.626 ' O ' ' N ' ' A' ' 144' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 624' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 626' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 627' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 630' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 637' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 644' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 647' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 648' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 652' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 655' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 662' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 667' ' ' HOH . . . . . 0.83 ' O ' ' CD ' ' A' ' 55' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 670' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 672' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 705' ' ' HOH . . . . . 0.626 ' O ' ' N ' ' A' ' 15' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 733' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 1.5 m . . . . . 0 N--CA 1.48 1.07 0 N-CA-C 108.615 -0.883 . . . . 71.68 108.615 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ARG . . . . . 0.446 ' O ' HD12 ' A' ' 129' ' ' ILE . . . -65.24 -41.31 94.45 Favored 'General case' 0 C--O 1.252 1.229 0 N-CA-C 115.16 1.541 . . . . 70.94 115.16 -176.981 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 3' ' ' SER . . . . . 1.079 ' HA ' HD11 ' A' ' 129' ' ' ILE . 88.1 p -164.33 150.14 10.65 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 106.802 -1.555 . . . . 57.45 106.802 -176.817 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . 0.3 35.8 mt -101.1 163.75 12.13 Favored 'General case' 0 C--O 1.252 1.216 0 O-C-N 126.765 2.54 . . . . 36.41 109.137 -179.254 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 36.5 m-80 -133.2 140.51 47.59 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 105.774 -1.935 . . . . 31.47 105.774 171.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 5.9 m -129.57 148.02 51.43 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 105.76 -1.941 . . . . 22.32 105.76 175.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ILE . . . . . 0.404 ' HA ' ' O ' ' A' ' 134' ' ' PHE . 8.0 tt -140.21 136.39 37.31 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 N-CA-C 106.863 -1.532 . . . . 26.06 106.863 179.65 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 10.6 p -155.65 156.39 4.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 O-C-N 127.624 3.078 . . . . 21.92 108.24 -179.11 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -116.24 127.57 54.86 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 126.677 2.485 . . . . 22.52 104.397 172.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' VAL . . . . . 0.407 HG12 HG22 ' A' ' 16' ' ' ILE . 13.4 m -126.96 156.34 38.25 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 O-C-N 127.711 3.132 . . . . 21.56 110.209 179.277 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' CYS . . . . . 0.815 ' HB3' ' O ' ' A' ' 140' ' ' HIS 0.851 9.8 p -100.38 -175.0 2.8 Favored 'General case' 0 C--O 1.248 1.002 0 CA-C-N 111.766 -2.47 . . . . 50.0 111.268 175.039 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 12' ' ' GLN . . . . . 0.498 ' HG3' ' O ' ' A' ' 614' ' ' HOH 0.712 23.4 mt-30 -52.98 -36.28 60.06 Favored 'General case' 0 C--O 1.263 1.774 0 N-CA-C 116.551 2.056 . . . . 66.43 116.551 -175.101 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 13' ' ' ASN . . . . . 0.446 ' N ' ' O ' ' A' ' 705' ' ' HOH . 16.9 p30 -100.25 25.25 7.74 Favored 'General case' 0 N--CA 1.506 2.34 0 C-N-CA 116.017 -2.273 . . . . 61.6 109.011 -179.139 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 14' ' ' MET . . . . . 0.564 ' N ' ' O ' ' A' ' 705' ' ' HOH . . . 63.77 26.96 14.57 Favored 'General case' 0 C--O 1.264 1.847 0 O-C-N 124.761 1.288 . . . . 36.79 114.047 -176.96 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -82.42 148.83 26.85 Favored Glycine 0 N--CA 1.496 2.688 0 N-CA-C 109.253 -1.539 . . . . 22.37 109.253 -179.829 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ILE . . . . . 0.692 ' O ' ' H2N' ' A' ' 191' ' ' NAP . 30.2 pt -124.49 -3.75 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.245 0 N-CA-C 114.751 1.389 . . . . 22.19 114.751 178.008 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLY . . . . . 0.562 ' HA2' ' HD3' ' A' ' 23' ' ' PRO . . . -172.43 165.19 37.69 Favored Glycine 0 N--CA 1.497 2.76 0 C-N-CA 118.11 -1.995 . . . . 27.77 110.554 -178.051 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 4.4 tttt -153.78 128.54 9.43 Favored 'General case' 0 C--O 1.258 1.542 0 CA-C-N 113.117 -1.542 . . . . 53.89 110.242 177.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 55.72 38.74 30.48 Favored 'General case' 0 C--O 1.267 2.006 0 O-C-N 125.209 1.568 . . . . 55.87 112.492 176.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 84.38 2.39 89.1 Favored Glycine 0 C--O 1.258 1.601 0 C-N-CA 120.397 -0.906 . . . . 43.11 114.588 175.55 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ASN . . . . . 0.563 ' CG ' ' H ' ' A' ' 22' ' ' LEU . 25.4 t30 -139.27 -169.79 2.74 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-N 119.16 1.48 . . . . 73.97 111.37 177.266 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' LEU . . . . . 0.563 ' H ' ' CG ' ' A' ' 21' ' ' ASN . 32.8 mt -78.55 145.21 66.96 Favored Pre-proline 0 C--N 1.319 -0.721 0 O-C-N 127.781 3.175 . . . . 36.02 109.279 178.915 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 23' ' ' PRO . . . . . 0.562 ' HD3' ' HA2' ' A' ' 17' ' ' GLY . 6.4 Cg_endo -69.71 -19.83 35.87 Favored 'Trans proline' 0 C--N 1.309 -1.541 0 O-C-N 124.569 1.826 . . . . 32.78 114.324 179.991 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' TRP . . . . . 0.561 ' CZ3' ' HG2' ' A' ' 23' ' ' PRO . 3.2 p90 -112.9 154.81 44.81 Favored Pre-proline 0 N--CA 1.493 1.695 0 CA-C-N 121.87 2.123 . . . . 31.01 107.958 179.75 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -62.07 178.59 0.77 Allowed 'Trans proline' 0 C--O 1.253 1.251 0 N-CA-C 103.898 -3.155 . . . . 32.82 103.898 170.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -69.7 133.25 25.23 Favored 'Trans proline' 0 C--N 1.308 -1.585 0 O-C-N 124.871 1.985 . . . . 31.28 116.982 -169.258 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 36.9 mt -111.28 99.98 8.69 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 105.277 -2.12 . . . . 30.23 105.277 173.174 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ARG . . . . . 0.862 ' CZ ' ' NZ ' ' A' ' 32' ' ' LYS . 6.8 ttt180 -50.34 -59.05 4.36 Favored 'General case' 0 C--O 1.261 1.706 0 O-C-N 125.859 1.975 . . . . 65.94 111.847 -179.179 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ASN . . . . . 0.495 ' HB2' ' OE1' ' A' ' 172' ' ' GLU 0.315 68.4 m-80 -58.93 -44.36 91.32 Favored 'General case' 0 C--O 1.266 1.967 0 C-N-CA 127.696 2.399 . . . . 51.83 114.063 -179.891 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -62.15 -42.23 99.05 Favored 'General case' 0 N--CA 1.482 1.147 0 O-C-N 120.25 -1.531 . . . . 27.67 109.892 176.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . 0.441 43.0 t80 -62.85 -40.02 96.16 Favored 'General case' 0 N--CA 1.443 -0.809 0 O-C-N 124.768 1.292 . . . . 69.63 111.982 179.267 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LYS . . . . . 0.862 ' NZ ' ' CZ ' ' A' ' 28' ' ' ARG . 18.4 mttp -68.67 -30.23 68.87 Favored 'General case' 0 C--O 1.246 0.874 0 N-CA-C 109.148 -0.686 . . . . 62.43 109.148 -179.749 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -65.18 -45.75 83.6 Favored 'General case' 0 C--N 1.307 -1.252 0 O-C-N 124.036 0.835 . . . . 39.42 109.201 178.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -63.03 -46.28 88.32 Favored 'General case' 0 C--O 1.242 0.701 0 C-N-CA 124.994 1.318 . . . . 25.89 110.447 -179.294 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLN . . . . . . . . . . . . . 14.7 mm100 -58.25 -57.64 11.98 Favored 'General case' 0 C--O 1.252 1.215 0 CA-C-N 114.204 -1.362 . . . . 51.83 110.215 177.586 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 36.1 ttp85 -55.14 -50.75 68.47 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 125.08 1.352 . . . . 70.37 110.586 -179.805 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' MET . . . . . 0.436 ' HE3' ' CE2' ' A' ' 134' ' ' PHE . 21.2 mmm -59.48 -51.19 70.92 Favored 'General case' 0 C--O 1.246 0.874 0 CA-C-N 116.758 -0.201 . . . . 37.27 110.602 -178.303 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 71.4 p -72.93 -29.0 62.77 Favored 'General case' 0 CA--C 1.499 -0.988 0 N-CA-C 113.342 0.868 . . . . 26.84 113.342 -174.544 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 66.9 m -83.45 -27.83 29.22 Favored 'General case' 0 C--O 1.252 1.191 0 CA-C-O 116.403 -1.76 . . . . 39.82 115.302 -177.379 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' THR . . . . . 0.565 ' O ' ' HE1' ' A' ' 111' ' ' MET . 63.3 m -85.31 109.74 18.59 Favored 'General case' 0 C--N 1.307 -1.253 0 N-CA-C 114.69 1.367 . . . . 32.42 114.69 -170.425 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -101.91 153.86 19.47 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 126.442 2.339 . . . . 43.31 106.403 178.113 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' HIS . . . . . 0.52 ' O ' HG23 ' A' ' 43' ' ' VAL . 11.7 m80 -112.67 47.65 1.07 Allowed 'General case' 0 C--O 1.255 1.361 0 O-C-N 125.362 1.664 . . . . 68.25 111.568 -178.153 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' VAL . . . . . 0.808 HG11 ' HD2' ' A' ' 46' ' ' LYS . 2.3 t -160.67 119.79 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 N-CA-C 104.767 -2.308 . . . . 55.74 104.767 -177.532 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . 0.433 4.9 pt-20 -64.26 137.69 58.05 Favored 'General case' 0 C--O 1.252 1.191 0 CA-C-O 123.195 1.474 . . . . 84.64 110.899 -178.658 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 89.22 1.53 78.74 Favored Glycine 0 C--O 1.27 2.385 0 CA-C-N 114.462 -1.245 . . . . 62.02 112.633 179.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' LYS . . . . . 0.808 ' HD2' HG11 ' A' ' 43' ' ' VAL . 21.0 mttt -117.82 156.92 27.53 Favored 'General case' 0 N--CA 1.496 1.861 0 C-N-CA 117.896 -1.522 . . . . 63.04 109.943 177.763 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 21.6 mt-30 -123.37 162.39 22.84 Favored 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 105.176 -2.157 . . . . 53.85 105.176 177.062 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' ASN . . . . . 0.468 ' ND2' ' H ' ' A' ' 111' ' ' MET . 5.8 m120 -91.02 157.03 17.5 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 126.657 2.473 . . . . 34.96 104.486 179.21 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -109.59 142.17 41.07 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 128.908 3.88 . . . . 