data_4mfr_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 4mfr _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 ' 2' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.748 0 N-CA-C 111.712 0.264 . . . . 70.8 111.712 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -138.93 162.36 35.04 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.552 1.316 . . . . 56.47 114.552 -173.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 57.3 pttt -165.06 158.66 17.04 Favored 'General case' 0 CA--C 1.503 -0.847 0 N-CA-C 107.046 -1.464 . . . . 55.05 107.046 174.236 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 84.4 t -57.74 142.0 14.01 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.677 0 N-CA-C 108.337 -0.986 . . . . 35.95 108.337 -178.123 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 88.97 -11.28 69.7 Favored Glycine 0 N--CA 1.447 -0.608 0 CA-C-O 119.254 -0.748 . . . . 36.94 113.957 179.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 53.2 m-20 -63.73 144.42 57.05 Favored 'General case' 0 C--O 1.246 0.88 0 CA-C-N 117.925 0.862 . . . . 36.06 111.942 177.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 32.2 m -103.41 139.28 39.0 Favored 'General case' 0 CA--C 1.552 1.044 0 CA-C-O 121.147 0.499 . . . . 33.98 110.687 169.136 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 30.3 m -138.15 163.12 29.89 Favored 'Isoleucine or valine' 0 C--O 1.251 1.181 0 CA-C-O 121.046 0.451 . . . . 25.87 110.71 177.872 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 59.1 t -87.23 116.39 29.49 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.936 0 C-N-CA 119.062 -1.055 . . . . 22.88 108.341 172.252 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -102.53 121.19 50.68 Favored Pre-proline 0 C--O 1.256 1.397 0 C-N-CA 120.722 -0.391 . . . . 23.37 111.428 176.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -84.72 104.95 0.96 Allowed 'Trans proline' 0 C--O 1.247 0.929 0 C-N-CA 124.449 3.433 . . . . 40.17 110.339 178.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 7.7 t-160 -87.9 80.75 7.71 Favored 'General case' 0 C--O 1.25 1.113 0 CA-C-N 115.381 -0.827 . . . . 28.74 111.293 -178.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 39.3 m80 -62.12 136.74 58.08 Favored 'General case' 0 C--O 1.251 1.151 0 N-CA-C 113.971 1.1 . . . . 28.49 113.971 173.366 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -163.18 178.03 38.98 Favored Glycine 0 C--N 1.332 0.318 0 N-CA-C 109.172 -1.571 . . . . 24.53 109.172 171.633 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ALA . . . . . . . . . . . . . . . -77.68 145.19 36.78 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-O 121.689 0.757 . . . . 25.52 110.787 -177.724 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -133.45 151.52 51.8 Favored 'General case' 0 C--O 1.249 1.055 0 N-CA-C 106.965 -1.494 . . . . 23.72 106.965 171.049 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.0 tp -122.47 136.02 54.8 Favored 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 106.298 -1.741 . . . . 31.44 106.298 -177.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 48.2 t -77.53 102.46 3.99 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 O-C-N 123.867 0.73 . . . . 31.21 110.712 172.284 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' GLU . . . . . 0.441 ' OE1' ' O ' ' A' ' 325' ' ' HOH . 28.2 mt-10 -91.48 -19.72 22.52 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 114.296 1.221 . . . . 42.28 114.296 -176.502 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -160.05 146.94 16.14 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 107.985 -1.117 . . . . 38.6 107.985 177.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 14.2 mt -118.9 104.2 15.61 Favored 'Isoleucine or valine' 0 C--O 1.239 0.529 0 CA-C-N 114.97 -1.014 . . . . 40.77 108.266 166.17 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLU . . . . . . . . . . . . . 23.5 pt-20 -86.49 139.83 30.51 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.376 -0.602 . . . . 27.59 109.376 -179.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 86.0 m -109.85 133.98 52.56 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.685 0.755 . . . . 49.71 111.028 -176.531 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.3 mtp180 -125.79 156.34 39.64 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-N 115.0 -1.0 . . . . 62.27 110.296 176.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' THR . . . . . . . . . . . . . 62.4 p -94.95 108.15 20.2 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 109.149 -0.686 . . . . 68.63 109.149 176.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ILE . . . . . . . . . . . . . 3.3 pt -128.46 120.94 54.11 Favored 'Isoleucine or valine' 0 C--O 1.239 0.501 0 N-CA-C 114.155 1.168 . . . . 102.21 114.155 -175.395 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 69.3 mttt 59.73 36.8 22.34 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 115.003 -0.998 . . . . 89.28 109.873 -179.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 84.71 -25.0 6.07 Favored Glycine 0 CA--C 1.524 0.633 0 CA-C-N 115.494 -0.775 . . . . 76.56 114.764 -176.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -93.37 167.05 11.98 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 114.059 1.133 . . . . 91.9 114.059 -177.61 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -98.23 117.49 32.73 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.952 -0.567 . . . . 69.65 110.377 175.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LYS . . . . . 0.441 ' NZ ' ' O ' ' A' ' 33' ' ' GLU . 0.2 OUTLIER -123.17 129.82 51.93 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 113.388 0.884 . . . . 94.38 113.388 -179.079 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' GLU . . . . . 0.441 ' O ' ' NZ ' ' A' ' 32' ' ' LYS . 0.1 OUTLIER -87.24 148.72 25.0 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 113.956 1.095 . . . . 57.8 113.956 -173.372 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 40.3 m-85 -123.32 135.85 54.4 Favored 'General case' 0 CA--C 1.502 -0.885 0 CA-C-N 115.06 -0.973 . . . . 42.1 109.432 173.209 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 45.2 mt -89.16 141.53 28.44 Favored 'General case' 0 C--O 1.254 1.305 0 C-N-CA 120.075 -0.65 . . . . 26.02 109.994 178.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 94.4 t -110.35 105.84 19.58 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 N-CA-C 107.906 -1.146 . . . . 33.07 107.906 168.978 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 84.0 mt -100.61 132.85 45.78 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 113.682 0.993 . . . . 27.15 113.682 -172.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 45.9 tttt -88.31 120.85 30.07 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 107.744 -1.206 . . . . 30.65 107.744 171.434 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 93.3 t -130.09 149.9 34.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.016 -0.538 . . . . 26.12 109.919 -173.359 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ALA . . . . . . . . . . . . . . . 55.27 40.5 31.6 Favored 'General case' 0 C--O 1.251 1.163 0 N-CA-C 113.686 0.995 . . . . 26.82 113.686 177.356 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 12.8 mp0 78.76 7.17 2.22 Favored 'General case' 0 CA--C 1.549 0.904 1 N-CA-C 124.291 4.922 . . . . 48.65 124.291 162.373 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' GLY . . . . . . . . . . . . . . . -123.98 113.25 2.01 Favored Glycine 0 N--CA 1.434 -1.487 0 C-N-CA 130.272 3.796 . . . . 33.92 106.392 -9.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -89.66 -6.22 56.36 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 108.04 -1.096 . . . . 41.53 108.04 172.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -126.77 134.13 50.67 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.127 -0.942 . . . . 25.39 111.509 -176.01 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 74.0 m -114.79 126.82 55.27 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 106.762 -1.57 . . . . 27.55 106.762 166.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 42.3 t -114.4 129.15 70.93 Favored 'Isoleucine or valine' 0 C--O 1.254 1.3 0 CA-C-O 121.832 0.825 . . . . 28.93 109.519 173.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 1.3 tmt_? -112.81 131.16 55.81 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-N 114.708 -1.133 . . . . 41.83 109.387 175.262 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 11.3 p -152.83 141.34 13.98 Favored Pre-proline 0 N--CA 1.477 0.906 0 CA-C-O 118.913 -0.565 . . . . 27.46 109.942 -168.068 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_exo -58.16 134.39 61.6 Favored 'Trans proline' 0 C--N 1.358 1.059 0 C-N-CA 121.587 1.525 . . . . 33.74 111.557 174.381 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.89 -22.05 63.26 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.645 1.35 . . . . 34.9 114.645 -176.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 17.6 pt-20 -82.91 -20.13 35.98 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 119.219 -0.992 . . . . 61.94 110.406 177.562 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -97.99 18.11 16.75 Favored 'General case' 0 C--O 1.241 0.643 0 C-N-CA 123.898 0.879 . . . . 86.87 111.276 -179.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -110.33 118.86 37.45 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.942 0.877 . . . . 65.53 110.705 -177.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 24.6 tp10 -125.78 73.26 1.33 Allowed 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 105.162 -2.162 . . . . 80.86 105.162 178.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -113.59 126.96 55.86 Favored 'General case' 0 C--O 1.243 0.76 0 N-CA-C 107.145 -1.428 . . . . 40.81 107.145 176.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 47.6 t -64.73 127.32 25.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 O-C-N 124.288 0.992 . . . . 35.12 111.846 178.259 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -77.42 155.93 44.27 Favored Glycine 0 C--O 1.24 0.495 0 C-N-CA 121.089 -0.577 . . . . 34.82 113.749 178.304 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 5.4 t -136.53 142.89 36.96 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 N-CA-C 106.951 -1.5 . . . . 36.31 106.951 179.254 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 32.6 mtm180 -58.71 145.87 38.59 Favored 'General case' 0 C--O 1.245 0.837 0 N-CA-C 116.655 2.095 . . . . 52.65 116.655 -172.651 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -59.25 -39.26 82.29 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 114.975 -1.011 . . . . 55.29 111.817 -176.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 2.4 p -59.92 -23.93 28.2 Favored 'Isoleucine or valine' 0 C--O 1.24 0.56 0 O-C-N 123.779 0.674 . . . . 50.59 112.642 -178.25 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 91.2 t -86.71 -52.01 12.32 Favored 'Isoleucine or valine' 0 C--O 1.248 0.987 0 C-N-CA 124.207 1.003 . . . . 37.34 110.518 172.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 71.42 177.88 27.73 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 121.066 -0.588 . . . . 34.54 114.149 171.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -64.57 -44.11 91.75 Favored 'General case' 0 CA--C 1.562 1.414 0 N-CA-C 113.834 1.05 . . . . 37.02 113.834 -176.74 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -66.98 -43.58 82.67 Favored 'General case' 0 C--O 1.222 -0.376 0 O-C-N 121.142 -0.974 . . . . 52.93 112.861 178.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -54.18 -49.94 57.68 Favored Glycine 0 C--O 1.245 0.789 0 O-C-N 123.932 0.77 . . . . 28.9 112.299 173.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 13.9 tp -60.76 -51.43 69.38 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 117.065 0.432 . . . . 24.0 110.646 179.809 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 32.5 m-20 -58.61 -35.36 72.35 Favored 'General case' 0 C--N 1.334 -0.074 0 C-N-CA 120.388 -0.525 . . . . 36.3 110.923 177.79 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 41.9 tptt -63.54 -44.4 94.29 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 116.801 -0.181 . . . . 36.84 111.446 175.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 44.6 t -56.32 -46.18 81.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 C-N-CA 120.719 -0.392 . . . . 27.24 110.707 175.877 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -60.71 -36.04 77.82 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 114.034 1.124 . . . . 29.84 114.034 176.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -69.3 -41.35 76.89 Favored 'General case' 0 N--CA 1.436 -1.162 0 C-N-CA 119.979 -0.689 . . . . 41.11 110.015 -175.7 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 18.1 t -59.37 -45.14 93.66 Favored 'Isoleucine or valine' 0 C--O 1.252 1.221 0 CA-C-N 115.283 -0.871 . . . . 27.52 111.823 175.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 57.5 mt -69.02 -27.61 65.83 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 119.905 -0.718 . . . . 21.26 110.256 -174.