data_5fwc_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 5fwc _Structure_validation_residue.Date_analyzed 2016-12-23 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 ' 6' ' ' LYS . . . . . . . . . . . . . 21.8 mttm . . . . . 0 N--CA 1.514 2.738 0 CA-C-O 122.743 1.259 . . . . 46.969999999999999 112.097 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -76.15 159.78 30.37 Favored 'General case' 0 C--O 1.278 2.58 0 CA-C-N 114.496 -1.229 . . . . 20.16 110.493 -172.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 84.0 mt -110.9 148.57 32.18 Favored 'General case' 0 C--O 1.277 2.509 0 CA-C-N 112.771 -2.013 . . . . 14.98 105.893 179.499 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 22.4 m -129.69 154.99 41.08 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-N 113.516 -1.675 . . . . 13.27 108.665 169.758 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 48.6 tp -103.45 126.01 50.36 Favored 'General case' 0 C--O 1.25 1.123 0 C-N-CA 125.441 1.496 . . . . 14.699999999999999 109.177 179.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.71 122.85 19.97 Favored 'General case' 0 C--O 1.235 0.293 0 O-C-N 120.498 -1.376 . . . . 11.039999999999999 107.737 174.072 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 98.1 mt -90.46 -21.04 22.07 Favored 'General case' 0 C--O 1.293 3.388 0 CA-C-O 116.768 -1.587 . . . . 14.68 110.505 179.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 74.3 m-85 -141.6 156.16 45.7 Favored 'General case' 0 C--O 1.251 1.156 0 O-C-N 124.53 1.144 . . . . 17.34 110.58 -178.508 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 77.1 m-20 -62.02 143.76 56.12 Favored 'General case' 0 C--O 1.272 2.254 0 CA-C-N 119.918 1.236 . . . . 18.489999999999998 110.225 160.426 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -145.55 127.79 15.77 Favored 'General case' 0 C--O 1.246 0.88 0 N-CA-C 106.732 -1.581 . . . . 12.609999999999999 106.732 172.88 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -98.48 107.8 20.34 Favored 'General case' 0 C--O 1.171 -3.035 0 O-C-N 124.748 1.28 . . . . 26.469999999999999 111.824 175.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLU . . . . . 0.872 ' OE1' ' N ' ' A' ' 64' ' ' NH4 0.405 6.9 pt-20 7.96 115.41 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.019 0 CA-C-O 116.877 -1.535 . . . . 24.129999999999999 109.188 -173.881 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LYS . . . . . 0.621 ' NZ ' ' O ' ' A' 2012 ' ' HOH . 0.1 OUTLIER -128.5 -1.44 5.55 Favored 'General case' 0 CA--C 1.494 -1.176 0 N-CA-C 117.628 2.455 . . . . 36.950000000000003 117.628 175.733 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.7 p -150.0 161.47 31.03 Favored Pre-proline 0 N--CA 1.416 -2.128 0 N-CA-C 106.45 -1.685 . . . . 18.780000000000001 106.45 171.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -59.18 -23.48 69.57 Favored 'Trans proline' 0 N--CA 1.494 1.508 0 CA-C-O 114.91 -2.204 . . . . 17.32 115.753 -177.397 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.2 mmt180 -91.61 -8.87 46.06 Favored 'General case' 0 CA--C 1.465 -2.309 0 O-C-N 127.966 3.291 . . . . 33.649999999999999 111.882 -178.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 78.8 mt-10 -86.45 165.7 16.1 Favored 'General case' 0 C--N 1.312 -1.038 0 O-C-N 119.178 -2.201 . . . . 13.539999999999999 113.097 -179.292 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.8 p -133.09 153.97 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.383 0 CA-C-O 123.865 1.793 . . . . 13.460000000000001 107.928 175.379 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' THR . . . . . . . . . . . . . 54.7 m -88.72 141.61 28.36 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 114.124 -1.398 . . . . 11.970000000000001 111.748 177.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -139.15 160.42 39.84 Favored 'General case' 0 N--CA 1.488 1.452 0 CA-C-N 115.16 -0.927 . . . . 15.4 109.55 173.714 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 49.5 mttm -113.96 144.81 42.46 Favored 'General case' 0 N--CA 1.423 -1.809 0 N-CA-C 105.169 -2.16 . . . . 34.659999999999997 105.169 179.08 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -53.16 132.25 38.15 Favored 'General case' 0 C--O 1.264 1.846 0 N-CA-C 108.451 -0.944 . . . . 22.59 108.451 174.838 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 98.35 -15.94 60.58 Favored Glycine 0 N--CA 1.492 2.431 0 C-N-CA 119.339 -1.41 . . . . 11.42 111.583 -179.415 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -66.27 146.16 54.92 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 120.07 1.935 . . . . 14.550000000000001 109.514 -179.556 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 43.5 mm -104.71 114.34 44.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 N-CA-C 104.864 -2.273 . . . . 12.69 104.864 175.067 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.0 mt -110.12 145.41 37.21 Favored 'General case' 0 N--CA 1.518 2.937 0 CA-C-N 114.222 -1.354 . . . . 22.329999999999998 111.599 -176.048 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 41.6 m -81.96 130.05 34.96 Favored 'General case' 0 C--O 1.271 2.22 0 CA-C-O 116.303 -1.808 . . . . 