data_2j6o_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 2j6o _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' ' ' VAL . . . . . . . . . . . . . 3.0 p . . . . . 0 N--CA 1.492 1.668 0 N-CA-C 111.348 0.129 . . . . 30.68 111.348 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 -106.44 153.3 22.46 Favored 'General case' 0 C--O 1.221 -0.419 0 C-N-CA 123.449 0.7 . . . . 27.21 111.629 173.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 14.3 m-85 -125.49 151.3 46.47 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.663 0.785 . . . . 24.84 110.994 179.121 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 8.1 tt -109.38 135.65 47.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-N 115.972 -0.558 . . . . 21.64 109.875 177.008 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 21.2 t -81.71 127.27 39.73 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.621 0 N-CA-C 108.775 -0.824 . . . . 16.73 108.775 -178.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -107.26 -25.22 11.59 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 124.429 1.081 . . . . 30.58 113.8 179.843 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -137.75 135.46 36.4 Favored 'General case' 0 CA--C 1.508 -0.647 0 N-CA-C 109.117 -0.697 . . . . 22.64 109.117 179.461 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -56.87 139.52 51.19 Favored 'General case' 0 C--O 1.235 0.34 0 O-C-N 123.603 0.564 . . . . 22.7 111.769 176.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 86.4 t80 -141.29 133.44 27.87 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.209 -0.45 . . . . 19.88 110.1 173.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -106.12 131.83 52.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.447 -0.342 . . . . 26.05 110.78 178.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.27 141.77 45.57 Favored 'General case' 0 C--O 1.241 0.648 0 C-N-CA 122.94 0.496 . . . . 26.15 111.877 177.038 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 13.8 m -112.35 -18.94 7.24 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.304 0 CA-C-N 115.136 -0.938 . . . . 31.71 110.331 175.883 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 70.6 m-70 -133.44 159.44 40.33 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 108.192 -1.04 . . . . 37.29 108.192 170.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -67.56 -6.87 21.99 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 113.721 1.008 . . . . 45.18 113.721 -175.398 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 52.6 p30 -102.56 -2.16 29.03 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 113.882 1.067 . . . . 35.42 113.882 -179.747 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -93.45 160.29 14.87 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 108.669 -0.863 . . . . 26.24 108.669 175.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.5 mt -97.53 141.98 29.92 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 112.59 0.589 . . . . 23.56 112.59 172.799 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 99.3 m -91.16 118.63 30.6 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 107.586 -1.264 . . . . 22.84 107.586 164.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' ILE . . . . . . . . . . . . . 26.7 pt -127.78 152.56 36.01 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.635 0 N-CA-C 108.407 -0.961 . . . . 19.37 108.407 -165.866 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 78.9 mmt-85 -132.77 142.01 48.8 Favored 'General case' 0 C--O 1.248 0.974 0 N-CA-C 113.776 1.028 . . . . 18.72 113.776 -177.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 18.6 t -38.12 124.98 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 CA-C-N 116.01 -0.541 . . . . 17.47 112.417 179.307 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 98.83 -21.33 46.44 Favored Glycine 0 CA--C 1.523 0.567 0 N-CA-C 116.553 1.381 . . . . 18.82 116.553 178.8 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 70.5 mt-10 -68.88 145.41 53.72 Favored 'General case' 0 C--O 1.219 -0.542 0 N-CA-C 112.428 0.529 . . . . 16.59 112.428 178.723 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 19.5 mm -102.47 129.08 54.55 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 N-CA-C 107.223 -1.399 . . . . 20.95 107.223 177.049 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 42.8 mt -101.91 124.33 55.68 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.614 0 N-CA-C 107.418 -1.326 . . . . 18.52 107.418 175.66 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 18.5 mtt180 -95.6 146.95 24.08 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 115.594 1.702 . . . . 21.55 115.594 -173.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 61.13 55.48 3.01 Favored 'General case' 0 C--O 1.248 0.989 0 CA-C-O 122.838 1.304 . . . . 