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 73.4 mtt180 -103.4 -1.19 28.99 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 112.168 0.433 . . . . 24.96 112.168 -170.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -53.66 127.63 51.58 Favored Pre-proline 0 C--O 1.251 1.161 0 N-CA-C 108.58 -0.896 . . . . 24.24 108.58 177.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 2.8 Cg_exo -82.78 -30.36 1.04 Allowed 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 124.196 3.264 . . . . 34.23 114.377 -170.386 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' HIS . . . . . 0.461 ' N ' ' O1 ' ' A' ' 221' ' ' SO4 . 34.6 m-70 -126.2 88.12 2.79 Favored 'General case' 0 CA--C 1.507 -0.682 0 N-CA-C 107.799 -1.186 . . . . 30.79 107.799 -170.263 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 67.8 p -100.43 163.46 12.36 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.316 -0.402 . . . . 46.46 110.283 -176.713 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 -122.32 126.5 48.22 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 107.537 -1.283 . . . . 82.43 107.537 171.091 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -130.54 138.34 32.82 Favored Pre-proline 0 C--O 1.242 0.7 0 C-N-CA 120.77 -0.372 . . . . 41.68 110.347 171.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -43.22 135.07 6.05 Favored 'Trans proline' 0 C--O 1.247 0.964 0 C-N-CA 123.219 2.613 . . . . 47.33 111.931 177.023 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -75.01 -34.91 61.99 Favored 'General case' 0 C--O 1.248 1.013 0 CA-C-N 115.843 -0.617 . . . . 56.71 111.633 -175.855 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -87.47 139.98 30.0 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 115.317 1.599 . . . . 52.74 115.317 -179.679 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' TRP . . . . . . . . . . . . . 54.2 t90 -54.39 -50.74 66.84 Favored 'General case' 0 C--O 1.253 1.283 0 N-CA-C 113.37 0.878 . . . . 25.83 113.37 -170.648 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 5.3 m -58.57 -48.77 79.82 Favored 'General case' 0 C--O 1.244 0.772 0 CA-C-N 116.216 -0.447 . . . . 34.61 111.933 -179.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ARG . . . . . 0.522 ' NH2' ' O2 ' ' A' ' 228' ' ' SO4 . 19.7 mtp180 -55.68 -51.03 68.64 Favored 'General case' 0 C--O 1.255 1.372 0 N-CA-C 107.292 -1.373 . . . . 49.31 107.292 178.608 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 28.7 ttp-105 -62.03 -48.88 78.3 Favored 'General case' 0 C--O 1.251 1.17 0 CA-C-N 114.834 -1.075 . . . . 32.81 109.711 -175.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 51.6 t80 -62.12 -38.14 87.8 Favored 'General case' 0 C--O 1.244 0.782 0 O-C-N 123.796 0.685 . . . . 31.08 112.563 -178.512 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 25.4 tttt -68.27 -45.99 71.61 Favored 'General case' 0 C--O 1.244 0.78 0 C-N-CA 120.664 -0.414 . . . . 43.58 109.896 -177.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -65.91 -43.19 88.89 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 119.232 -0.987 . . . . 24.55 109.451 -175.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 96.1 m-20 -58.82 -39.77 82.2 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 114.699 1.37 . . . . 30.65 114.699 172.507 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 12.4 tp -62.56 -36.89 84.1 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 119.576 -0.85 . . . . 40.46 109.311 -176.41 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.2 -46.55 70.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.189 0.518 . . . . 55.5 110.412 -179.436 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 91.9 mttt -51.39 -47.67 62.81 Favored 'General case' 0 C--O 1.266 1.924 0 CA-C-N 115.484 -0.78 . . . . 32.93 112.417 178.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 16.8 mt -61.46 -29.35 69.9 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-N 115.434 -0.803 . . . . 31.77 111.98 177.929 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -87.91 -7.45 57.15 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 113.136 0.791 . . . . 31.25 113.136 174.868 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 42.8 p -66.16 -23.44 66.47 Favored 'General case' 0 C--O 1.25 1.105 0 N-CA-C 114.834 1.42 . . . . 38.85 114.834 -169.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 71.1 3.36 51.97 Favored Glycine 0 CA--C 1.532 1.148 0 N-CA-C 115.017 0.767 . . . . 41.15 115.017 -169.726 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 62.1 t0 -101.34 109.36 21.19 Favored 'General case' 0 C--O 1.246 0.874 0 N-CA-C 108.294 -1.002 . . . . 40.22 108.294 174.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 10.7 p -59.62 -25.44 31.71 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 N-CA-C 111.968 0.358 . . . . 40.28 111.968 -177.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 78.9 m-20 -66.23 -37.53 85.75 Favored 'General case' 0 C--O 1.248 0.987 0 C-N-CA 118.678 -1.209 . . . . 30.52 110.105 176.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' LYS . . . . . . . . . . . . . 13.2 mmtt -61.87 -42.01 98.54 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 123.944 0.777 . . . . 40.21 111.341 175.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 81.8 t -62.31 -33.27 58.11 Favored 'Isoleucine or valine' 0 C--O 1.244 0.814 0 CA-C-O 121.46 0.648 . . . . 28.39 110.646 178.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -76.81 -23.72 52.79 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 115.807 -0.633 . . . . 22.36 110.268 -177.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -67.81 -39.28 83.98 Favored 'General case' 0 C--O 1.25 1.121 0 C-N-CA 118.86 -1.136 . . . . 27.48 108.739 173.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 54.8 t -68.16 -48.22 74.9 Favored 'Isoleucine or valine' 0 C--O 1.241 0.643 0 CA-C-N 115.776 -0.647 . . . . 22.7 111.319 -179.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 36.8 t -56.04 -48.21 79.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 CA-C-N 116.42 -0.355 . . . . 23.14 111.094 176.208 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 7.6 tmm_? -60.95 -56.87 15.96 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 114.334 1.235 . . . . 24.97 114.334 177.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -53.95 -46.41 71.58 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 113.931 1.086 . . . . 27.79 113.931 -179.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 68.7 mt -72.51 -39.05 67.9 Favored 'General case' 0 C--O 1.244 0.788 0 N-CA-C 114.463 1.283 . . . . 27.44 114.463 -177.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' TRP . . . . . . . . . . . . . 3.2 m95 -55.85 -35.64 66.65 Favored 'General case' 0 C--O 1.212 -0.921 0 CA-C-N 118.659 0.663 . . . . 43.67 111.886 171.363 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 88.2 mtt180 -81.09 -38.74 26.8 Favored 'General case' 0 CA--C 1.501 -0.925 0 N-CA-C 107.767 -1.197 . . . . 34.72 107.767 -170.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 56.1 ttm-85 -65.08 -36.89 85.75 Favored 'General case' 0 C--O 1.216 -0.677 0 N-CA-C 109.664 -0.495 . . . . 37.98 109.664 175.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -57.48 -39.98 77.58 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 119.478 -0.889 . . . . 55.0 111.979 177.049 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 80.9 mm-40 -73.99 -28.97 61.73 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-O 121.185 0.517 . . . . 57.17 112.252 -177.812 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -105.13 -53.66 2.62 Favored 'General case' 0 CA--C 1.551 1.0 0 N-CA-C 119.795 3.257 . . . . 66.85 119.795 -174.494 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' ARG . . . . . 0.678 ' NH2' ' O ' ' A' ' 331' ' ' HOH . 0.0 OUTLIER -100.28 -19.5 16.33 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.311 0.856 . . . . 79.28 113.311 175.007 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 84.74 163.05 36.03 Favored Glycine 0 C--O 1.26 1.769 0 N-CA-C 111.675 -0.57 . . . . 43.03 111.675 -167.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 36.2 mt -106.56 144.06 33.77 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 115.62 1.711 . . . . 34.18 115.62 -176.511 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 28.5 p -71.3 162.59 29.19 Favored 'General case' 0 C--O 1.25 1.107 0 C-N-CA 119.924 -0.71 . . . . 27.05 109.469 166.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.14 -44.47 75.11 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 119.868 -0.733 . . . . 34.59 112.369 -178.435 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -67.49 -34.61 84.91 Favored Glycine 0 C--O 1.258 1.644 0 N-CA-C 110.271 -1.132 . . . . 30.1 110.271 -178.396 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 75.5 mt-10 -71.88 -36.54 70.1 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-N 114.814 -0.693 . . . . 34.98 109.837 -178.126 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 79.5 tttt -60.17 -46.32 90.08 Favored 'General case' 0 C--N 1.329 -0.295 0 O-C-N 123.585 0.553 . . . . 54.1 110.085 174.607 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 22.0 mmt85 -66.49 -34.92 79.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.828 0.347 . . . . 49.72 111.901 -178.361 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 39.6 ttm -70.45 -41.29 73.01 Favored 'General case' 0 C--O 1.241 0.644 0 CA-C-N 116.08 -0.509 . . . . 30.22 109.964 -178.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 128' ' ' LEU . . . . . . . . . . . . . 29.3 tp -58.13 -40.98 82.68 Favored 'General case' 0 N--CA 1.464 0.247 0 O-C-N 123.585 0.553 . . . . 28.93 110.55 174.922 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -66.76 -39.52 87.91 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 119.899 -0.72 . . . . 22.18 109.556 179.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 4.2 tmtt? -67.77 -45.91 73.56 Favored 'General case' 0 N--CA 1.44 -0.928 0 N-CA-C 107.805 -1.183 . . . . 49.67 107.805 -176.013 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -63.01 -42.19 99.77 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.684 -0.689 . . . . 28.28 109.68 -176.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 132' ' ' ARG . . . . . . . . . . . . . 24.6 mtm180 -55.82 -44.91 78.35 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 114.536 1.31 . . . . 45.15 114.536 174.91 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -64.63 -38.22 90.26 Favored 'General case' 0 N--CA 1.479 0.988 0 O-C-N 123.5 0.5 . . . . 57.21 110.611 178.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 97.1 mt -66.6 -52.22 48.28 Favored 'Isoleucine or valine' 0 C--O 1.241 0.614 0 C-N-CA 120.654 -0.418 . . . . 35.71 110.502 178.919 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 25.2 tp -48.5 -54.92 12.48 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 120.6 -0.44 . . . . 27.62 111.184 175.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 136' ' ' VAL . . . . . . . . . . . . . 30.9 t -61.09 -47.38 93.83 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 N-CA-C 113.936 1.087 . . . . 35.51 113.936 -179.036 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -60.2 -32.88 77.8 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.439 -0.886 . . . . 36.1 113.174 -179.131 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 50.0 tp10 -70.36 -37.73 74.67 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 113.377 0.88 . . . . 49.49 113.377 175.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 8.4 mp -87.22 -51.52 5.93 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 113.99 1.107 . . . . 36.59 113.99 -177.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -53.28 144.82 15.28 Favored 'General case' 0 C--O 1.242 0.688 0 N-CA-C 112.668 0.618 . . . . 32.95 112.668 -176.621 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 141' ' ' LEU . . . . . . . . . . . . . 23.5 mt -72.44 150.31 43.45 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 123.608 0.568 . . . . 57.1 111.514 173.611 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.535 0 N-CA-C 112.284 0.476 . . . . 76.05 112.284 177.04 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.492 0 N-CA-C 112.315 0.487 . . . . 79.87 112.315 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 15.7 tptp -91.45 -10.31 41.39 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 106.885 -1.524 . . . . 119.56 106.885 169.994 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -83.96 -42.57 16.12 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.154 -0.93 . . . . 56.33 109.069 171.82 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 151' ' ' GLU . . . . . . . . . . . . . 12.0 mt-10 -65.24 -26.01 67.92 Favored 'General case' 0 C--O 1.22 -0.466 0 O-C-N 123.765 0.666 . . . . 63.04 109.808 -179.887 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 91.7 m -79.88 -44.44 20.45 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 113.278 0.844 . . . . 50.57 113.278 178.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 24.8 mt -63.78 -46.79 93.