12.51 108.971 174.47 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 51.4 tp -83.9 122.45 28.73 Favored 'General case' 0 C--O 1.265 1.87 0 O-C-N 126.111 2.132 . . . . 14.94 111.733 177.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 50.1 mt -97.2 -39.84 9.08 Favored 'General case' 0 C--O 1.257 1.462 0 CA-C-O 115.981 -1.961 . . . . 15.52 114.01 176.271 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -155.05 121.67 5.37 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 118.125 -1.43 . . . . 13.890000000000001 107.577 -176.559 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 78.2 p -116.03 25.14 10.92 Favored 'General case' 0 C--O 1.196 -1.743 0 O-C-N 125.102 1.501 . . . . 12.52 114.031 177.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 82.2 p -69.42 -25.08 63.95 Favored 'General case' 0 C--O 1.213 -0.85 0 N-CA-C 114.333 1.235 . . . . 9.6600000000000001 114.333 -178.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -91.4 144.0 26.04 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 108.14 -1.059 . . . . 11.31 108.14 178.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 8.0 ttpp -69.37 -31.59 70.1 Favored 'General case' 0 C--O 1.185 -2.309 0 O-C-N 124.546 1.154 . . . . 44.049999999999997 113.666 178.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -106.31 -26.98 11.28 Favored 'General case' 0 CA--C 1.475 -1.928 0 N-CA-C 114.083 1.142 . . . . 22.620000000000001 114.083 -169.703 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 97.2 m95 -133.0 122.86 24.84 Favored 'General case' 0 C--O 1.249 1.043 0 O-C-N 120.239 -1.538 . . . . 13.6 109.05 -173.049 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 34.4 m0 -109.09 141.6 41.02 Favored 'General case' 0 C--O 1.293 3.352 0 O-C-N 124.296 0.997 . . . . 15.619999999999999 109.573 -179.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 77.7 tttt -89.84 130.52 36.07 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 107.342 -1.355 . . . . 18.510000000000002 107.342 177.244 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 23.6 m -137.48 163.2 31.64 Favored 'Isoleucine or valine' 0 CA--C 1.475 -1.908 0 CA-C-O 124.586 2.136 . . . . 12.81 108.503 -172.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -120.34 126.33 50.24 Favored 'General case' 0 C--O 1.181 -2.521 0 CA-C-N 114.025 -1.443 . . . . 35.289999999999999 109.939 174.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 15.8 t -135.99 124.54 37.62 Favored 'Isoleucine or valine' 0 C--O 1.165 -3.393 0 C-N-CA 126.171 1.789 . . . . 26.100000000000001 106.266 -171.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER 61.02 -126.25 0.91 Allowed 'General case' 0 N--CA 1.418 -2.049 0 N-CA-C 106.1 -1.815 . . . . 39.560000000000002 106.1 -168.695 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -114.97 28.49 8.0 Favored Glycine 0 C--O 1.208 -1.472 0 C-N-CA 128.491 2.948 . . . . 25.600000000000001 115.639 174.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 62.5 mtt85 -122.19 148.01 45.47 Favored 'General case' 0 C--O 1.239 0.543 0 N-CA-C 108.151 -1.055 . . . . 50.969999999999999 108.151 176.143 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -117.84 145.95 44.22 Favored 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 106.012 -1.848 . . . . 20.23 106.012 174.493 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 173.64 -173.97 45.99 Favored Glycine 0 C--O 1.261 1.807 0 N-CA-C 108.299 -1.921 . . . . 12.119999999999999 108.299 169.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -96.11 142.03 28.78 Favored 'General case' 0 C--O 1.254 1.332 0 N-CA-C 112.89 0.7 . . . . 16.739999999999998 112.89 -175.185 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 28.9 m -130.35 161.93 57.49 Favored Pre-proline 0 N--CA 1.512 2.675 0 CA-C-N 113.594 -1.639 . . . . 12.539999999999999 109.697 168.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -67.5 127.1 15.87 Favored 'Trans proline' 0 C--N 1.287 -2.676 0 CA-C-O 122.438 0.932 . . . . 13.220000000000001 109.784 -178.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.38 -32.1 66.47 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 113.749 1.018 . . . . 10.6 113.749 -179.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -66.53 -15.64 63.55 Favored 'General case' 0 C--O 1.3 3.748 0 CA-C-O 114.301 -2.762 . . . . 12.83 113.241 178.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 10.3 m-30 -99.19 11.15 39.88 Favored 'General case' 0 C--N 1.361 1.071 0 O-C-N 127.062 2.726 . . . . 12.59 110.468 -172.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 21.5 m -133.51 160.28 42.32 Favored 'Isoleucine or valine' 0 CA--C 1.477 -1.85 0 O-C-N 124.317 1.011 . . . . 13.82 111.113 171.368 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 61.3 tttt -123.02 124.68 43.68 Favored 'General case' 0 C--O 1.253 1.257 0 N-CA-C 105.247 -2.131 . . . . 33.969999999999999 105.247 -179.939 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' ALA . . . . . . . . . . . . . . . -69.64 135.13 49.54 Favored 'General case' 0 C--O 1.254 1.339 0 C-N-CA 119.238 -0.985 . . . . 16.489999999999998 109.103 175.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.7 mt -90.3 -32.41 16.53 Favored 'General case' 0 N--CA 1.503 2.192 0 N-CA-C 116.789 2.144 . . . . 