29.79 105.709 175.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 26.8 m -119.93 130.28 74.41 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.195 0 O-C-N 126.059 2.099 . . . . 27.71 108.819 174.247 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 13.1 mt -112.57 140.21 33.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 125.076 1.485 . . . . 29.0 108.756 176.72 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 18.5 ptp -155.6 157.26 36.47 Favored 'General case' 0 C--O 1.259 1.561 0 O-C-N 124.494 1.121 . . . . 25.42 108.063 -177.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -79.2 174.04 55.27 Favored Glycine 0 CA--C 1.539 1.584 0 CA-C-O 116.484 -2.287 . . . . 26.78 108.172 179.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.1 ttpt -67.17 -49.12 65.85 Favored 'General case' 0 C--O 1.266 1.973 0 O-C-N 126.307 1.828 . . . . 31.43 112.583 -171.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' LYS . . . . . 0.9 ' HD2' ' O ' ' A' ' 667' ' ' HOH . 25.2 mtpt -59.93 -43.84 94.69 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 114.29 -1.323 . . . . 42.03 108.701 -178.272 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 94.3 m -60.51 -41.05 93.54 Favored 'General case' 0 C--O 1.277 2.513 0 C-N-CA 117.418 -1.713 . . . . 25.42 112.66 179.364 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' TRP . . . . . 0.526 ' CE2' ' HD3' ' A' ' 65' ' ' ARG . 22.1 t-105 -62.09 -47.74 83.28 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 108.407 -0.961 . . . . 23.0 108.407 -178.998 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . 0.328 53.7 m-85 -69.28 -18.67 63.87 Favored 'General case' 0 C--O 1.26 1.609 0 CA-C-N 114.859 -1.064 . . . . 36.5 110.565 -176.537 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 11.1 p -69.47 -17.18 63.59 Favored 'General case' 0 C--O 1.278 2.576 0 CA-C-O 122.264 1.03 . . . . 29.73 111.518 179.626 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 39.0 mt -86.25 132.23 43.92 Favored Pre-proline 0 N--CA 1.504 2.245 0 C-N-CA 118.292 -1.363 . . . . 33.36 107.635 -177.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -46.65 131.07 15.72 Favored 'Trans proline' 0 N--CA 1.488 1.16 0 O-C-N 126.821 3.011 . . . . 34.63 108.485 175.683 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -50.64 -44.11 57.3 Favored 'General case' 0 C--N 1.308 -1.202 0 C-N-CA 125.218 1.407 . . . . 72.7 113.636 -174.638 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' LYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 655' ' ' HOH . 11.7 mmtp -66.93 -17.11 64.75 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-N 113.565 -1.652 . . . . 45.5 112.375 179.402 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -100.03 14.79 29.41 Favored 'General case' 0 C--O 1.271 2.206 0 CA-C-O 117.966 -1.016 . . . . 53.38 112.798 -178.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' ARG . . . . . 0.526 ' HD3' ' CE2' ' A' ' 57' ' ' TRP . 23.1 mtt180 -104.26 138.98 19.68 Favored Pre-proline 0 CA--C 1.545 0.764 0 C-N-CA 124.957 1.303 . . . . 42.38 111.583 -179.199 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_endo -88.17 172.18 31.71 Favored 'Cis proline' 0 C--N 1.315 -1.193 0 CA-C-O 125.116 2.048 . . . . 33.32 110.307 -2.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 27.6 mt -54.03 112.62 0.99 Allowed 'General case' 0 C--O 1.255 1.38 0 CA-C-N 112.605 -2.088 . . . . 30.87 107.071 177.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 8.9 tttm -48.31 137.5 11.01 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 113.86 -1.518 . . . . 73.77 110.694 -179.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 41.1 m-20 68.07 14.98 9.42 Favored 'General case' 0 C--O 1.25 1.108 0 N-CA-C 117.757 2.502 . . . . 51.77 117.757 172.145 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' ARG . . . . . . . . . . . . . 16.8 mtm180 -136.41 154.3 50.84 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 104.473 -2.417 . . . . 32.82 104.473 178.161 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' ILE . . . . . 0.421 HD12 HG22 ' A' ' 109' ' ' VAL . 27.5 mt -86.75 113.09 23.9 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.706 0 N-CA-C 104.161 -2.533 . . . . 32.09 104.161 177.393 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 72' ' ' ASN . . . . . 0.626 HD22 ' N ' ' A' ' 72' ' ' ASN . 0.8 OUTLIER -85.8 117.57 24.75 Favored 'General case' 0 C--O 1.261 1.664 0 O-C-N 124.728 1.268 . . . . 34.04 111.504 178.629 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 73.6 mt -117.18 125.27 73.85 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.879 0 N-CA-C 105.818 -1.919 . . . . 27.5 105.818 174.964 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 86.6 t -104.64 143.53 15.99 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.961 0 C-N-CA 123.653 0.781 . . . . 33.68 110.127 175.5 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' LEU . . . . . 0.504 ' HA ' ' O ' ' A' ' 90' ' ' SER . 18.4 mt -107.22 140.77 39.57 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 107.314 -1.365 . . . . 31.62 107.314 176.001 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 31.1 t -167.03 140.99 3.77 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 125.736 1.898 . . . . 34.11 106.881 178.025 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' ARG . . . . . 0.876 ' HD2' ' O ' ' A' ' 393' ' ' HOH . 10.4 mtt180 -94.0 -12.15 29.29 Favored 'General case' 0 C--N 1.291 -1.972 0 O-C-N 125.498 1.749 . . . . 77.78 107.843 176.602 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -97.58 -47.68 5.55 Favored 'General case' 0 C--O 1.273 2.302 0 N-CA-C 116.764 2.135 . . . . 44.16 116.764 -177.433 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 35.1 mt -63.71 147.79 50.74 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 120.187 1.358 . . . . 40.4 110.272 -176.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 14.2 tptt -96.68 -29.22 13.93 Favored 'General case' 0 N--CA 1.485 1.284 0 O-C-N 127.647 3.092 . . . . 84.4 108.308 -177.999 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . . . -136.44 157.63 46.33 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 112.843 -1.981 . . . . 54.07 111.045 178.949 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' ALA . . . . . 0.421 ' HA ' ' HD3' ' A' ' 83' ' ' PRO . . . -58.89 137.81 87.26 Favored Pre-proline 0 C--N 1.318 -0.765 0 C-N-CA 125.728 1.611 . . . . 44.21 108.417 176.927 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 83' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 82' ' ' ALA . 18.4 Cg_exo -68.92 152.7 73.45 Favored 'Trans proline' 0 N--CA 1.497 1.688 1 N-CA-C 101.487 -4.082 . . . . 40.37 101.487 -179.439 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 6.6 tptp -52.2 119.59 4.55 Favored 'General case' 0 C--N 1.282 -2.33 0 O-C-N 126.932 2.645 . . . . 63.65 109.627 179.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 97.41 -24.53 31.06 Favored Glycine 0 C--O 1.26 1.74 0 C-N-CA 126.601 2.048 . . . . 38.09 114.796 179.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.09 151.81 46.93 Favored 'General case' 0 N--CA 1.507 2.393 0 N-CA-C 105.648 -1.982 . . . . 31.93 105.648 176.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 39.9 m80 -84.09 -41.9 16.66 Favored 'General case' 0 C--O 1.248 1.019 0 O-C-N 124.908 1.38 . . . . 37.72 109.685 179.333 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -145.62 158.46 43.84 Favored 'General case' 0 C--O 1.249 1.076 0 C-N-CA 118.246 -1.382 . . . . 43.28 109.485 -179.27 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' LEU . . . . . 0.579 HD12 ' N ' ' A' ' 90' ' ' SER . 5.4 tp -124.41 138.8 54.33 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 129.044 3.965 . . . . 40.48 105.026 179.959 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 90' ' ' SER . . . . . 0.579 ' N ' HD12 ' A' ' 89' ' ' LEU . 9.2 m -140.62 149.21 42.04 Favored 'General case' 0 C--N 1.313 -1.022 1 O-C-N 129.683 4.364 . . . . 37.8 112.188 178.512 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 91' ' ' LYS . . . . . 0.754 ' HE3' ' O ' ' A' ' 279' ' ' HOH . 0.5 OUTLIER -85.6 -21.36 28.51 Favored 'General case' 0 C--O 1.265 1.872 0 O-C-N 126.012 2.07 . . . . 61.4 113.932 -176.224 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 83.0 p -156.28 170.36 22.44 Favored 'General case' 0 N--CA 1.514 2.773 0 CA-C-O 115.757 -2.068 . . . . 31.26 105.971 176.851 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' LEU . . . . . 0.433 ' O ' ' HB3' ' A' ' 96' ' ' ALA . 20.2 tp -64.94 -37.83 88.93 Favored 'General case' 0 N--CA 1.504 2.248 0 O-C-N 126.938 2.649 . . . . 43.25 105.373 179.929 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -54.25 -54.23 42.94 Favored 'General case' 0 N--CA 1.485 1.286 0 O-C-N 128.333 3.521 . . . . 55.98 110.064 179.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -55.57 -42.95 75.44 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 126.234 2.209 . . . . 53.17 107.438 179.205 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' ALA . . . . . 0.433 ' HB3' ' O ' ' A' ' 93' ' ' LEU . . . -59.32 -48.9 79.9 Favored 'General case' 0 C--O 1.275 2.425 0 O-C-N 121.46 -0.775 . . . . 35.98 109.283 -179.64 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . 0.374 30.6 mt -65.25 -39.62 92.89 Favored 'General case' 0 N--CA 1.508 2.429 0 C-N-CA 115.567 -2.453 . . . . 38.28 111.533 -175.987 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -58.3 -49.79 75.89 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 107.602 -1.259 . . . . 44.75 107.602 179.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 16.7 tp -52.68 -47.45 67.2 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 122.276 1.036 . . . . 50.38 109.751 -179.708 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' LEU . . . . . 0.438 HD23 HD12 ' A' ' 105' ' ' LEU . 11.2 mt -55.01 -38.33 67.76 Favored 'General case' 0 C--O 1.246 0.895 0 CA-C-N 114.364 -1.289 . . . . 56.12 111.453 -175.789 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . 0.281 76.8 m-20 -73.11 -23.29 60.48 Favored 'General case' 0 C--O 1.251 1.182 0 CA-C-O 116.297 -1.811 . . . . 68.32 112.959 177.746 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . 0.304 2.1 p -51.41 158.98 1.26 Allowed Pre-proline 0 N--CA 1.482 1.169 0 O-C-N 125.019 1.449 . . . . 68.34 108.113 -179.487 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -62.74 -45.09 14.55 Favored 'Trans proline' 0 C--O 1.258 1.514 0 C-N-CA 123.791 2.994 . . . . 76.02 113.616 -175.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . . . -51.67 -41.88 61.72 Favored 'General case' 0 C--O 1.259 1.598 0 N-CA-C 113.659 0.985 . . . . 83.04 113.659 179.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' LEU . . . . . 0.543 ' O ' ' N ' ' A' ' 108' ' ' LYS . 