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 CA-C-O 121.768 0.794 . . . . 46.06 110.95 172.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 5.9 tp -59.19 -46.13 89.22 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 115.546 -0.752 . . . . 37.23 110.3 178.401 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -60.16 -38.36 82.93 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 113.625 0.972 . . . . 43.57 113.625 175.427 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -67.45 -41.39 84.77 Favored 'General case' 0 C--O 1.243 0.718 0 N-CA-C 114.12 1.156 . . . . 51.79 114.12 176.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 157' ' ' VAL . . . . . . . . . . . . . 26.6 t -66.15 -48.45 81.33 Favored 'Isoleucine or valine' 0 C--O 1.243 0.722 0 CA-C-N 115.023 -0.99 . . . . 25.56 110.176 -179.285 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 40.5 mt -63.33 -35.85 81.75 Favored 'General case' 0 C--O 1.248 0.979 0 C-N-CA 119.929 -0.708 . . . . 26.74 110.161 178.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -71.2 -42.35 69.08 Favored 'General case' 0 C--O 1.249 1.049 0 CA-C-O 121.584 0.706 . . . . 23.18 110.267 -177.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -59.22 -43.93 92.3 Favored 'General case' 0 C--O 1.253 1.262 0 N-CA-C 107.982 -1.118 . . . . 21.32 107.982 175.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -62.98 -33.75 76.06 Favored 'General case' 0 C--O 1.245 0.855 0 C-N-CA 119.951 -0.7 . . . . 24.54 111.182 -178.25 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -61.29 -30.19 70.33 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 119.828 -0.749 . . . . 31.18 111.732 -177.298 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -89.04 -10.29 48.07 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 116.106 -0.497 . . . . 30.5 111.999 -174.678 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 164' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -95.85 126.38 41.07 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.44 -0.504 . . . . 35.68 110.498 -177.666 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 30.2 m170 -92.35 120.94 33.36 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 119.41 -0.916 . . . . 41.18 109.288 172.201 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 12.1 m170 -102.55 126.11 49.5 Favored 'General case' 0 CA--C 1.504 -0.789 0 N-CA-C 113.702 1.001 . . . . 30.07 113.702 178.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 79.5 m-70 -115.1 122.86 47.43 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 115.183 -0.917 . . . . 24.13 113.172 172.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -95.15 132.09 40.47 Favored 'General case' 0 CA--C 1.501 -0.912 0 N-CA-C 113.218 0.821 . . . . 35.24 113.218 178.355 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 2.1 p80 -148.94 79.84 1.42 Allowed 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 114.684 -1.143 . . . . 29.25 111.352 177.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 170' ' ' HIS . . . . . 0.717 ' N ' ' O2 ' ' A' ' 219' ' ' SO4 . 41.2 m80 . . . . . 0 C--O 1.222 -0.345 0 N-CA-C 108.957 -0.757 . . . . 59.16 108.957 170.037 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 201' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 202' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 203' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 204' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 205' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 206' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 207' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 208' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 209' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 210' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 211' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 212' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 213' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 214' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 215' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 216' ' ' IOD . . . . . 0.4 ' I ' ' CD ' ' A' ' 32' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 217' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 218' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 219' ' ' SO4 . . . . . 0.717 ' O2 ' ' N ' ' A' ' 170' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 220' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 221' ' ' SO4 . . . . . 0.461 ' O1 ' ' N ' ' A' ' 78' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 222' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 223' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 224' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 225' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 226' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 227' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 228' ' ' SO4 . . . . . 0.522 ' O2 ' ' NH2' ' A' ' 87' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 229' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 230' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 325' ' ' HOH . . . . . 0.441 ' O ' ' OE1' ' A' ' 20' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 331' ' ' HOH . . . . . 0.678 ' O ' ' NH2' ' A' ' 118' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.748 0 N-CA-C 111.712 0.264 . . . . 70.799999999999997 111.712 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -138.93 162.36 35.04 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.552 1.316 . . . . 56.469999999999999 114.552 -173.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 57.3 pttt -165.06 158.66 17.04 Favored 'General case' 0 CA--C 1.503 -0.847 0 N-CA-C 107.046 -1.464 . . . . 55.049999999999997 107.046 174.236 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 84.4 t -57.74 142.0 14.01 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.677 0 N-CA-C 108.337 -0.986 . . . . 35.950000000000003 108.337 -178.123 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 88.97 -11.28 69.7 Favored Glycine 0 N--CA 1.447 -0.608 0 CA-C-O 119.254 -0.748 . . . . 36.939999999999998 113.957 179.028 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 53.2 m-20 -63.73 144.42 57.05 Favored 'General case' 0 C--O 1.246 0.88 0 CA-C-N 117.925 0.862 . . . . 36.060000000000002 111.942 177.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 32.2 m -103.41 139.28 39.0 Favored 'General case' 0 CA--C 1.552 1.044 0 CA-C-O 121.147 0.499 . . . . 33.979999999999997 110.687 169.136 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 30.3 m -138.15 163.12 29.89 Favored 'Isoleucine or valine' 0 C--O 1.251 1.181 0 CA-C-O 121.046 0.451 . . . . 25.870000000000001 110.71 177.872 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 59.1 t -87.23 116.39 29.49 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.936 0 C-N-CA 119.062 -1.055 . . . . 22.879999999999999 108.341 172.252 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -102.53 121.19 50.68 Favored Pre-proline 0 C--O 1.256 1.397 0 C-N-CA 120.722 -0.391 . . . . 23.370000000000001 111.428 176.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -84.72 104.95 0.96 Allowed 'Trans proline' 0 C--O 1.247 0.929 0 C-N-CA 124.449 3.433 . . . . 40.170000000000002 110.339 178.282 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 7.7 t-160 -87.9 80.75 7.71 Favored 'General case' 0 C--O 1.25 1.113 0 CA-C-N 115.381 -0.827 . . . . 28.739999999999998 111.293 -178.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 39.3 m80 -62.12 136.74 58.08 Favored 'General case' 0 C--O 1.251 1.151 0 N-CA-C 113.971 1.1 . . . . 28.489999999999998 113.971 173.366 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -163.18 178.03 38.98 Favored Glycine 0 C--N 1.332 0.318 0 N-CA-C 109.172 -1.571 . . . . 24.530000000000001 109.172 171.633 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ALA . . . . . 0.447 ' HB2' ' HB3' ' A' ' 67' ' ' LEU . . . -77.68 145.19 36.78 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-O 121.689 0.757 . . . . 25.52 110.787 -177.724 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -133.45 151.52 51.8 Favored 'General case' 0 C--O 1.249 1.055 0 N-CA-C 106.965 -1.494 . . . . 23.719999999999999 106.965 171.049 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.0 tp -122.47 136.02 54.8 Favored 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 106.298 -1.741 . . . . 31.440000000000001 106.298 -177.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 48.2 t -77.53 102.46 3.99 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 O-C-N 123.867 0.73 . . . . 31.210000000000001 110.712 172.284 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' GLU . . . . . 0.441 ' OE1' ' O ' ' A' ' 325' ' ' HOH . 28.2 mt-10 -91.48 -19.72 22.52 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 114.296 1.221 . . . . 42.280000000000001 114.296 -176.502 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -160.05 146.94 16.14 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 107.985 -1.117 . . . . 38.600000000000001 107.985 177.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 14.2 mt -118.9 104.2 15.61 Favored 'Isoleucine or valine' 0 C--O 1.239 0.529 0 CA-C-N 114.97 -1.014 . . . . 40.770000000000003 108.266 166.17 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLU . . . . . 0.56 ' CG ' ' HB2' ' A' ' 34' ' ' TYR . 23.5 pt-20 -86.49 139.83 30.51 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.376 -0.602 . . . . 27.59 109.376 -179.249 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 86.0 m -109.85 133.98 52.56 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.685 0.755 . . . . 49.710000000000001 111.028 -176.531 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.3 mtp180 -125.79 156.34 39.64 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-N 115.0 -1.0 . . . . 62.270000000000003 110.296 176.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' THR . . . . . 0.504 HG22 ' OE1' ' A' ' 31' ' ' GLN . 62.4 p -94.95 108.15 20.2 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 109.149 -0.686 . . . . 68.629999999999995 109.149 176.935 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ILE . . . . . 0.617 HG12 ' HB3' ' A' ' 32' ' ' LYS . 3.3 pt -128.46 120.94 54.11 Favored 'Isoleucine or valine' 0 C--O 1.239 0.501 0 N-CA-C 114.155 1.168 . . . . 102.20999999999999 114.155 -175.395 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 69.3 mttt 59.73 36.8 22.34 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 115.003 -0.998 . . . . 89.280000000000001 109.873 -179.429 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 84.71 -25.0 6.07 Favored Glycine 0 CA--C 1.524 0.633 0 CA-C-N 115.494 -0.775 . . . . 76.560000000000002 114.764 -176.764 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -93.37 167.05 11.98 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 114.059 1.133 . . . . 91.900000000000006 114.059 -177.61 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 31' ' ' GLN . . . . . 0.504 ' OE1' HG22 ' A' ' 26' ' ' THR . 15.2 mm100 -98.23 117.49 32.73 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.952 -0.567 . . . . 69.650000000000006 110.377 175.98 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LYS . . . . . 0.682 ' HD2' ' I ' ' A' ' 216' ' ' IOD . 0.2 OUTLIER -123.17 129.82 51.93 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 113.388 0.884 . . . . 94.379999999999995 113.388 -179.079 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 33' ' ' GLU . . . . . 0.441 ' O ' ' NZ ' ' A' ' 32' ' ' LYS . 0.1 OUTLIER -87.24 148.72 25.0 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 113.956 1.095 . . . . 57.799999999999997 113.956 -173.372 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 34' ' ' TYR . . . . . 0.56 ' HB2' ' CG ' ' A' ' 23' ' ' GLU . 40.3 m-85 -123.32 135.85 54.4 Favored 'General case' 0 CA--C 1.502 -0.885 0 CA-C-N 115.06 -0.973 . . . . 42.100000000000001 109.432 173.209 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 45.2 mt -89.16 141.53 28.44 Favored 'General case' 0 C--O 1.254 1.305 0 C-N-CA 120.075 -0.65 . . . . 26.02 109.994 178.778 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 94.4 t -110.35 105.84 19.58 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 N-CA-C 107.906 -1.146 . . . . 33.07 107.906 168.978 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 84.0 mt -100.61 132.85 45.78 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 113.682 0.993 . . . . 27.149999999999999 113.682 -172.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 45.9 tttt -88.31 120.85 30.07 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 107.744 -1.206 . . . . 30.649999999999999 107.744 171.434 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' VAL . . . . . 0.498 ' HB ' ' HB3' ' A' ' 44' ' ' LEU . 93.3 t -130.09 149.9 34.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.016 -0.538 . . . . 26.120000000000001 109.919 -173.359 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ALA . . . . . 0.48 ' C ' ' HA2' ' A' ' 42' ' ' GLY . . . 55.27 40.5 31.6 Favored 'General case' 0 C--O 1.251 1.163 0 N-CA-C 113.686 0.995 . . . . 