25.16 116.789 179.473 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 53.4 p-10 . . . . . 0 N--CA 1.531 3.582 0 C-N-CA 128.746 2.818 . . . . 33.689999999999998 109.614 -170.242 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 63' ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 64' ' ' NH4 . . . . . 0.872 ' N ' ' OE1' ' A' ' 17' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2009 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2010 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2011 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2012 ' ' HOH . . . . . 0.621 ' O ' ' NZ ' ' A' ' 18' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 2013 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2014 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2015 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2016 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2017 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2018 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2019 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2020 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2021 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2022 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2023 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2024 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2025 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2026 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2027 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2028 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2029 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2030 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2031 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2032 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2033 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2034 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2035 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2036 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2037 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2038 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2039 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2040 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2041 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2042 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2043 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2044 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2045 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2046 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2047 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2048 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2049 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2050 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2051 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2052 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2053 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2054 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 2055 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 21.8 mttm . . . . . 0 N--CA 1.514 2.738 0 CA-C-O 122.743 1.259 . . . . 46.97 112.097 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 7' ' ' ALA . . . . . 0.521 ' HB1' ' O ' ' A' 2002 ' ' HOH . . . -76.15 159.78 30.37 Favored 'General case' 0 C--O 1.278 2.58 0 CA-C-N 114.496 -1.229 . . . . 20.16 110.493 -172.985 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 84.0 mt -110.9 148.57 32.18 Favored 'General case' 0 C--O 1.277 2.509 0 CA-C-N 112.771 -2.013 . . . . 14.98 105.893 179.499 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' VAL . . . . . 0.417 HG12 ' HA ' ' A' ' 60' ' ' ALA . 22.4 m -129.69 154.99 41.08 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-N 113.516 -1.675 . . . . 13.27 108.665 169.758 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 48.6 tp -103.45 126.01 50.36 Favored 'General case' 0 C--O 1.25 1.123 0 C-N-CA 125.441 1.496 . . . . 14.7 109.177 179.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.71 122.85 19.97 Favored 'General case' 0 C--O 1.235 0.293 0 O-C-N 120.498 -1.376 . . . . 11.04 107.737 174.072 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 98.1 mt -90.46 -21.04 22.07 Favored 'General case' 0 C--O 1.293 3.388 0 CA-C-O 116.768 -1.587 . . . . 14.68 110.505 179.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 74.3 m-85 -141.6 156.16 45.7 Favored 'General case' 0 C--O 1.251 1.156 0 O-C-N 124.53 1.144 . . . . 17.34 110.58 -178.508 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 77.1 m-20 -62.02 143.76 56.12 Favored 'General case' 0 C--O 1.272 2.254 0 CA-C-N 119.918 1.236 . . . . 18.49 110.225 160.426 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -145.55 127.79 15.77 Favored 'General case' 0 C--O 1.246 0.88 0 N-CA-C 106.732 -1.581 . . . . 12.61 106.732 172.88 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -98.48 107.8 20.34 Favored 'General case' 0 C--O 1.171 -3.035 0 O-C-N 124.748 1.28 . . . . 