0.3 OUTLIER -90.17 -55.32 3.65 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 124.814 1.246 . . . . 73.22 113.045 -178.551 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 106' ' ' LYS . . . . . 0.452 ' C ' ' O ' ' A' ' 105' ' ' LEU . . . -22.61 -55.78 0.03 OUTLIER 'General case' 0 C--O 1.253 1.262 0 CA-C-N 114.542 -1.208 . . . . 71.89 110.526 -176.737 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 3.3 p -75.93 -13.79 60.25 Favored 'General case' 0 C--O 1.264 1.836 0 N-CA-C 115.774 1.768 . . . . 71.87 115.774 -177.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' LYS . . . . . 0.613 ' NZ ' ' CB ' ' A' ' 108' ' ' LYS . 0.6 OUTLIER -100.36 -8.88 22.84 Favored 'General case' 0 C--O 1.249 1.058 0 N-CA-C 115.85 1.796 . . . . 75.43 115.85 -177.799 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 109' ' ' VAL . . . . . 0.421 HG22 HD12 ' A' ' 71' ' ' ILE . 77.9 t -119.77 127.71 75.88 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.381 0 N-CA-C 116.058 1.873 . . . . 40.89 116.058 -171.412 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 37.4 t0 -93.08 -83.85 0.3 Allowed 'General case' 0 N--CA 1.492 1.658 0 CA-C-N 112.714 -2.039 . . . . 42.36 108.029 177.695 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' MET . . . . . 1.01 ' HE1' ' O ' ' A' ' 240' ' ' HOH . 18.2 mtm -101.59 147.38 26.48 Favored 'General case' 0 C--O 1.249 1.035 0 CA-C-O 124.295 1.998 . . . . 46.38 113.221 -177.286 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 95.9 t -108.57 121.77 62.11 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.017 0 CA-C-N 113.858 -1.519 . . . . 29.31 108.321 175.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' TRP . . . . . 0.592 ' HE1' ' HE3' ' A' ' 111' ' ' MET . 87.7 m95 -116.09 136.8 52.7 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 127.551 3.032 . . . . 31.76 109.389 178.84 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ILE . . . . . 0.427 HG23 HG12 ' A' ' 120' ' ' VAL . 32.3 mm -100.06 123.9 53.18 Favored 'Isoleucine or valine' 0 C--O 1.253 1.281 0 N-CA-C 105.433 -2.062 . . . . 26.14 105.433 173.178 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . 0.26 5.3 m -119.81 23.07 5.14 Favored 'Isoleucine or valine' 0 C--O 1.266 1.924 0 O-C-N 127.932 3.27 . . . . 22.55 114.904 -177.356 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 87.54 -176.79 46.65 Favored Glycine 0 N--CA 1.483 1.806 0 O-C-N 127.111 2.757 . . . . 22.32 115.732 168.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -85.79 -148.29 10.98 Favored Glycine 0 N--CA 1.406 -3.318 1 C-N-CA 132.595 4.902 . . . . 23.79 115.933 6.474 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 118' ' ' THR . . . . . 0.63 ' HB ' ' O ' ' A' ' 318' ' ' HOH . 84.8 m -46.58 -62.34 1.42 Allowed 'General case' 0 C--O 1.253 1.276 0 N-CA-C 115.774 1.768 . . . . 24.2 115.774 -173.617 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -55.53 -41.32 73.01 Favored 'General case' 0 C--O 1.252 1.185 0 CA-C-O 116.876 -1.535 . . . . 35.16 111.086 179.781 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' VAL . . . . . 0.427 HG12 HG23 ' A' ' 114' ' ' ILE . 22.8 t -64.76 -47.52 88.3 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.779 0 C-N-CA 118.101 -1.439 . . . . 27.12 114.03 -179.757 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -57.63 -45.31 85.59 Favored 'General case' 0 C--O 1.212 -0.888 0 CA-C-O 117.173 -1.394 . . . . 25.9 107.367 179.051 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 30.1 tttm -56.76 -54.58 44.72 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 127.514 3.009 . . . . 53.91 112.358 -177.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -51.57 -51.11 58.13 Favored 'General case' 0 C--N 1.311 -1.079 0 O-C-N 126.039 2.087 . . . . 29.55 107.949 178.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.8 -43.66 98.2 Favored 'General case' 0 N--CA 1.485 1.292 0 O-C-N 126.609 2.443 . . . . 27.57 109.821 -176.724 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' MET . . . . . . . . . . . . 0.385 61.1 mtm -56.54 -40.69 75.55 Favored 'General case' 0 C--O 1.248 0.985 0 O-C-N 126.354 2.284 . . . . 52.73 114.276 177.565 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -76.2 -18.82 58.89 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 115.664 1.727 . . . . 57.52 115.664 -179.952 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' LYS . . . . . 0.543 ' HB3' HG23 ' A' ' 129' ' ' ILE . 5.5 mmtp -59.29 125.94 80.44 Favored Pre-proline 0 C--N 1.294 -1.817 0 C-N-CA 126.243 1.817 . . . . 61.88 106.308 174.61 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 128' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -84.29 69.74 6.13 Favored 'Trans proline' 0 C--N 1.317 -1.088 0 N-CA-C 105.372 -2.588 . . . . 49.03 105.372 179.286 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 129' ' ' ILE . . . . . 1.079 HD11 ' HA ' ' A' ' 3' ' ' SER . 0.0 OUTLIER -135.74 162.71 36.53 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.283 0 CA-C-N 112.576 -2.102 . . . . 52.37 105.448 174.853 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 130' ' ' ASN . . . . . 0.923 ' N ' HG13 ' A' ' 129' ' ' ILE . 4.1 m-20 -64.25 130.93 45.81 Favored 'General case' 0 C--N 1.295 -1.802 1 O-C-N 130.009 4.568 . . . . 53.66 105.701 179.543 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 131' ' ' HIS . . . . . . . . . . . . . 4.7 t-160 -150.21 132.45 15.45 Favored 'General case' 0 C--O 1.253 1.281 0 O-C-N 126.622 2.451 . . . . 30.58 111.801 -172.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' ARG . . . . . 0.564 ' NH1' ' OE1' ' A' ' 183' ' ' GLN . 42.8 mtm-85 -117.1 128.06 54.76 Favored 'General case' 0 CA--C 1.558 1.253 0 CA-C-N 112.896 -1.956 . . . . 57.38 107.662 176.12 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 13.1 tp -114.5 116.03 28.18 Favored 'General case' 0 C--N 1.3 -1.557 0 CA-C-N 112.321 -2.218 . . . . 29.04 110.101 -175.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' PHE . . . . . 0.436 ' CE2' ' HE3' ' A' ' 37' ' ' MET . 51.4 m-85 -101.6 105.97 16.98 Favored 'General case' 0 C--N 1.308 -1.198 0 O-C-N 126.147 2.154 . . . . 26.89 105.324 179.448 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 61.2 t -111.64 133.68 56.5 Favored 'Isoleucine or valine' 0 C--O 1.264 1.861 0 O-C-N 127.548 3.03 . . . . 27.92 108.758 179.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 78.4 m -104.86 116.88 32.74 Favored 'General case' 0 C--O 1.271 2.223 0 N-CA-C 105.08 -2.193 . . . . 18.67 105.08 171.437 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 5.5 mtt180 -92.6 105.13 17.35 Favored 'General case' 0 C--O 1.257 1.492 0 O-C-N 127.208 2.818 . . . . 35.2 113.403 176.505 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' ILE . . . . . . . . . . . . . 4.3 mt -89.68 116.23 30.71 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.561 0 N-CA-C 106.529 -1.656 . . . . 25.84 106.529 179.108 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' LEU . . . . . 0.699 ' C ' ' CD2' ' A' ' 140' ' ' HIS . 33.5 mt -80.08 53.18 1.67 Allowed 'General case' 0 C--N 1.298 -1.655 0 C-N-CA 126.284 1.834 . . . . 34.22 111.829 -171.07 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 140' ' ' HIS . . . . . 0.815 ' O ' ' HB3' ' A' ' 11' ' ' CYS . 26.1 m-70 -157.69 160.51 38.02 Favored 'General case' 0 C--N 1.285 -2.207 0 O-C-N 125.993 2.058 . . . . 61.17 106.336 -178.892 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 83.0 mt-10 -113.35 126.13 55.03 Favored 'General case' 0 C--N 1.311 -1.084 0 O-C-N 125.294 1.621 . . . . 74.83 108.335 -177.589 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' PHE . . . . . 0.531 ' HD1' ' SG ' ' A' ' 11' ' ' CYS . 4.7 m-85 -125.8 149.54 48.52 Favored 'General case' 0 CA--C 1.551 0.999 0 O-C-N 127.422 2.951 . . . . 45.52 105.668 174.969 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . 0.312 16.8 pt-20 -60.8 127.57 32.25 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 126.581 2.425 . . . . 75.2 109.888 175.126 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 2.6 m -135.31 144.35 46.69 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 113.734 -1.576 . . . . 31.33 108.028 -178.116 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 39.7 p30 -114.55 -2.72 13.07 Favored 'General case' 0 N--CA 1.481 1.098 0 O-C-N 126.055 2.097 . . . . 36.18 108.066 177.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 78.6 m -132.38 147.37 52.38 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-O 114.591 -2.623 . . . . 27.3 106.835 -179.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -137.94 156.84 47.45 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 128.835 3.834 . . . . 35.03 114.56 -174.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 148' ' ' PHE . . . . . 0.475 ' CD1' ' HD2' ' A' ' 149' ' ' PRO . 39.9 t80 -80.54 134.67 54.09 Favored Pre-proline 0 N--CA 1.42 -1.959 0 CA-C-N 110.534 -3.03 . . . . 25.63 107.886 179.421 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 149' ' ' PRO . . . . . 0.475 ' HD2' ' CD1' ' A' ' 148' ' ' PHE . 10.4 Cg_endo -64.25 162.81 28.55 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 O-C-N 126.358 2.767 . . . . 29.98 108.581 178.818 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -68.72 128.73 37.71 Favored 'General case' 0 C--N 1.307 -1.275 0 C-N-CA 125.142 1.377 . . . . 56.59 113.353 178.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' ILE . . . . . 0.912 ' C ' HD12 ' A' ' 151' ' ' ILE 0.348 0.0 OUTLIER -88.82 126.62 41.91 Favored 'Isoleucine or valine' 0 C--O 1.252 1.234 0 CA-C-O 123.63 1.681 . . . . 45.92 109.643 177.069 . . . . . . . . 4 4 . 1 . 001 ecloud build full ' A' A ' 152' ' ' ASP . . . . . 0.847 ' N ' HD12 ' A' ' 151' ' ' ILE 0.257 42.6 t0 -72.88 92.67 1.63 Allowed 'General case' 0 N--CA 1.44 -0.938 0 C-N-CA 124.474 1.11 . . . . 37.62 109.06 175.734 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 153' ' ' TYR . . . . . 0.71 ' CE1' HG13 ' A' ' 151' ' ' ILE . 21.9 m-30 -56.76 -12.2 1.77 Allowed 'General case' 0 C--O 1.254 1.308 0 O-C-N 126.434 2.334 . . . . 38.54 112.09 179.413 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 154' ' ' LYS . . . . . 0.71 ' HB2' ' OD1' ' A' ' 152' ' ' ASP . 6.7 mtmm -79.73 -40.97 27.67 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 126.614 2.446 . . . . 43.75 108.882 177.532 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -85.96 -46.92 10.09 Favored 'General case' 0 C--O 1.248 1.006 0 N-CA-C 114.235 1.198 . . . . 47.77 114.235 179.57 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' PHE . . . . . 0.732 ' HB2' ' CD1' ' A' ' 151' ' ' ILE . 78.4 m-85 -93.83 104.82 16.87 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 115.567 -0.742 . . . . 37.16 109.082 -176.863 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 15.1 mmtt -92.3 132.95 36.29 Favored 'General case' 0 C--N 1.309 -1.156 0 O-C-N 127.592 3.058 . . . . 