26.82 113.686 177.356 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLN . . . . . 0.527 ' N ' ' HA2' ' A' ' 42' ' ' GLY . 12.8 mp0 78.76 7.17 2.22 Favored 'General case' 0 CA--C 1.549 0.904 1 N-CA-C 124.291 4.922 . . . . 48.649999999999999 124.291 162.373 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 42' ' ' GLY . . . . . 0.527 ' HA2' ' N ' ' A' ' 41' ' ' GLN . . . -123.98 113.25 2.01 Favored Glycine 0 N--CA 1.434 -1.487 0 C-N-CA 130.272 3.796 . . . . 33.920000000000002 106.392 -9.396 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -89.66 -6.22 56.36 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 108.04 -1.096 . . . . 41.530000000000001 108.04 172.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' LEU . . . . . 0.498 ' HB3' ' HB ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -126.77 134.13 50.67 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.127 -0.942 . . . . 25.390000000000001 111.509 -176.01 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 74.0 m -114.79 126.82 55.27 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 106.762 -1.57 . . . . 27.550000000000001 106.762 166.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 42.3 t -114.4 129.15 70.93 Favored 'Isoleucine or valine' 0 C--O 1.254 1.3 0 CA-C-O 121.832 0.825 . . . . 28.93 109.519 173.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 1.3 tmt_? -112.81 131.16 55.81 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-N 114.708 -1.133 . . . . 41.829999999999998 109.387 175.262 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 11.3 p -152.83 141.34 13.98 Favored Pre-proline 0 N--CA 1.477 0.906 0 CA-C-O 118.913 -0.565 . . . . 27.460000000000001 109.942 -168.068 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_exo -58.16 134.39 61.6 Favored 'Trans proline' 0 C--N 1.358 1.059 0 C-N-CA 121.587 1.525 . . . . 33.740000000000002 111.557 174.381 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.89 -22.05 63.26 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.645 1.35 . . . . 34.899999999999999 114.645 -176.309 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLU . . . . . 0.616 ' HB3' ' HE2' ' A' ' 32' ' ' LYS . 17.6 pt-20 -82.91 -20.13 35.98 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 119.219 -0.992 . . . . 61.939999999999998 110.406 177.562 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -97.99 18.11 16.75 Favored 'General case' 0 C--O 1.241 0.643 0 C-N-CA 123.898 0.879 . . . . 86.870000000000005 111.276 -179.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -110.33 118.86 37.45 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.942 0.877 . . . . 65.530000000000001 110.705 -177.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 24.6 tp10 -125.78 73.26 1.33 Allowed 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 105.162 -2.162 . . . . 80.859999999999999 105.162 178.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -113.59 126.96 55.86 Favored 'General case' 0 C--O 1.243 0.76 0 N-CA-C 107.145 -1.428 . . . . 40.810000000000002 107.145 176.032 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 47.6 t -64.73 127.32 25.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 O-C-N 124.288 0.992 . . . . 35.119999999999997 111.846 178.259 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -77.42 155.93 44.27 Favored Glycine 0 C--O 1.24 0.495 0 C-N-CA 121.089 -0.577 . . . . 34.82 113.749 178.304 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 5.4 t -136.53 142.89 36.96 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 N-CA-C 106.951 -1.5 . . . . 36.310000000000002 106.951 179.254 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 32.6 mtm180 -58.71 145.87 38.59 Favored 'General case' 0 C--O 1.245 0.837 0 N-CA-C 116.655 2.095 . . . . 52.649999999999999 116.655 -172.651 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -59.25 -39.26 82.29 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 114.975 -1.011 . . . . 55.289999999999999 111.817 -176.314 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 2.4 p -59.92 -23.93 28.2 Favored 'Isoleucine or valine' 0 C--O 1.24 0.56 0 O-C-N 123.779 0.674 . . . . 50.590000000000003 112.642 -178.25 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 91.2 t -86.71 -52.01 12.32 Favored 'Isoleucine or valine' 0 C--O 1.248 0.987 0 C-N-CA 124.207 1.003 . . . . 37.340000000000003 110.518 172.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 71.42 177.88 27.73 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 121.066 -0.588 . . . . 34.539999999999999 114.149 171.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -64.57 -44.11 91.75 Favored 'General case' 0 CA--C 1.562 1.414 0 N-CA-C 113.834 1.05 . . . . 37.020000000000003 113.834 -176.74 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -66.98 -43.58 82.67 Favored 'General case' 0 C--O 1.222 -0.376 0 O-C-N 121.142 -0.974 . . . . 52.93 112.861 178.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -54.18 -49.94 57.68 Favored Glycine 0 C--O 1.245 0.789 0 O-C-N 123.932 0.77 . . . . 28.899999999999999 112.299 173.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 67' ' ' LEU . . . . . 0.447 ' HB3' ' HB2' ' A' ' 16' ' ' ALA . 13.9 tp -60.76 -51.43 69.38 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 117.065 0.432 . . . . 24.0 110.646 179.809 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 32.5 m-20 -58.61 -35.36 72.35 Favored 'General case' 0 C--N 1.334 -0.074 0 C-N-CA 120.388 -0.525 . . . . 36.299999999999997 110.923 177.79 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 41.9 tptt -63.54 -44.4 94.29 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 116.801 -0.181 . . . . 36.840000000000003 111.446 175.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 44.6 t -56.32 -46.18 81.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 C-N-CA 120.719 -0.392 . . . . 27.239999999999998 110.707 175.877 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -60.71 -36.04 77.82 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 114.034 1.124 . . . . 29.84 114.034 176.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -69.3 -41.35 76.89 Favored 'General case' 0 N--CA 1.436 -1.162 0 C-N-CA 119.979 -0.689 . . . . 41.109999999999999 110.015 -175.7 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 18.1 t -59.37 -45.14 93.66 Favored 'Isoleucine or valine' 0 C--O 1.252 1.221 0 CA-C-N 115.283 -0.871 . . . . 27.52 111.823 175.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 57.5 mt -69.02 -27.61 65.83 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 119.905 -0.718 . . . . 21.260000000000002 110.256 -174.461 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 73.4 mtt180 -103.4 -1.19 28.99 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 112.168 0.433 . . . . 24.960000000000001 112.168 -170.387 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ALA . . . . . 0.41 ' HA ' ' HD3' ' A' ' 77' ' ' PRO . . . -53.66 127.63 51.58 Favored Pre-proline 0 C--O 1.251 1.161 0 N-CA-C 108.58 -0.896 . . . . 24.239999999999998 108.58 177.995 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 77' ' ' PRO . . . . . 0.559 ' HD2' ' O1 ' ' A' ' 221' ' ' SO4 . 2.8 Cg_exo -82.78 -30.36 1.04 Allowed 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 124.196 3.264 . . . . 34.229999999999997 114.377 -170.386 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 34.6 m-70 -126.2 88.12 2.79 Favored 'General case' 0 CA--C 1.507 -0.682 0 N-CA-C 107.799 -1.186 . . . . 30.789999999999999 107.799 -170.263 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 67.8 p -100.43 163.46 12.36 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.316 -0.402 . . . . 46.460000000000001 110.283 -176.713 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 -122.32 126.5 48.22 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 107.537 -1.283 . . . . 82.430000000000007 107.537 171.091 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -130.54 138.34 32.82 Favored Pre-proline 0 C--O 1.242 0.7 0 C-N-CA 120.77 -0.372 . . . . 41.68 110.347 171.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -43.22 135.07 6.05 Favored 'Trans proline' 0 C--O 1.247 0.964 0 C-N-CA 123.219 2.613 . . . . 47.329999999999998 111.931 177.023 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -75.01 -34.91 61.99 Favored 'General case' 0 C--O 1.248 1.013 0 CA-C-N 115.843 -0.617 . . . . 56.710000000000001 111.633 -175.855 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 96.5 m-20 -87.47 139.98 30.0 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 115.317 1.599 . . . . 52.740000000000002 115.317 -179.679 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' TRP . . . . . . . . . . . . . 54.2 t90 -54.39 -50.74 66.84 Favored 'General case' 0 C--O 1.253 1.283 0 N-CA-C 113.37 0.878 . . . . 25.829999999999998 113.37 -170.648 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 5.3 m -58.57 -48.77 79.82 Favored 'General case' 0 C--O 1.244 0.772 0 CA-C-N 116.216 -0.447 . . . . 34.609999999999999 111.933 -179.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ARG . . . . . 0.522 ' NH2' ' O2 ' ' A' ' 228' ' ' SO4 . 19.7 mtp180 -55.68 -51.03 68.64 Favored 'General case' 0 C--O 1.255 1.372 0 N-CA-C 107.292 -1.373 . . . . 49.310000000000002 107.292 178.608 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 28.7 ttp-105 -62.03 -48.88 78.3 Favored 'General case' 0 C--O 1.251 1.17 0 CA-C-N 114.834 -1.075 . . . . 32.810000000000002 109.711 -175.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 51.6 t80 -62.12 -38.14 87.8 Favored 'General case' 0 C--O 1.244 0.782 0 O-C-N 123.796 0.685 . . . . 31.079999999999998 112.563 -178.512 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 25.4 tttt -68.27 -45.99 71.61 Favored 'General case' 0 C--O 1.244 0.78 0 C-N-CA 120.664 -0.414 . . . . 43.579999999999998 109.896 -177.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -65.91 -43.19 88.89 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 119.232 -0.987 . . . . 24.550000000000001 109.451 -175.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 96.1 m-20 -58.82 -39.77 82.2 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 114.699 1.37 . . . . 30.649999999999999 114.699 172.507 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 12.4 tp -62.56 -36.89 84.1 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 119.576 -0.85 . . . . 40.460000000000001 109.311 -176.41 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.2 -46.55 70.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.189 0.518 . . . . 55.5 110.412 -179.436 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 91.9 mttt -51.39 -47.67 62.81 Favored 'General case' 0 C--O 1.266 1.924 0 CA-C-N 115.484 -0.78 . . . . 32.93 112.417 178.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 16.8 mt -61.46 -29.35 69.9 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-N 115.434 -0.803 . . . . 31.77 111.98 177.929 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -87.91 -7.45 57.15 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 113.136 0.791 . . . . 31.25 113.136 174.868 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 42.8 p -66.16 -23.44 66.47 Favored 'General case' 0 C--O 1.25 1.105 0 N-CA-C 114.834 1.42 . . . . 38.850000000000001 114.834 -169.264 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 71.1 3.36 51.97 Favored Glycine 0 CA--C 1.532 1.148 0 N-CA-C 115.017 0.767 . . . . 41.149999999999999 115.017 -169.726 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ASP . . . . . 0.514 ' HB3' ' HG2' ' A' ' 103' ' ' LYS . 62.1 t0 -101.34 109.36 21.19 Favored 'General case' 0 C--O 1.246 0.874 0 N-CA-C 108.294 -1.002 . . . . 40.219999999999999 108.294 174.535 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 10.7 p -59.62 -25.44 31.71 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 N-CA-C 111.968 0.358 . . . . 40.280000000000001 111.968 -177.292 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 78.9 m-20 -66.23 -37.53 85.75 Favored 'General case' 0 C--O 1.248 0.987 0 C-N-CA 118.678 -1.209 . . . . 30.52 110.105 176.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 103' ' ' LYS . . . . . 0.514 ' HG2' ' HB3' ' A' ' 100' ' ' ASP . 13.2 mmtt -61.87 -42.01 98.54 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 123.944 0.777 . . . . 40.210000000000001 111.341 175.421 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 81.8 t -62.31 -33.27 58.11 Favored 'Isoleucine or valine' 0 C--O 1.244 0.814 0 CA-C-O 121.46 0.648 . . . . 28.390000000000001 110.646 178.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -76.81 -23.72 52.79 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 115.807 -0.633 . . . . 22.359999999999999 110.268 -177.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -67.81 -39.28 83.98 Favored 'General case' 0 C--O 1.25 1.121 0 C-N-CA 118.86 -1.136 . . . . 27.48 108.739 173.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 54.8 t -68.16 -48.22 74.9 Favored 'Isoleucine or valine' 0 C--O 1.241 0.643 0 CA-C-N 115.776 -0.647 . . . . 22.699999999999999 111.319 -179.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 36.8 t -56.04 -48.21 79.