27.75 111.824 175.098 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLU . . . . . 0.872 ' OE1' ' N ' ' A' ' 64' ' ' NH4 0.405 6.9 pt-20 7.96 115.41 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.019 0 CA-C-O 116.877 -1.535 . . . . 24.13 109.188 -173.881 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LYS . . . . . 0.621 ' NZ ' ' O ' ' A' 2012 ' ' HOH . 0.1 OUTLIER -128.5 -1.44 5.55 Favored 'General case' 0 CA--C 1.494 -1.176 0 N-CA-C 117.628 2.455 . . . . 36.95 117.628 175.733 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.7 p -150.0 161.47 31.03 Favored Pre-proline 0 N--CA 1.416 -2.128 0 N-CA-C 106.45 -1.685 . . . . 18.78 106.45 171.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -59.18 -23.48 69.57 Favored 'Trans proline' 0 N--CA 1.494 1.508 0 CA-C-O 114.91 -2.204 . . . . 17.32 115.753 -177.397 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.2 mmt180 -91.61 -8.87 46.06 Favored 'General case' 0 CA--C 1.465 -2.309 0 O-C-N 127.966 3.291 . . . . 33.65 111.882 -178.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 78.8 mt-10 -86.45 165.7 16.1 Favored 'General case' 0 C--N 1.312 -1.038 0 O-C-N 119.178 -2.201 . . . . 13.54 113.097 -179.292 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.8 p -133.09 153.97 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.383 0 CA-C-O 123.865 1.793 . . . . 13.46 107.928 175.379 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' THR . . . . . 0.518 ' OG1' ' HB2' ' A' ' 17' ' ' GLU . 54.7 m -88.72 141.61 28.36 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 114.124 -1.398 . . . . 11.97 111.748 177.215 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -139.15 160.42 39.84 Favored 'General case' 0 N--CA 1.488 1.452 0 CA-C-N 115.16 -0.927 . . . . 15.4 109.55 173.714 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 49.5 mttm -113.96 144.81 42.46 Favored 'General case' 0 N--CA 1.423 -1.809 0 N-CA-C 105.169 -2.16 . . . . 34.66 105.169 179.08 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -53.16 132.25 38.15 Favored 'General case' 0 C--O 1.264 1.846 0 N-CA-C 108.451 -0.944 . . . . 22.59 108.451 174.838 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 98.35 -15.94 60.58 Favored Glycine 0 N--CA 1.492 2.431 0 C-N-CA 119.339 -1.41 . . . . 11.42 111.583 -179.415 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -66.27 146.16 54.92 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 120.07 1.935 . . . . 14.55 109.514 -179.556 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 43.5 mm -104.71 114.34 44.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 N-CA-C 104.864 -2.273 . . . . 12.69 104.864 175.067 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.0 mt -110.12 145.41 37.21 Favored 'General case' 0 N--CA 1.518 2.937 0 CA-C-N 114.222 -1.354 . . . . 22.33 111.599 -176.048 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 41.6 m -81.96 130.05 34.96 Favored 'General case' 0 C--O 1.271 2.22 0 CA-C-O 116.303 -1.808 . . . . 12.51 108.971 174.47 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 51.4 tp -83.9 122.45 28.73 Favored 'General case' 0 C--O 1.265 1.87 0 O-C-N 126.111 2.132 . . . . 14.94 111.733 177.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 50.1 mt -97.2 -39.84 9.08 Favored 'General case' 0 C--O 1.257 1.462 0 CA-C-O 115.981 -1.961 . . . . 15.52 114.01 176.271 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -155.05 121.67 5.37 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 118.125 -1.43 . . . . 13.89 107.577 -176.559 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 78.2 p -116.03 25.14 10.92 Favored 'General case' 0 C--O 1.196 -1.743 0 O-C-N 125.102 1.501 . . . . 12.52 114.031 177.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 82.2 p -69.42 -25.08 63.95 Favored 'General case' 0 C--O 1.213 -0.85 0 N-CA-C 114.333 1.235 . . . . 9.66 114.333 -178.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -91.4 144.0 26.04 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 108.14 -1.059 . . . . 11.31 108.14 178.475 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 8.0 ttpp -69.37 -31.59 70.1 Favored 'General case' 0 C--O 1.185 -2.309 0 O-C-N 124.546 1.154 . . . . 44.05 113.666 178.564 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -106.31 -26.98 11.28 Favored 'General case' 0 CA--C 1.475 -1.928 0 N-CA-C 114.083 1.142 . . . . 22.62 114.083 -169.703 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 97.2 m95 -133.0 122.86 24.84 Favored 'General case' 0 C--O 1.249 1.043 0 O-C-N 120.239 -1.538 . . . . 13.6 109.05 -173.049 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 34.4 m0 -109.09 141.6 41.02 Favored 'General case' 0 C--O 1.293 3.352 0 O-C-N 124.296 0.997 . . . . 15.62 109.573 -179.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 77.7 tttt -89.84 130.52 36.07 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 107.342 -1.355 . . . . 18.51 107.342 177.244 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 23.6 m -137.48 163.2 31.64 Favored 'Isoleucine or valine' 0 CA--C 1.475 -1.908 0 CA-C-O 124.586 2.136 . . . . 12.81 108.503 -172.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -120.34 126.33 50.24 Favored 'General case' 0 C--O 1.181 -2.521 0 CA-C-N 114.025 -1.443 . . . . 