73.68 107.746 177.014 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 13.8 tp -78.07 121.37 24.18 Favored 'General case' 0 C--O 1.254 1.292 0 O-C-N 126.774 2.546 . . . . 38.98 107.573 -178.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 17.2 mt -73.95 149.13 41.56 Favored 'General case' 0 CA--C 1.548 0.903 0 O-C-N 125.254 1.596 . . . . 43.59 106.914 173.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 41.8 p -86.62 -18.75 30.6 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 113.348 -1.751 . . . . 53.2 109.569 176.976 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 161' ' ' GLU . . . . . 0.409 ' HG2' ' N ' ' A' ' 162' ' ' TYR . 5.2 tt0 -159.14 149.23 19.17 Favored 'General case' 0 C--O 1.25 1.125 0 O-C-N 124.809 1.318 . . . . 76.98 112.472 177.125 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 162' ' ' TYR . . . . . 0.409 ' N ' ' HG2' ' A' ' 161' ' ' GLU . 32.3 t80 -149.96 134.37 9.25 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-O 122.375 1.083 . . . . 46.92 109.717 178.888 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 163' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 162' ' ' TYR . 80.1 Cg_exo -48.87 112.12 0.59 Allowed 'Trans proline' 0 C--O 1.255 1.35 0 C-N-CA 122.194 1.93 . . . . 52.65 115.749 178.522 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 88.76 11.07 66.26 Favored Glycine 0 C--O 1.264 1.981 0 C-N-CA 120.232 -0.985 . . . . 51.8 113.444 174.198 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 13.4 t -113.62 112.07 48.63 Favored Pre-proline 0 N--CA 1.489 1.481 0 N-CA-C 106.045 -1.835 . . . . 43.38 106.045 176.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 166' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_exo -46.95 144.63 8.08 Favored 'Trans proline' 0 N--CA 1.513 2.636 0 O-C-N 124.955 2.029 . . . . 40.06 107.798 -179.101 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 167' ' ' ALA . . . . . . . . . . . . . . . -90.84 -42.11 10.82 Favored 'General case' 0 C--O 1.255 1.361 0 N-CA-C 114.919 1.451 . . . . 48.2 114.919 -179.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 168' ' ' ASP . . . . . 0.495 ' HB3' ' O ' ' A' ' 368' ' ' HOH . 23.8 m-20 -68.61 163.28 24.04 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.442 1.097 . . . . 75.04 111.075 -175.209 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 169' ' ' ILE . . . . . . . . . . . . . 3.9 mt -68.63 132.34 32.99 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.551 0 N-CA-C 105.625 -1.991 . . . . 46.16 105.625 171.655 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 170' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -95.66 161.87 13.86 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 126.257 2.223 . . . . 38.7 107.204 177.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 85.2 tt0 -141.49 139.41 33.29 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 106.146 -1.798 . . . . 59.96 106.146 176.8 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 172' ' ' GLU . . . . . 0.495 ' OE1' ' HB2' ' A' ' 29' ' ' ASN 0.254 28.4 tt0 -158.31 141.14 14.69 Favored 'General case' 0 N--CA 1.522 3.13 0 N-CA-C 103.181 -2.896 . . . . 41.24 103.181 175.01 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 46.84 37.17 4.51 Favored 'General case' 0 N--CA 1.428 -1.531 0 CA-C-O 113.284 -3.246 . . . . 38.88 112.153 -175.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . 79.8 2.95 88.98 Favored Glycine 0 C--N 1.289 -2.028 0 O-C-N 127.454 2.971 . . . . 26.58 113.598 175.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 175' ' ' ILE . . . . . 0.425 ' HA ' HD13 ' A' ' 175' ' ' ILE 0.279 46.5 mm -106.51 139.23 28.59 Favored 'Isoleucine or valine' 0 C--O 1.266 1.96 0 O-C-N 125.421 1.307 . . . . 31.72 109.852 179.274 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 176' ' ' GLN . . . . . . . . . . . . . 62.7 mt-30 -105.45 148.42 27.19 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 122.084 0.945 . . . . 31.83 108.911 176.035 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 22.7 p90 -153.89 160.2 42.06 Favored 'General case' 0 C--O 1.286 3.015 0 CA-C-N 112.812 -1.994 . . . . 30.03 108.248 -179.504 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 4.6 pttp -137.8 141.65 40.85 Favored 'General case' 0 C--O 1.241 0.619 0 CA-C-O 123.916 1.817 . . . . 66.17 112.509 174.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 179' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 -87.52 130.55 34.68 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 112.701 -2.045 . . . . 30.83 108.742 176.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -129.71 153.88 47.73 Favored 'General case' 0 C--N 1.297 -1.684 0 O-C-N 125.781 1.926 . . . . 35.31 109.397 174.37 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 181' ' ' VAL . . . . . . . . . . . . . 6.5 t -134.61 126.31 47.93 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.472 0 C-N-CA 127.893 2.477 . . . . 27.87 109.431 177.479 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -118.13 149.51 40.92 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 111.375 -2.648 . . . . 31.79 105.697 177.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 183' ' ' GLN . . . . . 0.564 ' OE1' ' NH1' ' A' ' 132' ' ' ARG . 16.5 tt0 -134.39 132.39 39.35 Favored 'General case' 0 C--N 1.321 -0.641 0 O-C-N 127.635 3.085 . . . . 58.57 112.014 -177.832 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 19.6 tttt -114.59 121.13 42.49 Favored 'General case' 0 C--N 1.319 -0.756 0 O-C-N 128.326 3.516 . . . . 41.47 107.073 174.478 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 16.6 m -103.4 122.31 44.59 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 113.601 -1.636 . . . . 61.0 110.584 -179.276 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 186' ' ' VAL . . . . . 0.532 ' CG2' ' C ' ' A' ' 129' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--O 1.26 1.628 1 CA-C-O 111.571 -4.062 . . . . 73.89 105.867 172.491 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 190' ' ' ' HG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 191' ' ' NAP . . . . . 0.692 ' H2N' ' O ' ' A' ' 16' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 198' ' ' HBI . . . . . 0.635 ' H71' ' H4N' ' A' ' 191' ' ' NAP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 240' ' ' HOH . . . . . 1.01 ' O ' ' HE1' ' A' ' 111' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 257' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 265' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 278' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 279' ' ' HOH . . . . . 0.754 ' O ' ' HE3' ' A' ' 91' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 295' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 318' ' ' HOH . . . . . 0.63 ' O ' ' HB ' ' A' ' 118' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 358' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 365' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 367' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 368' ' ' HOH . . . . . 0.495 ' O ' ' HB3' ' A' ' 168' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 379' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 392' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 393' ' ' HOH . . . . . 0.876 ' O ' ' HD2' ' A' ' 77' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 440' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 455' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 463' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 493' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 539' ' ' HOH . . . . . 0.434 ' O ' ' HB3' ' A' ' 140' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 546' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 547' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 551' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 584' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 585' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 601' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 602' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 603' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 604' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 605' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 606' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 607' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 608' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 609' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 610' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 611' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 612' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 613' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 614' ' ' HOH . . . . . 0.498 ' O ' ' HG3' ' A' ' 12' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 615' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 617' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 618' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 619' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 620' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 621' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 622' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 623' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 624' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 626' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 627' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 630' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 637' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 644' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 647' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 648' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 652' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 655' ' ' HOH . . . . . 0.455 ' O ' ' HB2' ' A' ' 63' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 662' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 667' ' ' HOH . . . . . 0.9 ' O ' ' HD2' ' A' ' 55' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 670' ' ' HOH . . . . . 0.463 ' O ' ' HD2' ' A' ' 55' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 672' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 705' ' ' HOH . . . . . 0.564 ' O ' ' N ' ' A' ' 14' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 733' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 1' ' ' VAL . . . . . . . . . . . . . 1.5 m . . . . . 0 N--CA 1.48 1.07 0 N-CA-C 108.615 -0.883 . . . . 71.68 108.615 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.446 ' O ' HD12 ' A' ' 129' ' ' ILE . . . -65.24 -41.31 94.45 Favored 'General case' 0 C--O 1.252 1.229 0 N-CA-C 115.16 1.541 . . . . 70.94 115.16 -176.981 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' SER . . . . . 1.079 ' HA ' HD11 ' A' ' 129' ' ' ILE . 