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 CA-C-N 116.42 -0.355 . . . . 23.140000000000001 111.094 176.208 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 7.6 tmm_? -60.95 -56.87 15.96 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 114.334 1.235 . . . . 24.969999999999999 114.334 177.749 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -53.95 -46.41 71.58 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 113.931 1.086 . . . . 27.789999999999999 113.931 -179.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 68.7 mt -72.51 -39.05 67.9 Favored 'General case' 0 C--O 1.244 0.788 0 N-CA-C 114.463 1.283 . . . . 27.440000000000001 114.463 -177.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' TRP . . . . . 0.513 ' HZ2' ' NH1' ' A' ' 132' ' ' ARG . 3.2 m95 -55.85 -35.64 66.65 Favored 'General case' 0 C--O 1.212 -0.921 0 CA-C-N 118.659 0.663 . . . . 43.670000000000002 111.886 171.363 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 88.2 mtt180 -81.09 -38.74 26.8 Favored 'General case' 0 CA--C 1.501 -0.925 0 N-CA-C 107.767 -1.197 . . . . 34.719999999999999 107.767 -170.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 56.1 ttm-85 -65.08 -36.89 85.75 Favored 'General case' 0 C--O 1.216 -0.677 0 N-CA-C 109.664 -0.495 . . . . 37.979999999999997 109.664 175.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -57.48 -39.98 77.58 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 119.478 -0.889 . . . . 55.0 111.979 177.049 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 80.9 mm-40 -73.99 -28.97 61.73 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-O 121.185 0.517 . . . . 57.170000000000002 112.252 -177.812 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -105.13 -53.66 2.62 Favored 'General case' 0 CA--C 1.551 1.0 0 N-CA-C 119.795 3.257 . . . . 66.849999999999994 119.795 -174.494 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' ARG . . . . . 0.678 ' NH2' ' O ' ' A' ' 331' ' ' HOH . 0.0 OUTLIER -100.28 -19.5 16.33 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.311 0.856 . . . . 79.280000000000001 113.311 175.007 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 84.74 163.05 36.03 Favored Glycine 0 C--O 1.26 1.769 0 N-CA-C 111.675 -0.57 . . . . 43.030000000000001 111.675 -167.989 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 36.2 mt -106.56 144.06 33.77 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 115.62 1.711 . . . . 34.18 115.62 -176.511 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 28.5 p -71.3 162.59 29.19 Favored 'General case' 0 C--O 1.25 1.107 0 C-N-CA 119.924 -0.71 . . . . 27.050000000000001 109.469 166.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.14 -44.47 75.11 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 119.868 -0.733 . . . . 34.590000000000003 112.369 -178.435 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -67.49 -34.61 84.91 Favored Glycine 0 C--O 1.258 1.644 0 N-CA-C 110.271 -1.132 . . . . 30.100000000000001 110.271 -178.396 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 75.5 mt-10 -71.88 -36.54 70.1 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-N 114.814 -0.693 . . . . 34.979999999999997 109.837 -178.126 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 79.5 tttt -60.17 -46.32 90.08 Favored 'General case' 0 C--N 1.329 -0.295 0 O-C-N 123.585 0.553 . . . . 54.100000000000001 110.085 174.607 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 22.0 mmt85 -66.49 -34.92 79.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.828 0.347 . . . . 49.719999999999999 111.901 -178.361 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 39.6 ttm -70.45 -41.29 73.01 Favored 'General case' 0 C--O 1.241 0.644 0 CA-C-N 116.08 -0.509 . . . . 30.219999999999999 109.964 -178.749 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 128' ' ' LEU . . . . . 0.5 ' O ' ' HG3' ' A' ' 132' ' ' ARG . 29.3 tp -58.13 -40.98 82.68 Favored 'General case' 0 N--CA 1.464 0.247 0 O-C-N 123.585 0.553 . . . . 28.93 110.55 174.922 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -66.76 -39.52 87.91 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 119.899 -0.72 . . . . 22.18 109.556 179.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 4.2 tmtt? -67.77 -45.91 73.56 Favored 'General case' 0 N--CA 1.44 -0.928 0 N-CA-C 107.805 -1.183 . . . . 49.670000000000002 107.805 -176.013 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -63.01 -42.19 99.77 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.684 -0.689 . . . . 28.280000000000001 109.68 -176.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 132' ' ' ARG . . . . . 0.513 ' NH1' ' HZ2' ' A' ' 112' ' ' TRP . 24.6 mtm180 -55.82 -44.91 78.35 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 114.536 1.31 . . . . 45.149999999999999 114.536 174.91 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -64.63 -38.22 90.26 Favored 'General case' 0 N--CA 1.479 0.988 0 O-C-N 123.5 0.5 . . . . 57.210000000000001 110.611 178.072 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 97.1 mt -66.6 -52.22 48.28 Favored 'Isoleucine or valine' 0 C--O 1.241 0.614 0 C-N-CA 120.654 -0.418 . . . . 35.710000000000001 110.502 178.919 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 25.2 tp -48.5 -54.92 12.48 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 120.6 -0.44 . . . . 27.620000000000001 111.184 175.782 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 136' ' ' VAL . . . . . 0.426 HG11 ' HB3' ' A' ' 151' ' ' GLU . 30.9 t -61.09 -47.38 93.83 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 N-CA-C 113.936 1.087 . . . . 35.509999999999998 113.936 -179.036 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -60.2 -32.88 77.8 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.439 -0.886 . . . . 36.100000000000001 113.174 -179.131 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 50.0 tp10 -70.36 -37.73 74.67 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 113.377 0.88 . . . . 49.490000000000002 113.377 175.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 8.4 mp -87.22 -51.52 5.93 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 113.99 1.107 . . . . 36.590000000000003 113.99 -177.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -53.28 144.82 15.28 Favored 'General case' 0 C--O 1.242 0.688 0 N-CA-C 112.668 0.618 . . . . 32.950000000000003 112.668 -176.621 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 141' ' ' LEU . . . . . . . . . . . . . 23.5 mt -72.44 150.31 43.45 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 123.608 0.568 . . . . 57.100000000000001 111.514 173.611 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.535 0 N-CA-C 112.284 0.476 . . . . 76.049999999999997 112.284 177.04 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.492 0 N-CA-C 112.315 0.487 . . . . 79.870000000000005 112.315 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 15.7 tptp -91.45 -10.31 41.39 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 106.885 -1.524 . . . . 119.56 106.885 169.994 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -83.96 -42.57 16.12 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.154 -0.93 . . . . 56.329999999999998 109.069 171.82 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 151' ' ' GLU . . . . . 0.426 ' HB3' HG11 ' A' ' 136' ' ' VAL . 12.0 mt-10 -65.24 -26.01 67.92 Favored 'General case' 0 C--O 1.22 -0.466 0 O-C-N 123.765 0.666 . . . . 63.039999999999999 109.808 -179.887 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 91.7 m -79.88 -44.44 20.45 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 113.278 0.844 . . . . 50.57 113.278 178.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 24.8 mt -63.78 -46.79 93.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 CA-C-O 121.768 0.794 . . . . 46.060000000000002 110.95 172.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 5.9 tp -59.19 -46.13 89.22 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 115.546 -0.752 . . . . 37.229999999999997 110.3 178.401 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -60.16 -38.36 82.93 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 113.625 0.972 . . . . 43.57 113.625 175.427 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -67.45 -41.39 84.77 Favored 'General case' 0 C--O 1.243 0.718 0 N-CA-C 114.12 1.156 . . . . 51.789999999999999 114.12 176.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 157' ' ' VAL . . . . . 0.5 ' HA ' ' O4 ' ' A' ' 229' ' ' SO4 . 26.6 t -66.15 -48.45 81.33 Favored 'Isoleucine or valine' 0 C--O 1.243 0.722 0 CA-C-N 115.023 -0.99 . . . . 25.559999999999999 110.176 -179.285 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 40.5 mt -63.33 -35.85 81.75 Favored 'General case' 0 C--O 1.248 0.979 0 C-N-CA 119.929 -0.708 . . . . 26.739999999999998 110.161 178.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -71.2 -42.35 69.08 Favored 'General case' 0 C--O 1.249 1.049 0 CA-C-O 121.584 0.706 . . . . 23.18 110.267 -177.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -59.22 -43.93 92.3 Favored 'General case' 0 C--O 1.253 1.262 0 N-CA-C 107.982 -1.118 . . . . 21.32 107.982 175.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -62.98 -33.75 76.06 Favored 'General case' 0 C--O 1.245 0.855 0 C-N-CA 119.951 -0.7 . . . . 24.539999999999999 111.182 -178.25 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -61.29 -30.19 70.33 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 119.828 -0.749 . . . . 31.18 111.732 -177.298 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -89.04 -10.29 48.07 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 116.106 -0.497 . . . . 30.5 111.999 -174.678 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 164' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -95.85 126.38 41.07 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.44 -0.504 . . . . 35.68 110.498 -177.666 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 30.2 m170 -92.35 120.94 33.36 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 119.41 -0.916 . . . . 41.18 109.288 172.201 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 12.1 m170 -102.55 126.11 49.5 Favored 'General case' 0 CA--C 1.504 -0.789 0 N-CA-C 113.702 1.001 . . . . 30.07 113.702 178.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 79.5 m-70 -115.1 122.86 47.43 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 115.183 -0.917 . . . . 24.129999999999999 113.172 172.987 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -95.15 132.09 40.47 Favored 'General case' 0 CA--C 1.501 -0.912 0 N-CA-C 113.218 0.821 . . . . 35.240000000000002 113.218 178.355 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 2.1 p80 -148.94 79.84 1.42 Allowed 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 114.684 -1.143 . . . . 29.25 111.352 177.561 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 170' ' ' HIS . . . . . 0.617 ' N ' ' O2 ' ' A' ' 219' ' ' SO4 . 41.2 m80 . . . . . 0 C--O 1.222 -0.345 0 N-CA-C 108.957 -0.757 . . . . 59.159999999999997 108.957 170.037 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 201' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 202' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 203' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 204' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 205' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 206' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 207' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 208' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 209' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 210' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 211' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 212' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 213' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 214' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 215' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 216' ' ' IOD . . . . . 0.682 ' I ' ' HD2' ' A' ' 32' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 217' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 218' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 219' ' ' SO4 . . . . . 0.617 ' O2 ' ' N ' ' A' ' 170' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 220' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 221' ' ' SO4 . . . . . 0.559 ' O1 ' ' HD2' ' A' ' 77' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 222' ' ' SO4 . . . . . 0.433 ' O4 ' ' HG3' ' A' ' 33' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 223' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 224' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 225' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 226' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 227' ' ' SO4 . . . . . 0.49 ' O2 ' ' HG ' ' A' ' 128' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 228' ' ' SO4 . . . . . 0.522 ' O2 ' ' NH2' ' A' ' 87' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 229' ' ' SO4 . . . . . 0.5 ' O4 ' ' HA ' ' A' ' 157' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 230' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 325' ' ' HOH . . . . . 