24.05 109.55 166.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 76.5 t -91.97 126.24 44.57 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 113.126 -1.852 . . . . 26.15 113.127 -168.288 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.2 mttt -117.37 138.45 51.79 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 114.569 -1.196 . . . . 42.51 111.026 -177.041 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.52 134.7 37.25 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.086 0.954 . . . . 33.31 108.768 175.512 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 18.4 mt -108.54 170.44 8.02 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 114.183 1.179 . . . . 37.71 114.183 -176.295 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -66.23 -45.48 80.52 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 116.0 -0.546 . . . . 40.38 112.075 178.587 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -52.31 108.81 0.32 Allowed 'General case' 0 CA--C 1.528 0.127 0 N-CA-C 108.114 -1.069 . . . . 38.54 108.114 167.637 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -68.39 132.08 46.42 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.312 -0.858 . . . . 33.27 111.3 -175.886 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 90.88 1.1 73.79 Favored Glycine 0 CA--C 1.53 1.014 0 CA-C-N 116.183 -0.462 . . . . 28.28 114.121 -174.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 84.0 m95 -120.73 147.58 45.11 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 113.34 0.867 . . . . 23.14 113.34 -176.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 84.9 mt -132.99 162.21 32.27 Favored 'General case' 0 C--O 1.24 0.566 0 CA-C-N 114.487 -1.233 . . . . 23.91 108.774 -176.949 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -134.26 130.38 37.03 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.74 -0.664 . . . . 43.4 109.337 179.575 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -161.79 -175.91 33.33 Favored Glycine 0 CA--C 1.504 -0.614 0 N-CA-C 110.525 -1.03 . . . . 20.08 110.525 -178.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -112.44 129.57 56.28 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 113.011 0.745 . . . . 32.1 113.011 -174.373 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 61.6 tp -132.76 120.77 22.07 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 115.462 -0.79 . . . . 22.89 112.949 176.084 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 51.47 48.01 23.74 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-O 121.315 0.579 . . . . 30.74 111.407 -175.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 84.54 -21.1 11.46 Favored Glycine 0 CA--C 1.522 0.495 0 N-CA-C 117.515 1.766 . . . . 33.01 117.515 178.712 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 52.9 ttp85 -100.06 138.22 37.44 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 115.155 1.539 . . . . 45.68 115.155 -178.617 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 54.7 mtp85 -98.56 136.03 39.25 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.482 0.549 . . . . 38.71 112.482 174.657 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -165.19 -177.34 37.57 Favored Glycine 0 C--O 1.217 -0.95 0 N-CA-C 109.627 -1.389 . . . . 23.54 109.627 178.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 13.2 ptp -105.23 152.98 22.19 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 112.963 0.727 . . . . 33.81 112.963 179.597 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 14.7 p90 -152.72 149.43 22.3 Favored Pre-proline 0 C--O 1.244 0.803 0 N-CA-C 108.579 -0.897 . . . . 21.48 108.579 -177.384 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -70.06 135.47 29.82 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 121.435 1.423 . . . . 18.64 112.257 -174.935 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' ASP . . . . . . . . . . . . 0.252 58.6 p30 -69.19 -17.89 63.85 Favored 'General case' 0 N--CA 1.483 1.182 0 N-CA-C 117.366 2.358 . . . . 25.32 117.366 -172.841 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 22.1 p-10 -93.74 9.87 35.28 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 113.868 1.062 . . . . 25.56 113.868 -179.729 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -98.2 -3.35 37.75 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.103 -0.499 . . . . 21.91 110.048 172.119 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 27.1 m -137.47 165.33 27.22 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 CA-C-N 115.139 -0.937 . . . . 20.47 110.558 -169.469 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 26.2 tttp -137.63 132.95 33.76 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-N 115.533 -0.758 . . . . 24.52 110.538 177.