88.1 p -164.33 150.14 10.65 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 106.802 -1.555 . . . . 57.45 106.802 -176.817 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . 0.3 35.8 mt -101.1 163.75 12.13 Favored 'General case' 0 C--O 1.252 1.216 0 O-C-N 126.765 2.54 . . . . 36.41 109.137 -179.254 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ASN . . . . . . . . . . . . . 36.5 m-80 -133.2 140.51 47.59 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 105.774 -1.935 . . . . 31.47 105.774 171.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' SER . . . . . . . . . . . . . 5.9 m -129.57 148.02 51.43 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 105.76 -1.941 . . . . 22.32 105.76 175.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ILE . . . . . 0.404 ' HA ' ' O ' ' A' ' 134' ' ' PHE . 8.0 tt -140.21 136.39 37.31 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 N-CA-C 106.863 -1.532 . . . . 26.06 106.863 179.65 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 10.6 p -155.65 156.39 4.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.926 0 O-C-N 127.624 3.078 . . . . 21.92 108.24 -179.11 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -116.24 127.57 54.86 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 126.677 2.485 . . . . 22.52 104.397 172.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.407 HG12 HG22 ' A' ' 16' ' ' ILE . 13.4 m -126.96 156.34 38.25 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.201 0 O-C-N 127.711 3.132 . . . . 21.56 110.209 179.277 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.815 ' HB3' ' O ' ' A' ' 140' ' ' HIS 0.851 9.8 p -100.38 -175.0 2.8 Favored 'General case' 0 C--O 1.248 1.002 0 CA-C-N 111.766 -2.47 . . . . 50.0 111.268 175.039 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' GLN . . . . . 0.498 ' HG3' ' O ' ' A' ' 614' ' ' HOH 0.712 5.1 mt-30 -52.98 -36.28 60.06 Favored 'General case' 0 C--O 1.263 1.774 0 N-CA-C 116.551 2.056 . . . . 66.43 116.551 -175.101 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' ASN . . . . . 0.446 ' N ' ' O ' ' A' ' 705' ' ' HOH . 0.5 OUTLIER -100.25 25.25 7.74 Favored 'General case' 0 N--CA 1.506 2.34 0 C-N-CA 116.017 -2.273 . . . . 61.6 109.011 -179.139 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' MET . . . . . 0.564 ' N ' ' O ' ' A' ' 705' ' ' HOH . . . 63.77 26.96 14.57 Favored 'General case' 0 C--O 1.264 1.847 0 O-C-N 124.761 1.288 . . . . 36.79 114.047 -176.96 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -82.42 148.83 26.85 Favored Glycine 0 N--CA 1.496 2.688 0 N-CA-C 109.253 -1.539 . . . . 22.37 109.253 -179.829 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.692 ' O ' ' H2N' ' A' ' 191' ' ' NAP . 30.2 pt -124.49 -3.75 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.245 0 N-CA-C 114.751 1.389 . . . . 22.19 114.751 178.008 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLY . . . . . 0.562 ' HA2' ' HD3' ' A' ' 23' ' ' PRO . . . -172.43 165.19 37.69 Favored Glycine 0 N--CA 1.497 2.76 0 C-N-CA 118.11 -1.995 . . . . 27.77 110.554 -178.051 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 4.4 tttt -153.78 128.54 9.43 Favored 'General case' 0 C--O 1.258 1.542 0 CA-C-N 113.117 -1.542 . . . . 53.89 110.242 177.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 55.72 38.74 30.48 Favored 'General case' 0 C--O 1.267 2.006 0 O-C-N 125.209 1.568 . . . . 55.87 112.492 176.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLY . . . . . . . . . . . . . . . 84.38 2.39 89.1 Favored Glycine 0 C--O 1.258 1.601 0 C-N-CA 120.397 -0.906 . . . . 43.11 114.588 175.55 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.563 ' CG ' ' H ' ' A' ' 22' ' ' LEU . 25.4 t30 -139.27 -169.79 2.74 Favored 'General case' 0 C--O 1.244 0.804 0 CA-C-N 119.16 1.48 . . . . 73.97 111.37 177.266 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.563 ' H ' ' CG ' ' A' ' 21' ' ' ASN . 32.8 mt -78.55 145.21 66.96 Favored Pre-proline 0 C--N 1.319 -0.721 0 O-C-N 127.781 3.175 . . . . 36.02 109.279 178.915 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' PRO . . . . . 0.562 ' HD3' ' HA2' ' A' ' 17' ' ' GLY . 6.4 Cg_endo -69.71 -19.83 35.87 Favored 'Trans proline' 0 C--N 1.309 -1.541 0 O-C-N 124.569 1.826 . . . . 32.78 114.324 179.991 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.561 ' CZ3' ' HG2' ' A' ' 23' ' ' PRO . 3.2 p90 -112.9 154.81 44.81 Favored Pre-proline 0 N--CA 1.493 1.695 0 CA-C-N 121.87 2.123 . . . . 31.01 107.958 179.75 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -62.07 178.59 0.77 Allowed 'Trans proline' 0 C--O 1.253 1.251 0 N-CA-C 103.898 -3.155 . . . . 32.82 103.898 170.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -69.7 133.25 25.23 Favored 'Trans proline' 0 C--N 1.308 -1.585 0 O-C-N 124.871 1.985 . . . . 31.28 116.982 -169.258 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 36.9 mt -111.28 99.98 8.69 Favored 'General case' 0 N--CA 1.446 -0.648 0 N-CA-C 105.277 -2.12 . . . . 30.23 105.277 173.174 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ARG . . . . . 0.862 ' CZ ' ' NZ ' ' A' ' 32' ' ' LYS . 6.8 ttt180 -50.34 -59.05 4.36 Favored 'General case' 0 C--O 1.261 1.706 0 O-C-N 125.859 1.975 . . . . 65.94 111.847 -179.179 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.495 ' HB2' ' OE1' ' A' ' 172' ' ' GLU 0.315 68.4 m-80 -58.93 -44.36 91.32 Favored 'General case' 0 C--O 1.266 1.967 0 C-N-CA 127.696 2.399 . . . . 51.83 114.063 -179.891 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 4.1 tm-20 -62.15 -42.23 99.05 Favored 'General case' 0 N--CA 1.482 1.147 0 O-C-N 120.25 -1.531 . . . . 27.67 109.892 176.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' TYR . . . . . . . . . . . . 0.441 43.0 t80 -62.85 -40.02 96.16 Favored 'General case' 0 N--CA 1.443 -0.809 0 O-C-N 124.768 1.292 . . . . 69.63 111.982 179.267 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.862 ' NZ ' ' CZ ' ' A' ' 28' ' ' ARG . 18.4 mttp -68.67 -30.23 68.87 Favored 'General case' 0 C--O 1.246 0.874 0 N-CA-C 109.148 -0.686 . . . . 62.43 109.148 -179.749 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 69.3 t80 -65.18 -45.75 83.6 Favored 'General case' 0 C--N 1.307 -1.252 0 O-C-N 124.036 0.835 . . . . 39.42 109.201 178.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -63.03 -46.28 88.32 Favored 'General case' 0 C--O 1.242 0.701 0 C-N-CA 124.994 1.318 . . . . 25.89 110.447 -179.294 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLN . . . . . 0.706 ' NE2' HH12 ' A' ' 70' ' ' ARG . 2.3 mm-40 -58.25 -57.64 11.98 Favored 'General case' 0 C--O 1.252 1.215 0 CA-C-N 114.204 -1.362 . . . . 51.83 110.215 177.586 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ARG . . . . . . . . . . . . . 36.1 ttp85 -55.14 -50.75 68.47 Favored 'General case' 0 C--N 1.309 -1.179 0 C-N-CA 125.08 1.352 . . . . 70.37 110.586 -179.805 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' MET . . . . . 0.436 ' HE3' ' CE2' ' A' ' 134' ' ' PHE . 21.2 mmm -59.48 -51.19 70.92 Favored 'General case' 0 C--O 1.246 0.874 0 CA-C-N 116.758 -0.201 . . . . 37.27 110.602 -178.303 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' THR . . . . . . . . . . . . . 71.4 p -72.93 -29.0 62.77 Favored 'General case' 0 CA--C 1.499 -0.988 0 N-CA-C 113.342 0.868 . . . . 26.84 113.342 -174.544 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' SER . . . . . . . . . . . . . 66.9 m -83.45 -27.83 29.22 Favored 'General case' 0 C--O 1.252 1.191 0 CA-C-O 116.403 -1.76 . . . . 39.82 115.302 -177.379 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' THR . . . . . 0.812 ' O ' ' HE1' ' A' ' 111' ' ' MET . 63.3 m -85.31 109.74 18.59 Favored 'General case' 0 C--N 1.307 -1.253 0 N-CA-C 114.69 1.367 . . . . 32.42 114.69 -170.425 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -101.91 153.86 19.47 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 126.442 2.339 . . . . 43.31 106.403 178.113 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' HIS . . . . . 0.52 ' O ' HG23 ' A' ' 43' ' ' VAL . 11.7 m80 -112.67 47.65 1.07 Allowed 'General case' 0 C--O 1.255 1.361 0 O-C-N 125.362 1.664 . . . . 68.25 111.568 -178.153 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.808 HG11 ' HD2' ' A' ' 46' ' ' LYS . 2.3 t -160.67 119.79 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 N-CA-C 104.767 -2.308 . . . . 55.74 104.767 -177.532 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . 0.433 4.9 pt-20 -64.26 137.69 58.05 Favored 'General case' 0 C--O 1.252 1.191 0 CA-C-O 123.195 1.474 . . . . 84.64 110.899 -178.658 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 89.22 1.53 78.74 Favored Glycine 0 C--O 1.27 2.385 0 CA-C-N 114.462 -1.245 . . . . 62.02 112.633 179.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' LYS . . . . . 0.808 ' HD2' HG11 ' A' ' 43' ' ' VAL . 21.0 mttt -117.82 156.92 27.53 Favored 'General case' 0 N--CA 1.496 1.861 0 C-N-CA 117.896 -1.522 . . . . 63.04 109.943 177.763 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 4.2 mt-30 -123.37 162.39 22.84 Favored 'General case' 0 N--CA 1.497 1.924 0 N-CA-C 105.176 -2.157 . . . . 53.85 105.176 177.062 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' ASN . . . . . 0.887 HD21 ' HE2' ' A' ' 111' ' ' MET . 87.9 m-20 -91.02 157.03 17.5 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 126.657 2.473 . . . . 34.96 104.486 179.21 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ALA . . . . . . . . . . . . . . . -109.59 142.17 41.07 Favored 'General case' 0 C--N 1.305 -1.362 0 O-C-N 128.908 3.88 . . . . 29.79 105.709 175.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 26.8 m -119.93 130.28 74.41 Favored 'Isoleucine or valine' 0 C--N 1.309 -1.195 0 O-C-N 126.059 2.099 . . . . 27.71 108.819 174.247 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 13.1 mt -112.57 140.21 33.54 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 O-C-N 125.076 1.485 . . . . 29.0 108.756 176.72 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' MET . . . . . . . . . . . . . 18.5 ptp -155.6 157.26 36.47 Favored 'General case' 0 C--O 1.259 1.561 0 O-C-N 124.494 1.121 . . . . 25.42 108.063 -177.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' GLY . . . . . . . . . . . . . . . -79.2 174.04 55.27 Favored Glycine 0 CA--C 1.539 1.584 0 CA-C-O 116.484 -2.287 . . . . 26.78 108.172 179.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 22.1 ttpt -67.17 -49.12 65.85 Favored 'General case' 0 C--O 1.266 1.973 0 O-C-N 126.307 1.828 . . . . 31.43 112.583 -171.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' LYS . . . . . 0.9 ' HD2' ' O ' ' A' ' 667' ' ' HOH . 25.2 mtpt -59.93 -43.84 94.69 Favored 'General case' 0 N--CA 1.478 0.966 0 CA-C-N 114.29 -1.323 . . . . 42.03 108.701 -178.272 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 94.3 m -60.51 -41.05 93.54 Favored 'General case' 0 C--O 1.277 2.513 0 C-N-CA 117.418 -1.713 . . . . 