0.441 ' O ' ' OE1' ' A' ' 20' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 331' ' ' HOH . . . . . 0.678 ' O ' ' NH2' ' A' ' 118' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.243 0.748 0 N-CA-C 111.712 0.264 . . . . 70.799999999999997 111.712 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -138.93 162.36 35.04 Favored 'General case' 0 N--CA 1.473 0.689 0 N-CA-C 114.552 1.316 . . . . 56.469999999999999 114.552 -173.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 57.3 pttt -165.06 158.66 17.04 Favored 'General case' 0 CA--C 1.503 -0.847 0 N-CA-C 107.046 -1.464 . . . . 55.049999999999997 107.046 174.236 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 84.4 t -57.74 142.0 14.01 Favored 'Isoleucine or valine' 0 N--CA 1.445 -0.677 0 N-CA-C 108.337 -0.986 . . . . 35.950000000000003 108.337 -178.123 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' GLY . . . . . . . . . . . . . . . 88.97 -11.28 69.7 Favored Glycine 0 N--CA 1.447 -0.608 0 CA-C-O 119.254 -0.748 . . . . 36.939999999999998 113.957 179.028 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 53.2 m-20 -63.73 144.42 57.05 Favored 'General case' 0 C--O 1.246 0.88 0 CA-C-N 117.925 0.862 . . . . 36.060000000000002 111.942 177.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 32.2 m -103.41 139.28 39.0 Favored 'General case' 0 CA--C 1.552 1.044 0 CA-C-O 121.147 0.499 . . . . 33.979999999999997 110.687 169.136 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 30.3 m -138.15 163.12 29.89 Favored 'Isoleucine or valine' 0 C--O 1.251 1.181 0 CA-C-O 121.046 0.451 . . . . 25.870000000000001 110.71 177.872 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' VAL . . . . . . . . . . . . . 59.1 t -87.23 116.39 29.49 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.936 0 C-N-CA 119.062 -1.055 . . . . 22.879999999999999 108.341 172.252 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -102.53 121.19 50.68 Favored Pre-proline 0 C--O 1.256 1.397 0 C-N-CA 120.722 -0.391 . . . . 23.370000000000001 111.428 176.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 69.1 Cg_endo -84.72 104.95 0.96 Allowed 'Trans proline' 0 C--O 1.247 0.929 0 C-N-CA 124.449 3.433 . . . . 40.170000000000002 110.339 178.282 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' HIS . . . . . . . . . . . . . 7.7 t-160 -87.9 80.75 7.71 Favored 'General case' 0 C--O 1.25 1.113 0 CA-C-N 115.381 -0.827 . . . . 28.739999999999998 111.293 -178.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 39.3 m80 -62.12 136.74 58.08 Favored 'General case' 0 C--O 1.251 1.151 0 N-CA-C 113.971 1.1 . . . . 28.489999999999998 113.971 173.366 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -163.18 178.03 38.98 Favored Glycine 0 C--N 1.332 0.318 0 N-CA-C 109.172 -1.571 . . . . 24.530000000000001 109.172 171.633 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ALA . . . . . 0.447 ' HB2' ' HB3' ' A' ' 67' ' ' LEU . . . -77.68 145.19 36.78 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-O 121.689 0.757 . . . . 25.52 110.787 -177.724 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -133.45 151.52 51.8 Favored 'General case' 0 C--O 1.249 1.055 0 N-CA-C 106.965 -1.494 . . . . 23.719999999999999 106.965 171.049 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 40.0 tp -122.47 136.02 54.8 Favored 'General case' 0 N--CA 1.442 -0.849 0 N-CA-C 106.298 -1.741 . . . . 31.440000000000001 106.298 -177.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' VAL . . . . . . . . . . . . . 48.2 t -77.53 102.46 3.99 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 O-C-N 123.867 0.73 . . . . 31.210000000000001 110.712 172.284 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' GLU . . . . . 0.441 ' OE1' ' O ' ' A' ' 325' ' ' HOH . 28.2 mt-10 -91.48 -19.72 22.52 Favored 'General case' 0 N--CA 1.478 0.936 0 N-CA-C 114.296 1.221 . . . . 42.280000000000001 114.296 -176.502 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -160.05 146.94 16.14 Favored 'General case' 0 C--O 1.241 0.628 0 N-CA-C 107.985 -1.117 . . . . 38.600000000000001 107.985 177.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' ILE . . . . . . . . . . . . . 14.2 mt -118.9 104.2 15.61 Favored 'Isoleucine or valine' 0 C--O 1.239 0.529 0 CA-C-N 114.97 -1.014 . . . . 40.770000000000003 108.266 166.17 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLU . . . . . 0.56 ' CG ' ' HB2' ' A' ' 34' ' ' TYR . 23.5 pt-20 -86.49 139.83 30.51 Favored 'General case' 0 C--N 1.329 -0.286 0 N-CA-C 109.376 -0.602 . . . . 27.59 109.376 -179.249 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 86.0 m -109.85 133.98 52.56 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.685 0.755 . . . . 49.710000000000001 111.028 -176.531 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 14.3 mtp180 -125.79 156.34 39.64 Favored 'General case' 0 C--O 1.241 0.634 0 CA-C-N 115.0 -1.0 . . . . 62.270000000000003 110.296 176.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' THR . . . . . 0.504 HG22 ' OE1' ' A' ' 31' ' ' GLN . 62.4 p -94.95 108.15 20.2 Favored 'General case' 0 CA--C 1.536 0.415 0 N-CA-C 109.149 -0.686 . . . . 68.629999999999995 109.149 176.935 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ILE . . . . . 0.617 HG12 ' HB3' ' A' ' 32' ' ' LYS . 3.3 pt -128.46 120.94 54.11 Favored 'Isoleucine or valine' 0 C--O 1.239 0.501 0 N-CA-C 114.155 1.168 . . . . 102.20999999999999 114.155 -175.395 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' LYS . . . . . . . . . . . . . 69.3 mttt 59.73 36.8 22.34 Favored 'General case' 0 C--O 1.238 0.491 0 CA-C-N 115.003 -0.998 . . . . 89.280000000000001 109.873 -179.429 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 84.71 -25.0 6.07 Favored Glycine 0 CA--C 1.524 0.633 0 CA-C-N 115.494 -0.775 . . . . 76.560000000000002 114.764 -176.764 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -93.37 167.05 11.98 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 114.059 1.133 . . . . 91.900000000000006 114.059 -177.61 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' GLN . . . . . 0.504 ' OE1' HG22 ' A' ' 26' ' ' THR . 15.2 mm100 -98.23 117.49 32.73 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-N 115.952 -0.567 . . . . 69.650000000000006 110.377 175.98 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.682 ' HD2' ' I ' ' A' ' 216' ' ' IOD . 0.2 OUTLIER -123.17 129.82 51.93 Favored 'General case' 0 C--N 1.328 -0.343 0 N-CA-C 113.388 0.884 . . . . 94.379999999999995 113.388 -179.079 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' GLU . . . . . 0.441 ' O ' ' NZ ' ' A' ' 32' ' ' LYS . 0.1 OUTLIER -87.24 148.72 25.0 Favored 'General case' 0 N--CA 1.442 -0.872 0 N-CA-C 113.956 1.095 . . . . 57.799999999999997 113.956 -173.372 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.56 ' HB2' ' CG ' ' A' ' 23' ' ' GLU . 40.3 m-85 -123.32 135.85 54.4 Favored 'General case' 0 CA--C 1.502 -0.885 0 CA-C-N 115.06 -0.973 . . . . 42.100000000000001 109.432 173.209 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' LEU . . . . . . . . . . . . . 45.2 mt -89.16 141.53 28.44 Favored 'General case' 0 C--O 1.254 1.305 0 C-N-CA 120.075 -0.65 . . . . 26.02 109.994 178.778 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' VAL . . . . . . . . . . . . . 94.4 t -110.35 105.84 19.58 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.67 0 N-CA-C 107.906 -1.146 . . . . 33.07 107.906 168.978 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 84.0 mt -100.61 132.85 45.78 Favored 'General case' 0 C--O 1.243 0.758 0 N-CA-C 113.682 0.993 . . . . 27.149999999999999 113.682 -172.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' LYS . . . . . . . . . . . . . 45.9 tttt -88.31 120.85 30.07 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 107.744 -1.206 . . . . 30.649999999999999 107.744 171.434 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' VAL . . . . . 0.498 ' HB ' ' HB3' ' A' ' 44' ' ' LEU . 93.3 t -130.09 149.9 34.07 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.444 0 CA-C-N 116.016 -0.538 . . . . 26.120000000000001 109.919 -173.359 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ALA . . . . . 0.48 ' C ' ' HA2' ' A' ' 42' ' ' GLY . . . 55.27 40.5 31.6 Favored 'General case' 0 C--O 1.251 1.163 0 N-CA-C 113.686 0.995 . . . . 26.82 113.686 177.356 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLN . . . . . 0.527 ' N ' ' HA2' ' A' ' 42' ' ' GLY . 12.8 mp0 78.76 7.17 2.22 Favored 'General case' 0 CA--C 1.549 0.904 1 N-CA-C 124.291 4.922 . . . . 48.649999999999999 124.291 162.373 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' GLY . . . . . 0.527 ' HA2' ' N ' ' A' ' 41' ' ' GLN . . . -123.98 113.25 2.01 Favored Glycine 0 N--CA 1.434 -1.487 0 C-N-CA 130.272 3.796 . . . . 33.920000000000002 106.392 -9.396 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 14.7 m-20 -89.66 -6.22 56.36 Favored 'General case' 0 CA--C 1.515 -0.4 0 N-CA-C 108.04 -1.096 . . . . 41.530000000000001 108.04 172.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.498 ' HB3' ' HB ' ' A' ' 39' ' ' VAL . 0.1 OUTLIER -126.77 134.13 50.67 Favored 'General case' 0 N--CA 1.448 -0.545 0 CA-C-N 115.127 -0.942 . . . . 25.390000000000001 111.509 -176.01 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 74.0 m -114.79 126.82 55.27 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 106.762 -1.57 . . . . 27.550000000000001 106.762 166.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 42.3 t -114.4 129.15 70.93 Favored 'Isoleucine or valine' 0 C--O 1.254 1.3 0 CA-C-O 121.832 0.825 . . . . 28.93 109.519 173.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 1.3 tmt_? -112.81 131.16 55.81 Favored 'General case' 0 C--O 1.241 0.632 0 CA-C-N 114.708 -1.133 . . . . 41.829999999999998 109.387 175.262 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 11.3 p -152.83 141.34 13.98 Favored Pre-proline 0 N--CA 1.477 0.906 0 CA-C-O 118.913 -0.565 . . . . 27.460000000000001 109.942 -168.068 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 40.3 Cg_exo -58.16 134.39 61.6 Favored 'Trans proline' 0 C--N 1.358 1.059 0 C-N-CA 121.587 1.525 . . . . 33.740000000000002 111.557 174.381 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -69.89 -22.05 63.26 Favored 'General case' 0 CA--C 1.541 0.621 0 N-CA-C 114.645 1.35 . . . . 34.899999999999999 114.645 -176.309 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLU . . . . . 0.616 ' HB3' ' HE2' ' A' ' 32' ' ' LYS . 17.6 pt-20 -82.91 -20.13 35.98 Favored 'General case' 0 N--CA 1.464 0.268 0 C-N-CA 119.219 -0.992 . . . . 61.939999999999998 110.406 177.562 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 19.8 m120 -97.99 18.11 16.75 Favored 'General case' 0 C--O 1.241 0.643 0 C-N-CA 123.898 0.879 . . . . 86.870000000000005 111.276 -179.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ALA . . . . . . . . . . . . . . . -110.33 118.86 37.45 Favored 'General case' 0 C--O 1.242 0.685 0 CA-C-O 121.942 0.877 . . . . 65.530000000000001 110.705 -177.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' GLU . . . . . . . . . . . . . 24.6 tp10 -125.78 73.26 1.33 Allowed 'General case' 0 N--CA 1.436 -1.147 0 N-CA-C 105.162 -2.162 . . . . 80.859999999999999 105.162 178.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' TYR . . . . . . . . . . . . . 22.1 m-85 -113.59 126.96 55.86 Favored 'General case' 0 C--O 1.243 0.76 0 N-CA-C 107.145 -1.428 . . . . 40.810000000000002 107.145 176.032 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' VAL . . . . . . . . . . . . . 47.6 t -64.73 127.32 25.34 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.464 0 O-C-N 124.288 0.992 . . . . 35.119999999999997 111.846 178.259 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . -77.42 155.93 44.27 Favored Glycine 0 C--O 1.24 0.495 0 C-N-CA 121.089 -0.577 . . . . 34.82 113.749 178.304 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 5.4 t -136.53 142.89 36.96 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 N-CA-C 106.951 -1.5 . . . . 36.310000000000002 106.951 179.254 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' ARG . . . . . . . . . . . . . 32.6 mtm180 -58.71 145.87 38.59 Favored 'General case' 0 C--O 1.245 0.837 0 N-CA-C 116.655 2.095 . . . . 52.649999999999999 116.655 -172.651 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 92.4 m-20 -59.25 -39.26 82.29 Favored 'General case' 0 N--CA 1.466 0.341 0 CA-C-N 114.975 -1.011 . . . . 55.289999999999999 111.817 -176.314 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' VAL . . . . . . . . . . . . . 2.4 p -59.92 -23.93 28.2 Favored 'Isoleucine or valine' 0 C--O 1.24 0.56 0 O-C-N 123.779 0.674 . . . . 50.590000000000003 112.642 -178.25 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' VAL . . . . . . . . . . . . . 91.2 t -86.71 -52.01 12.32 Favored 'Isoleucine or valine' 0 C--O 1.248 0.987 0 C-N-CA 124.207 1.003 . . . . 37.340000000000003 110.518 172.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' GLY . . . . . . . . . . . . . . . 71.42 177.88 27.73 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 121.066 -0.588 . . . . 34.539999999999999 114.149 171.