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -65.08 127.52 31.97 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-N 116.242 -0.435 . . . . 36.5 110.878 179.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 11.8 mt -75.57 129.7 36.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 N-CA-C 108.819 -0.808 . . . . 29.5 108.819 172.405 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 79.2 mttt . . . . . 0 N--CA 1.473 0.68 0 C-N-CA 123.426 0.691 . . . . 44.29 110.091 -177.22 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 327' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_exo . . . . . 0 N--CA 1.457 -0.64 0 N-CA-C 111.752 -0.134 . . . . 30.43 111.752 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C ' 328' ' ' LEU . . . . . . . . . . . . . 3.1 mp -117.99 122.6 30.32 Favored Pre-proline 0 C--N 1.329 -0.313 0 O-C-N 123.877 0.736 . . . . 27.23 110.269 178.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 329' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -74.88 -167.43 0.42 Allowed 'Trans proline' 0 N--CA 1.454 -0.801 0 O-C-N 122.761 0.874 . . . . 24.27 110.555 174.029 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 330' ' ' ARG . . . . . . . . . . . . . 40.4 mtp180 -124.68 89.84 51.78 Favored Pre-proline 0 C--N 1.322 -0.592 0 N-CA-C 106.714 -1.587 . . . . 24.19 106.714 174.855 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 331' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_exo -47.67 149.0 5.29 Favored 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 123.582 2.855 . . . . 23.17 109.622 -168.494 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 332' ' ' ARG . . . . . . . . . . . . . 44.1 mtm105 -103.61 134.3 47.18 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 113.145 0.795 . . . . 29.19 113.145 -173.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' C' C ' 333' ' ' VAL . . . . . . . . . . . . . 21.2 t . . . . . 0 C--O 1.236 0.355 0 CA-C-N 116.141 -0.481 . . . . 30.29 110.215 174.44 . . . . . . . . 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 0 . 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 ' C' C 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' C' C 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' VAL . . . . . 0.525 HG21 ' HG3' ' A' ' 56' ' ' GLU . 3.0 p . . . . . 0 N--CA 1.492 1.668 0 N-CA-C 111.348 0.129 . . . . 30.68 111.348 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 -106.44 153.3 22.46 Favored 'General case' 0 C--O 1.221 -0.419 0 C-N-CA 123.449 0.7 . . . . 27.210000000000001 111.629 173.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 14.3 m-85 -125.49 151.3 46.47 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.663 0.785 . . . . 24.84 110.994 179.121 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 8.1 tt -109.38 135.65 47.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-N 115.972 -0.558 . . . . 21.640000000000001 109.875 177.008 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 21.2 t -81.71 127.27 39.73 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.621 0 N-CA-C 108.775 -0.824 . . . . 16.73 108.775 -178.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -107.26 -25.22 11.59 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 124.429 1.081 . . . . 30.579999999999998 113.8 179.843 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -137.75 135.46 36.4 Favored 'General case' 0 CA--C 1.508 -0.647 0 N-CA-C 109.117 -0.697 . . . . 22.640000000000001 109.117 179.461 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -56.87 139.52 51.19 Favored 'General case' 0 C--O 1.235 0.34 0 O-C-N 123.603 0.564 . . . . 22.699999999999999 111.769 176.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 86.4 t80 -141.29 133.44 27.87 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.209 -0.45 . . . . 19.879999999999999 110.1 173.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -106.12 131.83 52.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.447 -0.342 . . . . 26.050000000000001 110.78 178.215 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.27 141.77 45.57 Favored 'General case' 0 C--O 1.241 0.648 0 C-N-CA 122.94 0.496 . . . . 26.149999999999999 111.877 177.038 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 13.8 m -112.35 -18.94 7.24 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.304 0 CA-C-N 115.136 -0.938 . . . . 31.710000000000001 110.331 175.883 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 70.6 m-70 -133.44 159.44 40.33 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 108.192 -1.04 . . . . 37.289999999999999 108.192 170.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -67.56 -6.87 21.99 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 113.721 1.008 . . . . 45.18 113.721 -175.398 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 52.6 p30 -102.56 -2.16 29.03 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 113.882 1.067 . . . . 