25.42 112.66 179.364 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' TRP . . . . . 0.526 ' CE2' ' HD3' ' A' ' 65' ' ' ARG . 22.1 t-105 -62.09 -47.74 83.28 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 108.407 -0.961 . . . . 23.0 108.407 -178.998 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' PHE . . . . . . . . . . . . 0.328 53.7 m-85 -69.28 -18.67 63.87 Favored 'General case' 0 C--O 1.26 1.609 0 CA-C-N 114.859 -1.064 . . . . 36.5 110.565 -176.537 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 11.1 p -69.47 -17.18 63.59 Favored 'General case' 0 C--O 1.278 2.576 0 CA-C-O 122.264 1.03 . . . . 29.73 111.518 179.626 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ILE . . . . . . . . . . . . . 39.0 mt -86.25 132.23 43.92 Favored Pre-proline 0 N--CA 1.504 2.245 0 C-N-CA 118.292 -1.363 . . . . 33.36 107.635 -177.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' PRO . . . . . . . . . . . . . 80.4 Cg_exo -46.65 131.07 15.72 Favored 'Trans proline' 0 N--CA 1.488 1.16 0 O-C-N 126.821 3.011 . . . . 34.63 108.485 175.683 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -50.64 -44.11 57.3 Favored 'General case' 0 C--N 1.308 -1.202 0 C-N-CA 125.218 1.407 . . . . 72.7 113.636 -174.638 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.455 ' HB2' ' O ' ' A' ' 655' ' ' HOH . 11.7 mmtp -66.93 -17.11 64.75 Favored 'General case' 0 CA--C 1.505 -0.788 0 CA-C-N 113.565 -1.652 . . . . 45.5 112.375 179.402 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' ASN . . . . . . . . . . . . . 83.3 m-20 -100.03 14.79 29.41 Favored 'General case' 0 C--O 1.271 2.206 0 CA-C-O 117.966 -1.016 . . . . 53.38 112.798 -178.353 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.526 ' HD3' ' CE2' ' A' ' 57' ' ' TRP . 23.1 mtt180 -104.26 138.98 19.68 Favored Pre-proline 0 CA--C 1.545 0.764 0 C-N-CA 124.957 1.303 . . . . 42.38 111.583 -179.199 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 17.3 Cg_endo -88.17 172.18 31.71 Favored 'Cis proline' 0 C--N 1.315 -1.193 0 CA-C-O 125.116 2.048 . . . . 33.32 110.307 -2.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 27.6 mt -54.03 112.62 0.99 Allowed 'General case' 0 C--O 1.255 1.38 0 CA-C-N 112.605 -2.088 . . . . 30.87 107.071 177.798 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 8.9 tttm -48.31 137.5 11.01 Favored 'General case' 0 C--N 1.302 -1.465 0 CA-C-N 113.86 -1.518 . . . . 73.77 110.694 -179.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' ASP . . . . . . . . . . . . . 41.1 m-20 68.07 14.98 9.42 Favored 'General case' 0 C--O 1.25 1.108 0 N-CA-C 117.757 2.502 . . . . 51.77 117.757 172.145 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' ARG . . . . . 0.706 HH12 ' NE2' ' A' ' 35' ' ' GLN . 16.8 mtm180 -136.41 154.3 50.84 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 104.473 -2.417 . . . . 32.82 104.473 178.161 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' ILE . . . . . 0.421 HD12 HG22 ' A' ' 109' ' ' VAL . 27.5 mt -86.75 113.09 23.9 Favored 'Isoleucine or valine' 0 N--CA 1.513 2.706 0 N-CA-C 104.161 -2.533 . . . . 32.09 104.161 177.393 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' ASN . . . . . 0.626 HD22 ' N ' ' A' ' 72' ' ' ASN . 0.8 OUTLIER -85.8 117.57 24.75 Favored 'General case' 0 C--O 1.261 1.664 0 O-C-N 124.728 1.268 . . . . 34.04 111.504 178.629 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' ILE . . . . . . . . . . . . . 73.6 mt -117.18 125.27 73.85 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.879 0 N-CA-C 105.818 -1.919 . . . . 27.5 105.818 174.964 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 86.6 t -104.64 143.53 15.99 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.961 0 C-N-CA 123.653 0.781 . . . . 33.68 110.127 175.5 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' LEU . . . . . 0.504 ' HA ' ' O ' ' A' ' 90' ' ' SER . 18.4 mt -107.22 140.77 39.57 Favored 'General case' 0 N--CA 1.483 1.221 0 N-CA-C 107.314 -1.365 . . . . 31.62 107.314 176.001 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' SER . . . . . . . . . . . . . 31.1 t -167.03 140.99 3.77 Favored 'General case' 0 C--N 1.304 -1.386 0 O-C-N 125.736 1.898 . . . . 34.11 106.881 178.025 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.876 ' HD2' ' O ' ' A' ' 393' ' ' HOH . 10.4 mtt180 -94.0 -12.15 29.29 Favored 'General case' 0 C--N 1.291 -1.972 0 O-C-N 125.498 1.749 . . . . 77.78 107.843 176.602 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 37.6 mt-10 -97.58 -47.68 5.55 Favored 'General case' 0 C--O 1.273 2.302 0 N-CA-C 116.764 2.135 . . . . 44.16 116.764 -177.433 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 35.1 mt -63.71 147.79 50.74 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 120.187 1.358 . . . . 40.4 110.272 -176.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 14.2 tptt -96.68 -29.22 13.93 Favored 'General case' 0 N--CA 1.485 1.284 0 O-C-N 127.647 3.092 . . . . 84.4 108.308 -177.999 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . . . -136.44 157.63 46.33 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 112.843 -1.981 . . . . 54.07 111.045 178.949 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.421 ' HA ' ' HD3' ' A' ' 83' ' ' PRO . . . -58.89 137.81 87.26 Favored Pre-proline 0 C--N 1.318 -0.765 0 C-N-CA 125.728 1.611 . . . . 44.21 108.417 176.927 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' A' ' 82' ' ' ALA . 18.4 Cg_exo -68.92 152.7 73.45 Favored 'Trans proline' 0 N--CA 1.497 1.688 1 N-CA-C 101.487 -4.082 . . . . 40.37 101.487 -179.439 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 6.6 tptp -52.2 119.59 4.55 Favored 'General case' 0 C--N 1.282 -2.33 0 O-C-N 126.932 2.645 . . . . 63.65 109.627 179.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' GLY . . . . . . . . . . . . . . . 97.41 -24.53 31.06 Favored Glycine 0 C--O 1.26 1.74 0 C-N-CA 126.601 2.048 . . . . 38.09 114.796 179.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' ALA . . . . . . . . . . . . . . . -67.09 151.81 46.93 Favored 'General case' 0 N--CA 1.507 2.393 0 N-CA-C 105.648 -1.982 . . . . 31.93 105.648 176.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' HIS . . . . . . . . . . . . . 39.9 m80 -84.09 -41.9 16.66 Favored 'General case' 0 C--O 1.248 1.019 0 O-C-N 124.908 1.38 . . . . 37.72 109.685 179.333 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' TYR . . . . . . . . . . . . . 96.9 m-85 -145.62 158.46 43.84 Favored 'General case' 0 C--O 1.249 1.076 0 C-N-CA 118.246 -1.382 . . . . 43.28 109.485 -179.27 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.579 HD12 ' N ' ' A' ' 90' ' ' SER . 5.4 tp -124.41 138.8 54.33 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 129.044 3.965 . . . . 40.48 105.026 179.959 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' SER . . . . . 0.579 ' N ' HD12 ' A' ' 89' ' ' LEU . 9.2 m -140.62 149.21 42.04 Favored 'General case' 0 C--N 1.313 -1.022 1 O-C-N 129.683 4.364 . . . . 37.8 112.188 178.512 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.754 ' HE3' ' O ' ' A' ' 279' ' ' HOH . 0.5 OUTLIER -85.6 -21.36 28.51 Favored 'General case' 0 C--O 1.265 1.872 0 O-C-N 126.012 2.07 . . . . 61.4 113.932 -176.224 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' SER . . . . . . . . . . . . . 83.0 p -156.28 170.36 22.44 Favored 'General case' 0 N--CA 1.514 2.773 0 CA-C-O 115.757 -2.068 . . . . 31.26 105.971 176.851 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.433 ' O ' ' HB3' ' A' ' 96' ' ' ALA . 20.2 tp -64.94 -37.83 88.93 Favored 'General case' 0 N--CA 1.504 2.248 0 O-C-N 126.938 2.649 . . . . 43.25 105.373 179.929 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -54.25 -54.23 42.94 Favored 'General case' 0 N--CA 1.485 1.286 0 O-C-N 128.333 3.521 . . . . 55.98 110.064 179.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' ASP . . . . . . . . . . . . . 54.3 m-20 -55.57 -42.95 75.44 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 126.234 2.209 . . . . 53.17 107.438 179.205 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' ALA . . . . . 0.433 ' HB3' ' O ' ' A' ' 93' ' ' LEU . . . -59.32 -48.9 79.9 Favored 'General case' 0 C--O 1.275 2.425 0 O-C-N 121.46 -0.775 . . . . 35.98 109.283 -179.64 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . 0.374 30.6 mt -65.25 -39.62 92.89 Favored 'General case' 0 N--CA 1.508 2.429 0 C-N-CA 115.567 -2.453 . . . . 38.28 111.533 -175.987 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -58.3 -49.79 75.89 Favored 'General case' 0 N--CA 1.478 0.959 0 N-CA-C 107.602 -1.259 . . . . 44.75 107.602 179.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 16.7 tp -52.68 -47.45 67.2 Favored 'General case' 0 C--N 1.319 -0.738 0 CA-C-O 122.276 1.036 . . . . 50.38 109.751 -179.708 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' LEU . . . . . 0.438 HD23 HD12 ' A' ' 105' ' ' LEU . 11.2 mt -55.01 -38.33 67.76 Favored 'General case' 0 C--O 1.246 0.895 0 CA-C-N 114.364 -1.289 . . . . 56.12 111.453 -175.789 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' ASP . . . . . . . . . . . . 0.281 76.8 m-20 -73.11 -23.29 60.48 Favored 'General case' 0 C--O 1.251 1.182 0 CA-C-O 116.297 -1.811 . . . . 68.32 112.959 177.746 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . 0.304 2.1 p -51.41 158.98 1.26 Allowed Pre-proline 0 N--CA 1.482 1.169 0 O-C-N 125.019 1.449 . . . . 68.34 108.113 -179.487 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' PRO . . . . . . . . . . . . . 32.0 Cg_exo -62.74 -45.09 14.55 Favored 'Trans proline' 0 C--O 1.258 1.514 0 C-N-CA 123.791 2.994 . . . . 76.02 113.616 -175.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' GLU . . . . . . . . . . . . . . . -51.67 -41.88 61.72 Favored 'General case' 0 C--O 1.259 1.598 0 N-CA-C 113.659 0.985 . . . . 83.04 113.659 179.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' LEU . . . . . 0.543 ' O ' ' N ' ' A' ' 108' ' ' LYS . 0.3 OUTLIER -90.17 -55.32 3.65 Favored 'General case' 0 C--N 1.324 -0.506 0 C-N-CA 124.814 1.246 . . . . 73.22 113.045 -178.551 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' LYS . . . . . 0.452 ' C ' ' O ' ' A' ' 105' ' ' LEU . . . -22.61 -55.78 0.03 OUTLIER 'General case' 0 C--O 1.253 1.262 0 CA-C-N 114.542 -1.208 . . . . 71.89 110.526 -176.737 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' SER . . . . . . . . . . . . . 3.3 p -75.93 -13.79 60.25 Favored 'General case' 0 C--O 1.264 1.836 0 N-CA-C 115.774 1.768 . . . . 71.87 115.774 -177.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' LYS . . . . . 0.613 ' NZ ' ' CB ' ' A' ' 108' ' ' LYS . 0.6 OUTLIER -100.36 -8.88 22.84 Favored 'General case' 0 C--O 1.249 1.058 0 N-CA-C 115.85 1.796 . . . . 75.43 115.85 -177.799 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' VAL . . . . . 0.421 HG22 HD12 ' A' ' 71' ' ' ILE . 77.9 t -119.77 127.71 75.88 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.381 0 N-CA-C 116.058 1.873 . . . . 