35.29 109.939 174.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 15.8 t -135.99 124.54 37.62 Favored 'Isoleucine or valine' 0 C--O 1.165 -3.393 0 C-N-CA 126.171 1.789 . . . . 26.1 106.266 -171.086 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ASN . . . . . 0.444 ' HB2' ' H ' ' A' ' 48' ' ' GLY . 0.9 OUTLIER 61.02 -126.25 0.91 Allowed 'General case' 0 N--CA 1.418 -2.049 0 N-CA-C 106.1 -1.815 . . . . 39.56 106.1 -168.695 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 48' ' ' GLY . . . . . 0.444 ' H ' ' HB2' ' A' ' 47' ' ' ASN . . . -114.97 28.49 8.0 Favored Glycine 0 C--O 1.208 -1.472 0 C-N-CA 128.491 2.948 . . . . 25.6 115.639 174.63 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 62.5 mtt85 -122.19 148.01 45.47 Favored 'General case' 0 C--O 1.239 0.543 0 N-CA-C 108.151 -1.055 . . . . 50.97 108.151 176.143 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -117.84 145.95 44.22 Favored 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 106.012 -1.848 . . . . 20.23 106.012 174.493 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 173.64 -173.97 45.99 Favored Glycine 0 C--O 1.261 1.807 0 N-CA-C 108.299 -1.921 . . . . 12.12 108.299 169.281 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -96.11 142.03 28.78 Favored 'General case' 0 C--O 1.254 1.332 0 N-CA-C 112.89 0.7 . . . . 16.74 112.89 -175.185 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 28.9 m -130.35 161.93 57.49 Favored Pre-proline 0 N--CA 1.512 2.675 0 CA-C-N 113.594 -1.639 . . . . 12.54 109.697 168.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -67.5 127.1 15.87 Favored 'Trans proline' 0 C--N 1.287 -2.676 0 CA-C-O 122.438 0.932 . . . . 13.22 109.784 -178.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.38 -32.1 66.47 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 113.749 1.018 . . . . 10.6 113.749 -179.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -66.53 -15.64 63.55 Favored 'General case' 0 C--O 1.3 3.748 0 CA-C-O 114.301 -2.762 . . . . 12.83 113.241 178.398 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 10.3 m-30 -99.19 11.15 39.88 Favored 'General case' 0 C--N 1.361 1.071 0 O-C-N 127.062 2.726 . . . . 12.59 110.468 -172.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 21.5 m -133.51 160.28 42.32 Favored 'Isoleucine or valine' 0 CA--C 1.477 -1.85 0 O-C-N 124.317 1.011 . . . . 13.82 111.113 171.368 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 61.3 tttt -123.02 124.68 43.68 Favored 'General case' 0 C--O 1.253 1.257 0 N-CA-C 105.247 -2.131 . . . . 33.97 105.247 -179.939 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 60' ' ' ALA . . . . . 0.417 ' HA ' HG12 ' A' ' 9' ' ' VAL . . . -69.64 135.13 49.54 Favored 'General case' 0 C--O 1.254 1.339 0 C-N-CA 119.238 -0.985 . . . . 16.49 109.103 175.835 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.7 mt -90.3 -32.41 16.53 Favored 'General case' 0 N--CA 1.503 2.192 0 N-CA-C 116.789 2.144 . . . . 25.16 116.789 179.473 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 53.4 p-10 . . . . . 0 N--CA 1.531 3.582 0 C-N-CA 128.746 2.818 . . . . 33.69 109.614 -170.242 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 63' ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 64' ' ' NH4 . . . . . 0.872 ' N ' ' OE1' ' A' ' 17' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 65' ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2002 ' ' HOH . . . . . 0.521 ' O ' ' HB1' ' A' ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2009 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2010 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2011 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2012 ' ' HOH . . . . . 0.621 ' O ' ' NZ ' ' A' ' 18' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 2013 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2014 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2015 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2016 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2017 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2018 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2019 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2020 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2021 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2022 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2023 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2024 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2025 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2026 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2027 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2028 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2029 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2030 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2031 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2032 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2033 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2034 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2035 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2036 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2037 