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -64.57 -44.11 91.75 Favored 'General case' 0 CA--C 1.562 1.414 0 N-CA-C 113.834 1.05 . . . . 37.020000000000003 113.834 -176.74 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' GLU . . . . . . . . . . . . . 50.6 mt-10 -66.98 -43.58 82.67 Favored 'General case' 0 C--O 1.222 -0.376 0 O-C-N 121.142 -0.974 . . . . 52.93 112.861 178.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' GLY . . . . . . . . . . . . . . . -54.18 -49.94 57.68 Favored Glycine 0 C--O 1.245 0.789 0 O-C-N 123.932 0.77 . . . . 28.899999999999999 112.299 173.172 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' LEU . . . . . 0.447 ' HB3' ' HB2' ' A' ' 16' ' ' ALA . 13.9 tp -60.76 -51.43 69.38 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 117.065 0.432 . . . . 24.0 110.646 179.809 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 32.5 m-20 -58.61 -35.36 72.35 Favored 'General case' 0 C--N 1.334 -0.074 0 C-N-CA 120.388 -0.525 . . . . 36.299999999999997 110.923 177.79 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' LYS . . . . . . . . . . . . . 41.9 tptt -63.54 -44.4 94.29 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-N 116.801 -0.181 . . . . 36.840000000000003 111.446 175.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' VAL . . . . . . . . . . . . . 44.6 t -56.32 -46.18 81.64 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.222 0 C-N-CA 120.719 -0.392 . . . . 27.239999999999998 110.707 175.877 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' PHE . . . . . . . . . . . . . 39.8 m-85 -60.71 -36.04 77.82 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 114.034 1.124 . . . . 29.84 114.034 176.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLN . . . . . . . . . . . . . 30.3 tt0 -69.3 -41.35 76.89 Favored 'General case' 0 N--CA 1.436 -1.162 0 C-N-CA 119.979 -0.689 . . . . 41.109999999999999 110.015 -175.7 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' VAL . . . . . . . . . . . . . 18.1 t -59.37 -45.14 93.66 Favored 'Isoleucine or valine' 0 C--O 1.252 1.221 0 CA-C-N 115.283 -0.871 . . . . 27.52 111.823 175.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 57.5 mt -69.02 -27.61 65.83 Favored 'General case' 0 N--CA 1.468 0.459 0 C-N-CA 119.905 -0.718 . . . . 21.260000000000002 110.256 -174.461 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ARG . . . . . . . . . . . . . 73.4 mtt180 -103.4 -1.19 28.99 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 112.168 0.433 . . . . 24.960000000000001 112.168 -170.387 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ALA . . . . . 0.41 ' HA ' ' HD3' ' A' ' 77' ' ' PRO . . . -53.66 127.63 51.58 Favored Pre-proline 0 C--O 1.251 1.161 0 N-CA-C 108.58 -0.896 . . . . 24.239999999999998 108.58 177.995 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.559 ' HD2' ' O1 ' ' A' ' 221' ' ' SO4 . 2.8 Cg_exo -82.78 -30.36 1.04 Allowed 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 124.196 3.264 . . . . 34.229999999999997 114.377 -170.386 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 34.6 m-70 -126.2 88.12 2.79 Favored 'General case' 0 CA--C 1.507 -0.682 0 N-CA-C 107.799 -1.186 . . . . 30.789999999999999 107.799 -170.263 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' THR . . . . . . . . . . . . . 67.8 p -100.43 163.46 12.36 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 116.316 -0.402 . . . . 46.460000000000001 110.283 -176.713 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 43.3 mm-40 -122.32 126.5 48.22 Favored 'General case' 0 N--CA 1.446 -0.636 0 N-CA-C 107.537 -1.283 . . . . 82.430000000000007 107.537 171.091 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -130.54 138.34 32.82 Favored Pre-proline 0 C--O 1.242 0.7 0 C-N-CA 120.77 -0.372 . . . . 41.68 110.347 171.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' PRO . . . . . . . . . . . . . 75.6 Cg_exo -43.22 135.07 6.05 Favored 'Trans proline' 0 C--O 1.247 0.964 0 C-N-CA 123.219 2.613 . . . . 47.329999999999998 111.931 177.023 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -75.01 -34.91 61.99 Favored 'General case' 0 C--O 1.248 1.013 0 CA-C-N 115.843 -0.617 . . . . 56.710000000000001 111.633 -175.855 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' ASN . . . . . . . . . . . . . 8.0 m120 -87.47 139.98 30.0 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 115.317 1.599 . . . . 52.740000000000002 115.317 -179.679 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' TRP . . . . . . . . . . . . . 54.2 t90 -54.39 -50.74 66.84 Favored 'General case' 0 C--O 1.253 1.283 0 N-CA-C 113.37 0.878 . . . . 25.829999999999998 113.37 -170.648 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 5.3 m -58.57 -48.77 79.82 Favored 'General case' 0 C--O 1.244 0.772 0 CA-C-N 116.216 -0.447 . . . . 34.609999999999999 111.933 -179.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ARG . . . . . 0.522 ' NH2' ' O2 ' ' A' ' 228' ' ' SO4 . 19.7 mtp180 -55.68 -51.03 68.64 Favored 'General case' 0 C--O 1.255 1.372 0 N-CA-C 107.292 -1.373 . . . . 49.310000000000002 107.292 178.608 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 28.7 ttp-105 -62.03 -48.88 78.3 Favored 'General case' 0 C--O 1.251 1.17 0 CA-C-N 114.834 -1.075 . . . . 32.810000000000002 109.711 -175.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' TYR . . . . . . . . . . . . . 51.6 t80 -62.12 -38.14 87.8 Favored 'General case' 0 C--O 1.244 0.782 0 O-C-N 123.796 0.685 . . . . 31.079999999999998 112.563 -178.512 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 25.4 tttt -68.27 -45.99 71.61 Favored 'General case' 0 C--O 1.244 0.78 0 C-N-CA 120.664 -0.414 . . . . 43.579999999999998 109.896 -177.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' ALA . . . . . . . . . . . . . . . -65.91 -43.19 88.89 Favored 'General case' 0 N--CA 1.472 0.651 0 C-N-CA 119.232 -0.987 . . . . 24.550000000000001 109.451 -175.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' ASN . . . . . . . . . . . . . 96.1 m-20 -58.82 -39.77 82.2 Favored 'General case' 0 N--CA 1.479 0.998 0 N-CA-C 114.699 1.37 . . . . 30.649999999999999 114.699 172.507 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 12.4 tp -62.56 -36.89 84.1 Favored 'General case' 0 C--N 1.318 -0.771 0 C-N-CA 119.576 -0.85 . . . . 40.460000000000001 109.311 -176.41 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -68.2 -46.55 70.33 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 121.189 0.518 . . . . 55.5 110.412 -179.436 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' LYS . . . . . . . . . . . . . 91.9 mttt -51.39 -47.67 62.81 Favored 'General case' 0 C--O 1.266 1.924 0 CA-C-N 115.484 -0.78 . . . . 32.93 112.417 178.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' LEU . . . . . . . . . . . . . 16.8 mt -61.46 -29.35 69.9 Favored 'General case' 0 C--O 1.216 -0.706 0 CA-C-N 115.434 -0.803 . . . . 31.77 111.98 177.929 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' ALA . . . . . . . . . . . . . . . -87.91 -7.45 57.15 Favored 'General case' 0 C--O 1.239 0.542 0 N-CA-C 113.136 0.791 . . . . 31.25 113.136 174.868 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' SER . . . . . . . . . . . . . 42.8 p -66.16 -23.44 66.47 Favored 'General case' 0 C--O 1.25 1.105 0 N-CA-C 114.834 1.42 . . . . 38.850000000000001 114.834 -169.264 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' GLY . . . . . . . . . . . . . . . 71.1 3.36 51.97 Favored Glycine 0 CA--C 1.532 1.148 0 N-CA-C 115.017 0.767 . . . . 41.149999999999999 115.017 -169.726 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ASP . . . . . 0.514 ' HB3' ' HG2' ' A' ' 103' ' ' LYS . 62.1 t0 -101.34 109.36 21.19 Favored 'General case' 0 C--O 1.246 0.874 0 N-CA-C 108.294 -1.002 . . . . 40.219999999999999 108.294 174.535 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' VAL . . . . . . . . . . . . . 10.7 p -59.62 -25.44 31.71 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 N-CA-C 111.968 0.358 . . . . 40.280000000000001 111.968 -177.292 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 78.9 m-20 -66.23 -37.53 85.75 Favored 'General case' 0 C--O 1.248 0.987 0 C-N-CA 118.678 -1.209 . . . . 30.52 110.105 176.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' LYS . . . . . 0.514 ' HG2' ' HB3' ' A' ' 100' ' ' ASP . 13.2 mmtt -61.87 -42.01 98.54 Favored 'General case' 0 N--CA 1.468 0.461 0 O-C-N 123.944 0.777 . . . . 40.210000000000001 111.341 175.421 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 81.8 t -62.31 -33.27 58.11 Favored 'Isoleucine or valine' 0 C--O 1.244 0.814 0 CA-C-O 121.46 0.648 . . . . 28.390000000000001 110.646 178.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' ALA . . . . . . . . . . . . . . . -76.81 -23.72 52.79 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 115.807 -0.633 . . . . 22.359999999999999 110.268 -177.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' GLU . . . . . . . . . . . . . 93.1 mt-10 -67.81 -39.28 83.98 Favored 'General case' 0 C--O 1.25 1.121 0 C-N-CA 118.86 -1.136 . . . . 27.48 108.739 173.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' VAL . . . . . . . . . . . . . 54.8 t -68.16 -48.22 74.9 Favored 'Isoleucine or valine' 0 C--O 1.241 0.643 0 CA-C-N 115.776 -0.647 . . . . 22.699999999999999 111.319 -179.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' VAL . . . . . . . . . . . . . 36.8 t -56.04 -48.21 79.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.237 0 CA-C-N 116.42 -0.355 . . . . 23.140000000000001 111.094 176.208 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' ARG . . . . . . . . . . . . . 7.6 tmm_? -60.95 -56.87 15.96 Favored 'General case' 0 N--CA 1.477 0.905 0 N-CA-C 114.334 1.235 . . . . 24.969999999999999 114.334 177.749 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' ASP . . . . . . . . . . . . . 82.3 m-20 -53.95 -46.41 71.58 Favored 'General case' 0 N--CA 1.48 1.065 0 N-CA-C 113.931 1.086 . . . . 27.789999999999999 113.931 -179.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' LEU . . . . . . . . . . . . . 68.7 mt -72.51 -39.05 67.9 Favored 'General case' 0 C--O 1.244 0.788 0 N-CA-C 114.463 1.283 . . . . 27.440000000000001 114.463 -177.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' TRP . . . . . 0.513 ' HZ2' ' NH1' ' A' ' 132' ' ' ARG . 3.2 m95 -55.85 -35.64 66.65 Favored 'General case' 0 C--O 1.212 -0.921 0 CA-C-N 118.659 0.663 . . . . 43.670000000000002 111.886 171.363 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ARG . . . . . . . . . . . . . 88.2 mtt180 -81.09 -38.74 26.8 Favored 'General case' 0 CA--C 1.501 -0.925 0 N-CA-C 107.767 -1.197 . . . . 34.719999999999999 107.767 -170.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' ARG . . . . . . . . . . . . . 56.1 ttm-85 -65.08 -36.89 85.75 Favored 'General case' 0 C--O 1.216 -0.677 0 N-CA-C 109.664 -0.495 . . . . 37.979999999999997 109.664 175.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' ASP . . . . . . . . . . . . . 31.3 t0 -57.48 -39.98 77.58 Favored 'General case' 0 C--N 1.324 -0.511 0 C-N-CA 119.478 -0.889 . . . . 55.0 111.979 177.049 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' GLN . . . . . . . . . . . . . 80.9 mm-40 -73.99 -28.97 61.73 Favored 'General case' 0 CA--C 1.513 -0.455 0 CA-C-O 121.185 0.517 . . . . 57.170000000000002 112.252 -177.812 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -105.13 -53.66 2.62 Favored 'General case' 0 CA--C 1.551 1.0 0 N-CA-C 119.795 3.257 . . . . 66.849999999999994 119.795 -174.494 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' ARG . . . . . 0.678 ' NH2' ' O ' ' A' ' 331' ' ' HOH . 0.0 OUTLIER -100.28 -19.5 16.33 Favored 'General case' 0 CA--C 1.54 0.575 0 N-CA-C 113.311 0.856 . . . . 79.280000000000001 113.311 175.007 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' GLY . . . . . . . . . . . . . . . 84.74 163.05 36.03 Favored Glycine 0 C--O 1.26 1.769 0 N-CA-C 111.675 -0.57 . . . . 43.030000000000001 111.675 -167.989 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' LEU . . . . . . . . . . . . . 36.2 mt -106.56 144.06 33.77 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 115.62 1.711 . . . . 34.18 115.62 -176.511 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 28.5 p -71.3 162.59 29.19 Favored 'General case' 0 C--O 1.25 1.107 0 C-N-CA 119.924 -0.71 . . . . 27.050000000000001 109.469 166.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' ALA . . . . . . . . . . . . . . . -55.14 -44.47 75.11 Favored 'General case' 0 CA--C 1.547 0.828 0 C-N-CA 119.868 -0.733 . . . . 34.590000000000003 112.369 -178.435 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' GLY . . . . . . . . . . . . . . . -67.49 -34.61 84.91 Favored Glycine 0 C--O 1.258 1.644 0 N-CA-C 110.271 -1.132 . . . . 30.100000000000001 110.271 -178.396 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' GLU . . . . . . . . . . . . . 75.5 mt-10 -71.88 -36.54 70.1 Favored 'General case' 0 CA--C 1.514 -0.432 0 CA-C-N 114.814 -0.693 . . . . 34.979999999999997 109.837 -178.126 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' LYS . . . . . . . . . . . . . 79.5 tttt -60.17 -46.32 90.08 Favored 'General case' 0 C--N 1.329 -0.295 0 O-C-N 123.585 0.553 . . . . 