40.89 116.058 -171.412 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 37.4 t0 -93.08 -83.85 0.3 Allowed 'General case' 0 N--CA 1.492 1.658 0 CA-C-N 112.714 -2.039 . . . . 42.36 108.029 177.695 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' MET . . . . . 0.887 ' HE2' HD21 ' A' ' 48' ' ' ASN . 18.2 mtm -101.59 147.38 26.48 Favored 'General case' 0 C--O 1.249 1.035 0 CA-C-O 124.295 1.998 . . . . 46.38 113.221 -177.286 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' VAL . . . . . . . . . . . . . 95.9 t -108.57 121.77 62.11 Favored 'Isoleucine or valine' 0 C--N 1.313 -1.017 0 CA-C-N 113.858 -1.519 . . . . 29.31 108.321 175.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' TRP . . . . . . . . . . . . . 87.7 m95 -116.09 136.8 52.7 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 127.551 3.032 . . . . 31.76 109.389 178.84 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ILE . . . . . 0.427 HG23 HG12 ' A' ' 120' ' ' VAL . 32.3 mm -100.06 123.9 53.18 Favored 'Isoleucine or valine' 0 C--O 1.253 1.281 0 N-CA-C 105.433 -2.062 . . . . 26.14 105.433 173.178 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' VAL . . . . . . . . . . . . 0.26 5.3 m -119.81 23.07 5.14 Favored 'Isoleucine or valine' 0 C--O 1.266 1.924 0 O-C-N 127.932 3.27 . . . . 22.55 114.904 -177.356 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' GLY . . . . . . . . . . . . . . . 87.54 -176.79 46.65 Favored Glycine 0 N--CA 1.483 1.806 0 O-C-N 127.111 2.757 . . . . 22.32 115.732 168.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' GLY . . . . . . . . . . . . . . . -85.79 -148.29 10.98 Favored Glycine 0 N--CA 1.406 -3.318 1 C-N-CA 132.595 4.902 . . . . 23.79 115.933 6.474 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' THR . . . . . 0.63 ' HB ' ' O ' ' A' ' 318' ' ' HOH . 84.8 m -46.58 -62.34 1.42 Allowed 'General case' 0 C--O 1.253 1.276 0 N-CA-C 115.774 1.768 . . . . 24.2 115.774 -173.617 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' ALA . . . . . . . . . . . . . . . -55.53 -41.32 73.01 Favored 'General case' 0 C--O 1.252 1.185 0 CA-C-O 116.876 -1.535 . . . . 35.16 111.086 179.781 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' VAL . . . . . 0.427 HG12 HG23 ' A' ' 114' ' ' ILE . 22.8 t -64.76 -47.52 88.3 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.779 0 C-N-CA 118.101 -1.439 . . . . 27.12 114.03 -179.757 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' TYR . . . . . . . . . . . . . 29.8 m-85 -57.63 -45.31 85.59 Favored 'General case' 0 C--O 1.212 -0.888 0 CA-C-O 117.173 -1.394 . . . . 25.9 107.367 179.051 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' LYS . . . . . . . . . . . . . 30.1 tttm -56.76 -54.58 44.72 Favored 'General case' 0 CA--C 1.543 0.706 0 O-C-N 127.514 3.009 . . . . 53.91 112.358 -177.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -51.57 -51.11 58.13 Favored 'General case' 0 C--N 1.311 -1.079 0 O-C-N 126.039 2.087 . . . . 29.55 107.949 178.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . -62.8 -43.66 98.2 Favored 'General case' 0 N--CA 1.485 1.292 0 O-C-N 126.609 2.443 . . . . 27.57 109.821 -176.724 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' MET . . . . . . . . . . . . 0.385 61.1 mtm -56.54 -40.69 75.55 Favored 'General case' 0 C--O 1.248 0.985 0 O-C-N 126.354 2.284 . . . . 52.73 114.276 177.565 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' GLU . . . . . . . . . . . . . 8.5 mt-10 -76.2 -18.82 58.89 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 115.664 1.727 . . . . 57.52 115.664 -179.952 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' LYS . . . . . 0.543 ' HB3' HG23 ' A' ' 129' ' ' ILE . 5.5 mmtp -59.29 125.94 80.44 Favored Pre-proline 0 C--N 1.294 -1.817 0 C-N-CA 126.243 1.817 . . . . 61.88 106.308 174.61 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -84.29 69.74 6.13 Favored 'Trans proline' 0 C--N 1.317 -1.088 0 N-CA-C 105.372 -2.588 . . . . 49.03 105.372 179.286 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' ILE . . . . . 1.079 HD11 ' HA ' ' A' ' 3' ' ' SER . 0.0 OUTLIER -135.74 162.71 36.53 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.283 0 CA-C-N 112.576 -2.102 . . . . 52.37 105.448 174.853 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' ASN . . . . . 0.923 ' N ' HG13 ' A' ' 129' ' ' ILE . 4.1 m-20 -64.25 130.93 45.81 Favored 'General case' 0 C--N 1.295 -1.802 1 O-C-N 130.009 4.568 . . . . 53.66 105.701 179.543 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' HIS . . . . . . . . . . . . . 4.7 t-160 -150.21 132.45 15.45 Favored 'General case' 0 C--O 1.253 1.281 0 O-C-N 126.622 2.451 . . . . 30.58 111.801 -172.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' ARG . . . . . 0.564 ' NH1' ' OE1' ' A' ' 183' ' ' GLN . 42.8 mtm-85 -117.1 128.06 54.76 Favored 'General case' 0 CA--C 1.558 1.253 0 CA-C-N 112.896 -1.956 . . . . 57.38 107.662 176.12 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' LEU . . . . . . . . . . . . . 13.1 tp -114.5 116.03 28.18 Favored 'General case' 0 C--N 1.3 -1.557 0 CA-C-N 112.321 -2.218 . . . . 29.04 110.101 -175.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' PHE . . . . . 0.436 ' CE2' ' HE3' ' A' ' 37' ' ' MET . 51.4 m-85 -101.6 105.97 16.98 Favored 'General case' 0 C--N 1.308 -1.198 0 O-C-N 126.147 2.154 . . . . 26.89 105.324 179.448 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' VAL . . . . . . . . . . . . . 61.2 t -111.64 133.68 56.5 Favored 'Isoleucine or valine' 0 C--O 1.264 1.861 0 O-C-N 127.548 3.03 . . . . 27.92 108.758 179.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' THR . . . . . . . . . . . . . 78.4 m -104.86 116.88 32.74 Favored 'General case' 0 C--O 1.271 2.223 0 N-CA-C 105.08 -2.193 . . . . 18.67 105.08 171.437 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' ARG . . . . . . . . . . . . . 5.5 mtt180 -92.6 105.13 17.35 Favored 'General case' 0 C--O 1.257 1.492 0 O-C-N 127.208 2.818 . . . . 35.2 113.403 176.505 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' ILE . . . . . . . . . . . . . 4.3 mt -89.68 116.23 30.71 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.561 0 N-CA-C 106.529 -1.656 . . . . 25.84 106.529 179.108 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' LEU . . . . . 0.699 ' C ' ' CD2' ' A' ' 140' ' ' HIS . 33.5 mt -80.08 53.18 1.67 Allowed 'General case' 0 C--N 1.298 -1.655 0 C-N-CA 126.284 1.834 . . . . 34.22 111.829 -171.07 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' HIS . . . . . 0.815 ' O ' ' HB3' ' A' ' 11' ' ' CYS . 26.1 m-70 -157.69 160.51 38.02 Favored 'General case' 0 C--N 1.285 -2.207 0 O-C-N 125.993 2.058 . . . . 61.17 106.336 -178.892 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' GLU . . . . . . . . . . . . . 83.0 mt-10 -113.35 126.13 55.03 Favored 'General case' 0 C--N 1.311 -1.084 0 O-C-N 125.294 1.621 . . . . 74.83 108.335 -177.589 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' PHE . . . . . 0.531 ' HD1' ' SG ' ' A' ' 11' ' ' CYS . 4.7 m-85 -125.8 149.54 48.52 Favored 'General case' 0 CA--C 1.551 0.999 0 O-C-N 127.422 2.951 . . . . 45.52 105.668 174.969 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 143' ' ' GLU . . . . . . . . . . . . 0.312 16.8 pt-20 -60.8 127.57 32.25 Favored 'General case' 0 N--CA 1.469 0.513 0 O-C-N 126.581 2.425 . . . . 75.2 109.888 175.126 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 144' ' ' SER . . . . . . . . . . . . . 2.6 m -135.31 144.35 46.69 Favored 'General case' 0 C--N 1.313 -1.011 0 CA-C-N 113.734 -1.576 . . . . 31.33 108.028 -178.116 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 145' ' ' ASP . . . . . . . . . . . . . 39.7 p30 -114.55 -2.72 13.07 Favored 'General case' 0 N--CA 1.481 1.098 0 O-C-N 126.055 2.097 . . . . 36.18 108.066 177.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 146' ' ' THR . . . . . . . . . . . . . 78.6 m -132.38 147.37 52.38 Favored 'General case' 0 N--CA 1.486 1.339 0 CA-C-O 114.591 -2.623 . . . . 27.3 106.835 -179.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 147' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -137.94 156.84 47.45 Favored 'General case' 0 C--N 1.323 -0.579 0 O-C-N 128.835 3.834 . . . . 35.03 114.56 -174.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' PHE . . . . . 0.475 ' CD1' ' HD2' ' A' ' 149' ' ' PRO . 39.9 t80 -80.54 134.67 54.09 Favored Pre-proline 0 N--CA 1.42 -1.959 0 CA-C-N 110.534 -3.03 . . . . 25.63 107.886 179.421 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' PRO . . . . . 0.475 ' HD2' ' CD1' ' A' ' 148' ' ' PHE . 10.4 Cg_endo -64.25 162.81 28.55 Favored 'Trans proline' 0 N--CA 1.493 1.472 0 O-C-N 126.358 2.767 . . . . 29.98 108.581 178.818 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' GLU . . . . . . . . . . . . . 8.2 mt-10 -68.72 128.73 37.71 Favored 'General case' 0 C--N 1.307 -1.275 0 C-N-CA 125.142 1.377 . . . . 56.59 113.353 178.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' ILE . . . . . 0.912 ' C ' HD12 ' A' ' 151' ' ' ILE 0.348 0.0 OUTLIER -88.82 126.62 41.91 Favored 'Isoleucine or valine' 0 C--O 1.252 1.234 0 CA-C-O 123.63 1.681 . . . . 45.92 109.643 177.069 . . . . . . . . 4 4 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' ASP . . . . . 0.847 ' N ' HD12 ' A' ' 151' ' ' ILE 0.257 42.6 t0 -72.88 92.67 1.63 Allowed 'General case' 0 N--CA 1.44 -0.938 0 C-N-CA 124.474 1.11 . . . . 37.62 109.06 175.734 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' TYR . . . . . 0.71 ' CE1' HG13 ' A' ' 151' ' ' ILE . 21.9 m-30 -56.76 -12.2 1.77 Allowed 'General case' 0 C--O 1.254 1.308 0 O-C-N 126.434 2.334 . . . . 38.54 112.09 179.413 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' LYS . . . . . 0.71 ' HB2' ' OD1' ' A' ' 152' ' ' ASP . 6.7 mtmm -79.73 -40.97 27.67 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 126.614 2.446 . . . . 43.75 108.882 177.532 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 92.8 m-20 -85.96 -46.92 10.09 Favored 'General case' 0 C--O 1.248 1.006 0 N-CA-C 114.235 1.198 . . . . 47.77 114.235 179.57 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.732 ' HB2' ' CD1' ' A' ' 151' ' ' ILE . 78.4 m-85 -93.83 104.82 16.87 Favored 'General case' 0 C--N 1.313 -0.985 0 CA-C-N 115.567 -0.742 . . . . 37.16 109.082 -176.863 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' LYS . . . . . . . . . . . . . 15.1 mmtt -92.3 132.95 36.29 Favored 'General case' 0 C--N 1.309 -1.156 0 O-C-N 127.592 3.058 . . . . 73.68 107.746 177.014 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 13.8 tp -78.07 121.37 24.18 Favored 'General case' 0 C--O 1.254 1.292 0 O-C-N 126.774 2.546 . . . . 38.98 107.573 -178.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' LEU . . . . . . . . . . . . . 17.2 mt -73.95 149.13 41.56 Favored 'General case' 0 CA--C 1.548 0.903 0 O-C-N 125.254 1.596 . . . . 43.59 106.914 173.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' THR . . . . . . . . . . . . . 