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2038 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2039 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2040 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2041 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2042 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2043 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2044 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2045 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2046 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2047 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2048 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2049 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2050 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2051 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2052 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2053 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2054 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2055 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' LYS . . . . . . . . . . . . . 21.8 mttm . . . . . 0 N--CA 1.514 2.738 0 CA-C-O 122.743 1.259 . . . . 46.969999999999999 112.097 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.521 ' HB1' ' O ' ' A' 2002 ' ' HOH . . . -76.15 159.78 30.37 Favored 'General case' 0 C--O 1.278 2.58 0 CA-C-N 114.496 -1.229 . . . . 20.16 110.493 -172.985 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' LEU . . . . . . . . . . . . . 84.0 mt -110.9 148.57 32.18 Favored 'General case' 0 C--O 1.277 2.509 0 CA-C-N 112.771 -2.013 . . . . 14.98 105.893 179.499 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.417 HG12 ' HA ' ' A' ' 60' ' ' ALA . 22.4 m -129.69 154.99 41.08 Favored 'Isoleucine or valine' 0 C--N 1.314 -0.937 0 CA-C-N 113.516 -1.675 . . . . 13.27 108.665 169.758 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' LEU . . . . . . . . . . . . . 48.6 tp -103.45 126.01 50.36 Favored 'General case' 0 C--O 1.25 1.123 0 C-N-CA 125.441 1.496 . . . . 14.699999999999999 109.177 179.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ALA . . . . . . . . . . . . . . . -69.71 122.85 19.97 Favored 'General case' 0 C--O 1.235 0.293 0 O-C-N 120.498 -1.376 . . . . 11.039999999999999 107.737 174.072 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 98.1 mt -90.46 -21.04 22.07 Favored 'General case' 0 C--O 1.293 3.388 0 CA-C-O 116.768 -1.587 . . . . 14.68 110.505 179.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 74.3 m-85 -141.6 156.16 45.7 Favored 'General case' 0 C--O 1.251 1.156 0 O-C-N 124.53 1.144 . . . . 17.34 110.58 -178.508 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 77.1 m-20 -62.02 143.76 56.12 Favored 'General case' 0 C--O 1.272 2.254 0 CA-C-N 119.918 1.236 . . . . 18.489999999999998 110.225 160.426 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -145.55 127.79 15.77 Favored 'General case' 0 C--O 1.246 0.88 0 N-CA-C 106.732 -1.581 . . . . 12.609999999999999 106.732 172.88 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -98.48 107.8 20.34 Favored 'General case' 0 C--O 1.171 -3.035 0 O-C-N 124.748 1.28 . . . . 27.75 111.824 175.098 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.872 ' OE1' ' N ' ' A' ' 64' ' ' NH4 0.405 6.9 pt-20 7.96 115.41 0.0 OUTLIER 'General case' 0 CA--C 1.551 1.019 0 CA-C-O 116.877 -1.535 . . . . 24.129999999999999 109.188 -173.881 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LYS . . . . . 0.621 ' NZ ' ' O ' ' A' 2012 ' ' HOH . 0.1 OUTLIER -128.5 -1.44 5.55 Favored 'General case' 0 CA--C 1.494 -1.176 0 N-CA-C 117.628 2.455 . . . . 36.950000000000003 117.628 175.733 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 1.7 p -150.0 161.47 31.03 Favored Pre-proline 0 N--CA 1.416 -2.128 0 N-CA-C 106.45 -1.685 . . . . 18.780000000000001 106.45 171.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_exo -59.18 -23.48 69.57 Favored 'Trans proline' 0 N--CA 1.494 1.508 0 CA-C-O 114.91 -2.204 . . . . 17.32 115.753 -177.397 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 31.2 mmt180 -91.61 -8.87 46.06 Favored 'General case' 0 CA--C 1.465 -2.309 0 O-C-N 127.966 3.291 . . . . 33.649999999999999 111.882 -178.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' GLU . . . . . . . . . . . . . 78.8 mt-10 -86.45 165.7 16.1 Favored 'General case' 0 C--N 1.312 -1.038 0 O-C-N 119.178 -2.201 . . . . 13.539999999999999 113.097 -179.292 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 14.8 p -133.09 153.97 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.527 3.383 0 CA-C-O 123.865 1.793 . . . . 13.460000000000001 107.928 175.379 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' THR . . . . . 0.518 ' OG1' ' HB2' ' A' ' 17' ' ' GLU . 54.7 m -88.72 141.61 28.36 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-N 114.124 -1.398 . . . . 11.970000000000001 111.748 177.215 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -139.15 160.42 39.84 Favored 'General case' 0 N--CA 1.488 1.452 0 CA-C-N 115.16 -0.927 . . . . 15.4 109.55 173.714 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' LYS . . . . . . . . . . . . . 