54.100000000000001 110.085 174.607 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' ARG . . . . . . . . . . . . . 22.0 mmt85 -66.49 -34.92 79.01 Favored 'General case' 0 C--N 1.327 -0.395 0 CA-C-O 120.828 0.347 . . . . 49.719999999999999 111.901 -178.361 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' MET . . . . . . . . . . . . . 39.6 ttm -70.45 -41.29 73.01 Favored 'General case' 0 C--O 1.241 0.644 0 CA-C-N 116.08 -0.509 . . . . 30.219999999999999 109.964 -178.749 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 128' ' ' LEU . . . . . 0.5 ' O ' ' HG3' ' A' ' 132' ' ' ARG . 29.3 tp -58.13 -40.98 82.68 Favored 'General case' 0 N--CA 1.464 0.247 0 O-C-N 123.585 0.553 . . . . 28.93 110.55 174.922 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 129' ' ' ALA . . . . . . . . . . . . . . . -66.76 -39.52 87.91 Favored 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 119.899 -0.72 . . . . 22.18 109.556 179.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 130' ' ' LYS . . . . . . . . . . . . . 4.2 tmtt? -67.77 -45.91 73.56 Favored 'General case' 0 N--CA 1.44 -0.928 0 N-CA-C 107.805 -1.183 . . . . 49.670000000000002 107.805 -176.013 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 131' ' ' ALA . . . . . . . . . . . . . . . -63.01 -42.19 99.77 Favored 'General case' 0 N--CA 1.454 -0.264 0 CA-C-N 115.684 -0.689 . . . . 28.280000000000001 109.68 -176.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 132' ' ' ARG . . . . . 0.513 ' NH1' ' HZ2' ' A' ' 112' ' ' TRP . 24.6 mtm180 -55.82 -44.91 78.35 Favored 'General case' 0 C--N 1.323 -0.545 0 N-CA-C 114.536 1.31 . . . . 45.149999999999999 114.536 174.91 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 133' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -64.63 -38.22 90.26 Favored 'General case' 0 N--CA 1.479 0.988 0 O-C-N 123.5 0.5 . . . . 57.210000000000001 110.611 178.072 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 134' ' ' ILE . . . . . . . . . . . . . 97.1 mt -66.6 -52.22 48.28 Favored 'Isoleucine or valine' 0 C--O 1.241 0.614 0 C-N-CA 120.654 -0.418 . . . . 35.710000000000001 110.502 178.919 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 135' ' ' LEU . . . . . . . . . . . . . 25.2 tp -48.5 -54.92 12.48 Favored 'General case' 0 N--CA 1.468 0.434 0 C-N-CA 120.6 -0.44 . . . . 27.620000000000001 111.184 175.782 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 136' ' ' VAL . . . . . 0.426 HG11 ' HB3' ' A' ' 151' ' ' GLU . 30.9 t -61.09 -47.38 93.83 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 N-CA-C 113.936 1.087 . . . . 35.509999999999998 113.936 -179.036 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 137' ' ' GLY . . . . . . . . . . . . . . . -60.2 -32.88 77.8 Favored Glycine 0 N--CA 1.448 -0.511 0 C-N-CA 120.439 -0.886 . . . . 36.100000000000001 113.174 -179.131 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 138' ' ' GLU . . . . . . . . . . . . . 50.0 tp10 -70.36 -37.73 74.67 Favored 'General case' 0 CA--C 1.54 0.578 0 N-CA-C 113.377 0.88 . . . . 49.490000000000002 113.377 175.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 139' ' ' LEU . . . . . . . . . . . . . 8.4 mp -87.22 -51.52 5.93 Favored 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 113.99 1.107 . . . . 36.590000000000003 113.99 -177.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 140' ' ' ALA . . . . . . . . . . . . . . . -53.28 144.82 15.28 Favored 'General case' 0 C--O 1.242 0.688 0 N-CA-C 112.668 0.618 . . . . 32.950000000000003 112.668 -176.621 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 141' ' ' LEU . . . . . . . . . . . . . 23.5 mt -72.44 150.31 43.45 Favored 'General case' 0 N--CA 1.472 0.656 0 O-C-N 123.608 0.568 . . . . 57.100000000000001 111.514 173.611 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 142' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.535 0 N-CA-C 112.284 0.476 . . . . 76.049999999999997 112.284 177.04 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 148' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.469 0.492 0 N-CA-C 112.315 0.487 . . . . 79.870000000000005 112.315 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 149' ' ' LYS . . . . . . . . . . . . . 15.7 tptp -91.45 -10.31 41.39 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 106.885 -1.524 . . . . 119.56 106.885 169.994 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 150' ' ' ALA . . . . . . . . . . . . . . . -83.96 -42.57 16.12 Favored 'General case' 0 N--CA 1.467 0.401 0 CA-C-N 115.154 -0.93 . . . . 56.329999999999998 109.069 171.82 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 151' ' ' GLU . . . . . 0.426 ' HB3' HG11 ' A' ' 136' ' ' VAL . 12.0 mt-10 -65.24 -26.01 67.92 Favored 'General case' 0 C--O 1.22 -0.466 0 O-C-N 123.765 0.666 . . . . 63.039999999999999 109.808 -179.887 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 152' ' ' THR . . . . . . . . . . . . . 91.7 m -79.88 -44.44 20.45 Favored 'General case' 0 C--N 1.326 -0.444 0 N-CA-C 113.278 0.844 . . . . 50.57 113.278 178.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 153' ' ' ILE . . . . . . . . . . . . . 24.8 mt -63.78 -46.79 93.48 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.67 0 CA-C-O 121.768 0.794 . . . . 46.060000000000002 110.95 172.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 154' ' ' LEU . . . . . . . . . . . . . 5.9 tp -59.19 -46.13 89.22 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 115.546 -0.752 . . . . 37.229999999999997 110.3 178.401 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 155' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -60.16 -38.36 82.93 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 113.625 0.972 . . . . 43.57 113.625 175.427 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 156' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -67.45 -41.39 84.77 Favored 'General case' 0 C--O 1.243 0.718 0 N-CA-C 114.12 1.156 . . . . 51.789999999999999 114.12 176.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 157' ' ' VAL . . . . . 0.5 ' HA ' ' O4 ' ' A' ' 229' ' ' SO4 . 26.6 t -66.15 -48.45 81.33 Favored 'Isoleucine or valine' 0 C--O 1.243 0.722 0 CA-C-N 115.023 -0.99 . . . . 25.559999999999999 110.176 -179.285 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 158' ' ' LEU . . . . . . . . . . . . . 40.5 mt -63.33 -35.85 81.75 Favored 'General case' 0 C--O 1.248 0.979 0 C-N-CA 119.929 -0.708 . . . . 26.739999999999998 110.161 178.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 159' ' ' ALA . . . . . . . . . . . . . . . -71.2 -42.35 69.08 Favored 'General case' 0 C--O 1.249 1.049 0 CA-C-O 121.584 0.706 . . . . 23.18 110.267 -177.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 160' ' ' ALA . . . . . . . . . . . . . . . -59.22 -43.93 92.3 Favored 'General case' 0 C--O 1.253 1.262 0 N-CA-C 107.982 -1.118 . . . . 21.32 107.982 175.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 161' ' ' ALA . . . . . . . . . . . . . . . -62.98 -33.75 76.06 Favored 'General case' 0 C--O 1.245 0.855 0 C-N-CA 119.951 -0.7 . . . . 24.539999999999999 111.182 -178.25 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 162' ' ' ALA . . . . . . . . . . . . . . . -61.29 -30.19 70.33 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 119.828 -0.749 . . . . 31.18 111.732 -177.298 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 163' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -89.04 -10.29 48.07 Favored 'General case' 0 C--N 1.315 -0.897 0 CA-C-N 116.106 -0.497 . . . . 30.5 111.999 -174.678 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 164' ' ' GLU . . . . . . . . . . . . . 95.9 mt-10 -95.85 126.38 41.07 Favored 'General case' 0 C--N 1.327 -0.388 0 C-N-CA 120.44 -0.504 . . . . 35.68 110.498 -177.666 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 165' ' ' HIS . . . . . . . . . . . . . 30.2 m170 -92.35 120.94 33.36 Favored 'General case' 0 C--N 1.322 -0.6 0 C-N-CA 119.41 -0.916 . . . . 41.18 109.288 172.201 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 166' ' ' HIS . . . . . . . . . . . . . 12.1 m170 -102.55 126.11 49.5 Favored 'General case' 0 CA--C 1.504 -0.789 0 N-CA-C 113.702 1.001 . . . . 30.07 113.702 178.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 167' ' ' HIS . . . . . . . . . . . . . 79.5 m-70 -115.1 122.86 47.43 Favored 'General case' 0 N--CA 1.479 1.02 0 CA-C-N 115.183 -0.917 . . . . 24.129999999999999 113.172 172.987 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 168' ' ' HIS . . . . . . . . . . . . . 98.7 m-70 -95.15 132.09 40.47 Favored 'General case' 0 CA--C 1.501 -0.912 0 N-CA-C 113.218 0.821 . . . . 35.240000000000002 113.218 178.355 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 169' ' ' HIS . . . . . . . . . . . . . 2.1 p80 -148.94 79.84 1.42 Allowed 'General case' 0 CA--C 1.54 0.575 0 CA-C-N 114.684 -1.143 . . . . 29.25 111.352 177.561 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 170' ' ' HIS . . . . . 0.617 ' N ' ' O2 ' ' A' ' 219' ' ' SO4 . 41.2 m80 . . . . . 0 C--O 1.222 -0.345 0 N-CA-C 108.957 -0.757 . . . . 59.159999999999997 108.957 170.037 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 201' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 202' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 203' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 204' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 205' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 206' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 207' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 208' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 209' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 210' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 211' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 212' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 213' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 214' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 215' ' ' IOD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 216' ' ' IOD . . . . . 0.682 ' I ' ' HD2' ' A' ' 32' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 217' ' ' GOL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 218' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 219' ' ' SO4 . . . . . 0.617 ' O2 ' ' N ' ' A' ' 170' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 220' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 221' ' ' SO4 . . . . . 0.559 ' O1 ' ' HD2' ' A' ' 77' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 222' ' ' SO4 . . . . . 0.433 ' O4 ' ' HG3' ' A' ' 33' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 223' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 224' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 225' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 226' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 227' ' ' SO4 . . . . . 0.49 ' O2 ' ' HG ' ' A' ' 128' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 228' ' ' SO4 . . . . . 0.522 ' O2 ' ' NH2' ' A' ' 87' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 229' ' ' SO4 . . . . . 0.5 ' O4 ' ' HA ' ' A' ' 157' ' ' VAL . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 230' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 301' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 302' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 303' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 304' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 305' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 306' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 307' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 308' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 309' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 310' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 311' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 312' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 313' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 314' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 315' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 316' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 317' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 318' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 319' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 320' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 321' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 322' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 323' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 324' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 325' ' ' HOH . . . . . 0.441 ' O ' ' OE1' ' A' ' 20' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 326' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 327' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 328' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 329' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 330' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 331' ' ' HOH . . . . . 0.678 ' O ' ' NH2' ' A' ' 118' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_