41.8 p -86.62 -18.75 30.6 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 113.348 -1.751 . . . . 53.2 109.569 176.976 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' GLU . . . . . 0.409 ' HG2' ' N ' ' A' ' 162' ' ' TYR . 5.2 tt0 -159.14 149.23 19.17 Favored 'General case' 0 C--O 1.25 1.125 0 O-C-N 124.809 1.318 . . . . 76.98 112.472 177.125 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' TYR . . . . . 0.409 ' N ' ' HG2' ' A' ' 161' ' ' GLU . 32.3 t80 -149.96 134.37 9.25 Favored Pre-proline 0 C--N 1.327 -0.379 0 CA-C-O 122.375 1.083 . . . . 46.92 109.717 178.888 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' PRO . . . . . 0.403 ' HD3' ' HA ' ' A' ' 162' ' ' TYR . 80.1 Cg_exo -48.87 112.12 0.59 Allowed 'Trans proline' 0 C--O 1.255 1.35 0 C-N-CA 122.194 1.93 . . . . 52.65 115.749 178.522 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' GLY . . . . . . . . . . . . . . . 88.76 11.07 66.26 Favored Glycine 0 C--O 1.264 1.981 0 C-N-CA 120.232 -0.985 . . . . 51.8 113.444 174.198 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' VAL . . . . . . . . . . . . . 13.4 t -113.62 112.07 48.63 Favored Pre-proline 0 N--CA 1.489 1.481 0 N-CA-C 106.045 -1.835 . . . . 43.38 106.045 176.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_exo -46.95 144.63 8.08 Favored 'Trans proline' 0 N--CA 1.513 2.636 0 O-C-N 124.955 2.029 . . . . 40.06 107.798 -179.101 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' ALA . . . . . . . . . . . . . . . -90.84 -42.11 10.82 Favored 'General case' 0 C--O 1.255 1.361 0 N-CA-C 114.919 1.451 . . . . 48.2 114.919 -179.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' ASP . . . . . 0.495 ' HB3' ' O ' ' A' ' 368' ' ' HOH . 23.8 m-20 -68.61 163.28 24.04 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.442 1.097 . . . . 75.04 111.075 -175.209 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' ILE . . . . . . . . . . . . . 3.9 mt -68.63 132.34 32.99 Favored 'Isoleucine or valine' 0 CA--C 1.565 1.551 0 N-CA-C 105.625 -1.991 . . . . 46.16 105.625 171.655 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' GLN . . . . . . . . . . . . . 31.1 mm-40 -95.66 161.87 13.86 Favored 'General case' 0 C--N 1.305 -1.332 0 O-C-N 126.257 2.223 . . . . 38.7 107.204 177.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 171' ' ' GLU . . . . . . . . . . . . . 85.2 tt0 -141.49 139.41 33.29 Favored 'General case' 0 C--N 1.313 -0.996 0 N-CA-C 106.146 -1.798 . . . . 59.96 106.146 176.8 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 172' ' ' GLU . . . . . 0.495 ' OE1' ' HB2' ' A' ' 29' ' ' ASN 0.254 28.4 tt0 -158.31 141.14 14.69 Favored 'General case' 0 N--CA 1.522 3.13 0 N-CA-C 103.181 -2.896 . . . . 41.24 103.181 175.01 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 173' ' ' ASP . . . . . . . . . . . . . 15.7 m-20 46.84 37.17 4.51 Favored 'General case' 0 N--CA 1.428 -1.531 0 CA-C-O 113.284 -3.246 . . . . 38.88 112.153 -175.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 174' ' ' GLY . . . . . . . . . . . . . . . 79.8 2.95 88.98 Favored Glycine 0 C--N 1.289 -2.028 0 O-C-N 127.454 2.971 . . . . 26.58 113.598 175.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 175' ' ' ILE . . . . . 0.425 ' HA ' HD13 ' A' ' 175' ' ' ILE 0.279 46.5 mm -106.51 139.23 28.59 Favored 'Isoleucine or valine' 0 C--O 1.266 1.96 0 O-C-N 125.421 1.307 . . . . 31.72 109.852 179.274 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 176' ' ' GLN . . . . . . . . . . . . . 62.7 mt-30 -105.45 148.42 27.19 Favored 'General case' 0 N--CA 1.477 0.894 0 CA-C-O 122.084 0.945 . . . . 31.83 108.911 176.035 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 177' ' ' TYR . . . . . . . . . . . . . 22.7 p90 -153.89 160.2 42.06 Favored 'General case' 0 C--O 1.286 3.015 0 CA-C-N 112.812 -1.994 . . . . 30.03 108.248 -179.504 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 178' ' ' LYS . . . . . . . . . . . . . 4.6 pttp -137.8 141.65 40.85 Favored 'General case' 0 C--O 1.241 0.619 0 CA-C-O 123.916 1.817 . . . . 66.17 112.509 174.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 179' ' ' PHE . . . . . . . . . . . . . 64.2 m-85 -87.52 130.55 34.68 Favored 'General case' 0 C--N 1.311 -1.07 0 CA-C-N 112.701 -2.045 . . . . 30.83 108.742 176.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 180' ' ' GLU . . . . . . . . . . . . . 96.9 mt-10 -129.71 153.88 47.73 Favored 'General case' 0 C--N 1.297 -1.684 0 O-C-N 125.781 1.926 . . . . 35.31 109.397 174.37 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 181' ' ' VAL . . . . . . . . . . . . . 6.5 t -134.61 126.31 47.93 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.472 0 C-N-CA 127.893 2.477 . . . . 27.87 109.431 177.479 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 182' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -118.13 149.51 40.92 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 111.375 -2.648 . . . . 31.79 105.697 177.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 183' ' ' GLN . . . . . 0.564 ' OE1' ' NH1' ' A' ' 132' ' ' ARG . 16.5 tt0 -134.39 132.39 39.35 Favored 'General case' 0 C--N 1.321 -0.641 0 O-C-N 127.635 3.085 . . . . 58.57 112.014 -177.832 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 184' ' ' LYS . . . . . . . . . . . . . 19.6 tttt -114.59 121.13 42.49 Favored 'General case' 0 C--N 1.319 -0.756 0 O-C-N 128.326 3.516 . . . . 41.47 107.073 174.478 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 185' ' ' SER . . . . . . . . . . . . . 16.6 m -103.4 122.31 44.59 Favored 'General case' 0 C--N 1.317 -0.833 0 CA-C-N 113.601 -1.636 . . . . 61.0 110.584 -179.276 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 186' ' ' VAL . . . . . 0.532 ' CG2' ' C ' ' A' ' 129' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--O 1.26 1.628 1 CA-C-O 111.571 -4.062 . . . . 73.89 105.867 172.491 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 190' ' ' ' HG' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 191' ' ' NAP . . . . . 0.692 ' H2N' ' O ' ' A' ' 16' ' ' ILE . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 198' ' ' HBI . . . . . 0.635 ' H71' ' H4N' ' A' ' 191' ' ' NAP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 230' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 233' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 240' ' ' HOH . . . . . 0.682 ' O ' ' HE1' ' A' ' 111' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 257' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 265' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 278' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 279' ' ' HOH . . . . . 0.754 ' O ' ' HE3' ' A' ' 91' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 295' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 318' ' ' HOH . . . . . 0.63 ' O ' ' HB ' ' A' ' 118' ' ' THR . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 335' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 339' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 342' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 346' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 358' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 365' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 367' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 368' ' ' HOH . . . . . 0.495 ' O ' ' HB3' ' A' ' 168' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 379' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 392' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 393' ' ' HOH . . . . . 0.876 ' O ' ' HD2' ' A' ' 77' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 424' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 427' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 430' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 440' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 455' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 463' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 493' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 539' ' ' HOH . . . . . 0.434 ' O ' ' HB3' ' A' ' 140' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 546' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 547' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 551' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 584' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 585' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 601' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 602' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 603' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 604' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 605' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 606' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 607' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 608' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 609' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 610' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 611' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 612' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 613' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 614' ' ' HOH . . . . . 0.498 ' O ' ' HG3' ' A' ' 12' ' ' GLN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 615' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 617' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 618' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 619' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 620' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 621' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 622' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 623' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 624' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 626' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 627' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 630' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 637' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 644' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 647' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 648' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 652' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 655' ' ' HOH . . . . . 0.455 ' O ' ' HB2' ' A' ' 63' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 662' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 667' ' ' HOH . . . . . 0.9 ' O ' ' HD2' ' A' ' 55' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 670' ' ' HOH . . . . . 0.463 ' O ' ' HD2' ' A' ' 55' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 672' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 705' ' ' HOH . . . . . 0.564 ' O ' ' N ' ' A' ' 14' ' ' MET . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 733' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_