49.5 mttm -113.96 144.81 42.46 Favored 'General case' 0 N--CA 1.423 -1.809 0 N-CA-C 105.169 -2.16 . . . . 34.659999999999997 105.169 179.08 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -53.16 132.25 38.15 Favored 'General case' 0 C--O 1.264 1.846 0 N-CA-C 108.451 -0.944 . . . . 22.59 108.451 174.838 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 98.35 -15.94 60.58 Favored Glycine 0 N--CA 1.492 2.431 0 C-N-CA 119.339 -1.41 . . . . 11.42 111.583 -179.415 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 92.9 m-20 -66.27 146.16 54.92 Favored 'General case' 0 C--N 1.318 -0.792 0 CA-C-N 120.07 1.935 . . . . 14.550000000000001 109.514 -179.556 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' ILE . . . . . . . . . . . . . 43.5 mm -104.71 114.34 44.07 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.633 0 N-CA-C 104.864 -2.273 . . . . 12.69 104.864 175.067 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LEU . . . . . . . . . . . . . 11.0 mt -110.12 145.41 37.21 Favored 'General case' 0 N--CA 1.518 2.937 0 CA-C-N 114.222 -1.354 . . . . 22.329999999999998 111.599 -176.048 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' THR . . . . . . . . . . . . . 41.6 m -81.96 130.05 34.96 Favored 'General case' 0 C--O 1.271 2.22 0 CA-C-O 116.303 -1.808 . . . . 12.51 108.971 174.47 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 51.4 tp -83.9 122.45 28.73 Favored 'General case' 0 C--O 1.265 1.87 0 O-C-N 126.111 2.132 . . . . 14.94 111.733 177.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 50.1 mt -97.2 -39.84 9.08 Favored 'General case' 0 C--O 1.257 1.462 0 CA-C-O 115.981 -1.961 . . . . 15.52 114.01 176.271 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ASN . . . . . . . . . . . . . 27.1 t-20 -155.05 121.67 5.37 Favored 'General case' 0 C--N 1.323 -0.56 0 C-N-CA 118.125 -1.43 . . . . 13.890000000000001 107.577 -176.559 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' SER . . . . . . . . . . . . . 78.2 p -116.03 25.14 10.92 Favored 'General case' 0 C--O 1.196 -1.743 0 O-C-N 125.102 1.501 . . . . 12.52 114.031 177.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 82.2 p -69.42 -25.08 63.95 Favored 'General case' 0 C--O 1.213 -0.85 0 N-CA-C 114.333 1.235 . . . . 9.6600000000000001 114.333 -178.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' ASN . . . . . . . . . . . . . 18.4 t-20 -91.4 144.0 26.04 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 108.14 -1.059 . . . . 11.31 108.14 178.475 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 8.0 ttpp -69.37 -31.59 70.1 Favored 'General case' 0 C--O 1.185 -2.309 0 O-C-N 124.546 1.154 . . . . 44.049999999999997 113.666 178.564 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 77.3 m-20 -106.31 -26.98 11.28 Favored 'General case' 0 CA--C 1.475 -1.928 0 N-CA-C 114.083 1.142 . . . . 22.620000000000001 114.083 -169.703 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' TRP . . . . . . . . . . . . . 97.2 m95 -133.0 122.86 24.84 Favored 'General case' 0 C--O 1.249 1.043 0 O-C-N 120.239 -1.538 . . . . 13.6 109.05 -173.049 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' TRP . . . . . . . . . . . . . 34.4 m0 -109.09 141.6 41.02 Favored 'General case' 0 C--O 1.293 3.352 0 O-C-N 124.296 0.997 . . . . 15.619999999999999 109.573 -179.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' LYS . . . . . . . . . . . . . 77.7 tttt -89.84 130.52 36.07 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 107.342 -1.355 . . . . 18.510000000000002 107.342 177.244 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 23.6 m -137.48 163.2 31.64 Favored 'Isoleucine or valine' 0 CA--C 1.475 -1.908 0 CA-C-O 124.586 2.136 . . . . 12.81 108.503 -172.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -120.34 126.33 50.24 Favored 'General case' 0 C--O 1.181 -2.521 0 CA-C-N 114.025 -1.443 . . . . 35.289999999999999 109.939 174.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' VAL . . . . . . . . . . . . . 15.8 t -135.99 124.54 37.62 Favored 'Isoleucine or valine' 0 C--O 1.165 -3.393 0 C-N-CA 126.171 1.789 . . . . 26.100000000000001 106.266 -171.086 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ASN . . . . . 0.444 ' HB2' ' H ' ' A' ' 48' ' ' GLY . 0.9 OUTLIER 61.02 -126.25 0.91 Allowed 'General case' 0 N--CA 1.418 -2.049 0 N-CA-C 106.1 -1.815 . . . . 39.560000000000002 106.1 -168.695 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.444 ' H ' ' HB2' ' A' ' 47' ' ' ASN . . . -114.97 28.49 8.0 Favored Glycine 0 C--O 1.208 -1.472 0 C-N-CA 128.491 2.948 . . . . 25.600000000000001 115.639 174.63 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 62.5 mtt85 -122.19 148.01 45.47 Favored 'General case' 0 C--O 1.239 0.543 0 N-CA-C 108.151 -1.055 . . . . 50.969999999999999 108.151 176.143 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 87.5 mt-30 -117.84 145.95 44.22 Favored 'General case' 0 N--CA 1.495 1.796 0 N-CA-C 106.012 -1.848 . . . . 20.23 106.012 174.493 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 173.64 -173.97 45.99 Favored Glycine 0 C--O 1.261 1.807 0 N-CA-C 108.299 -1.921 . . . . 12.119999999999999 108.299 169.281 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' PHE . . . . . . . . . . . . . 76.1 m-85 -96.11 142.03 28.78 Favored 'General case' 0 C--O 1.254 1.332 0 N-CA-C 112.89 0.7 . . . . 16.739999999999998 112.89 -175.185 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 28.9 m -130.35 161.93 57.49 Favored Pre-proline 0 N--CA 1.512 2.675 0 CA-C-N 113.594 -1.639 . . . . 12.539999999999999 109.697 168.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' PRO . . . . . . . . . . . . . 72.9 Cg_exo -67.5 127.1 15.87 Favored 'Trans proline' 0 C--N 1.287 -2.676 0 CA-C-O 122.438 0.932 . . . . 13.220000000000001 109.784 -178.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.38 -32.1 66.47 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 113.749 1.018 . . . . 10.6 113.749 -179.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -66.53 -15.64 63.55 Favored 'General case' 0 C--O 1.3 3.748 0 CA-C-O 114.301 -2.762 . . . . 12.83 113.241 178.398 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 10.3 m-30 -99.19 11.15 39.88 Favored 'General case' 0 C--N 1.361 1.071 0 O-C-N 127.062 2.726 . . . . 12.59 110.468 -172.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 21.5 m -133.51 160.28 42.32 Favored 'Isoleucine or valine' 0 CA--C 1.477 -1.85 0 O-C-N 124.317 1.011 . . . . 13.82 111.113 171.368 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 61.3 tttt -123.02 124.68 43.68 Favored 'General case' 0 C--O 1.253 1.257 0 N-CA-C 105.247 -2.131 . . . . 33.969999999999999 105.247 -179.939 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' ALA . . . . . 0.417 ' HA ' HG12 ' A' ' 9' ' ' VAL . . . -69.64 135.13 49.54 Favored 'General case' 0 C--O 1.254 1.339 0 C-N-CA 119.238 -0.985 . . . . 16.489999999999998 109.103 175.835 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 84.7 mt -90.3 -32.41 16.53 Favored 'General case' 0 N--CA 1.503 2.192 0 N-CA-C 116.789 2.144 . . . . 25.16 116.789 179.473 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 53.4 p-10 . . . . . 0 N--CA 1.531 3.582 0 C-N-CA 128.746 2.818 . . . . 33.689999999999998 109.614 -170.242 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 63' ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 64' ' ' NH4 . . . . . 0.872 ' N ' ' OE1' ' A' ' 17' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' EDO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2002 ' ' HOH . . . . . 0.521 ' O ' ' HB1' ' A' ' 7' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2009 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2010 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2011 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2012 ' ' HOH . . . . . 0.621 ' O ' ' NZ ' ' A' ' 18' ' ' LYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 2013 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2014 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2015 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2016 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2017 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2018 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2019 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2020 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2021 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2022 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2023 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2024 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2025 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2026 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2027 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2028 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2029 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2030 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2031 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2032 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2033 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2034 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2035 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2036 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2037 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2038 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2039 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2040 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2041 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2042 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2043 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2044 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2045 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2046 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2047 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2048 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2049 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2050 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2051 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2052 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2053 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2054 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2055 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_