35.420000000000002 113.882 -179.747 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -93.45 160.29 14.87 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 108.669 -0.863 . . . . 26.239999999999998 108.669 175.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.5 mt -97.53 141.98 29.92 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 112.59 0.589 . . . . 23.559999999999999 112.59 172.799 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 99.3 m -91.16 118.63 30.6 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 107.586 -1.264 . . . . 22.84 107.586 164.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' ILE . . . . . 0.538 HG22 HD22 ' A' ' 42' ' ' LEU . 26.7 pt -127.78 152.56 36.01 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.635 0 N-CA-C 108.407 -0.961 . . . . 19.370000000000001 108.407 -165.866 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 78.9 mmt-85 -132.77 142.01 48.8 Favored 'General case' 0 C--O 1.248 0.974 0 N-CA-C 113.776 1.028 . . . . 18.719999999999999 113.776 -177.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 18.6 t -38.12 124.98 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 CA-C-N 116.01 -0.541 . . . . 17.469999999999999 112.417 179.307 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 98.83 -21.33 46.44 Favored Glycine 0 CA--C 1.523 0.567 0 N-CA-C 116.553 1.381 . . . . 18.82 116.553 178.8 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 70.5 mt-10 -68.88 145.41 53.72 Favored 'General case' 0 C--O 1.219 -0.542 0 N-CA-C 112.428 0.529 . . . . 16.59 112.428 178.723 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 19.5 mm -102.47 129.08 54.55 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 N-CA-C 107.223 -1.399 . . . . 20.949999999999999 107.223 177.049 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 42.8 mt -101.91 124.33 55.68 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.614 0 N-CA-C 107.418 -1.326 . . . . 18.52 107.418 175.66 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 18.5 mtt180 -95.6 146.95 24.08 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 115.594 1.702 . . . . 21.550000000000001 115.594 -173.789 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 61.13 55.48 3.01 Favored 'General case' 0 C--O 1.248 0.989 0 CA-C-O 122.838 1.304 . . . . 24.050000000000001 109.55 166.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 76.5 t -91.97 126.24 44.57 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 113.126 -1.852 . . . . 26.149999999999999 113.127 -168.288 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.2 mttt -117.37 138.45 51.79 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 114.569 -1.196 . . . . 42.509999999999998 111.026 -177.041 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.52 134.7 37.25 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.086 0.954 . . . . 33.310000000000002 108.768 175.512 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 18.4 mt -108.54 170.44 8.02 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 114.183 1.179 . . . . 37.710000000000001 114.183 -176.295 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -66.23 -45.48 80.52 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 116.0 -0.546 . . . . 40.380000000000003 112.075 178.587 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -52.31 108.81 0.32 Allowed 'General case' 0 CA--C 1.528 0.127 0 N-CA-C 108.114 -1.069 . . . . 38.539999999999999 108.114 167.637 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -68.39 132.08 46.42 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.312 -0.858 . . . . 33.439999999999998 111.3 -175.886 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 90.88 1.1 73.79 Favored Glycine 0 CA--C 1.53 1.014 0 CA-C-N 116.183 -0.462 . . . . 28.280000000000001 114.121 -174.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 84.0 m95 -120.73 147.58 45.11 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 113.34 0.867 . . . . 23.140000000000001 113.34 -176.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 38' ' ' LEU . . . . . 0.406 ' HG ' ' HB3' ' A' ' 51' ' ' ASP . 84.9 mt -132.99 162.21 32.27 Favored 'General case' 0 C--O 1.24 0.566 0 CA-C-N 114.487 -1.233 . . . . 23.91 108.774 -176.949 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -134.26 130.38 37.03 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.74 -0.664 . . . . 43.399999999999999 109.337 179.575 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -161.79 -175.91 33.33 Favored Glycine 0 CA--C 1.504 -0.614 0 N-CA-C 110.525 -1.03 . . . . 20.079999999999998 110.525 -178.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -112.44 129.57 56.28 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 113.011 0.745 . . . . 32.100000000000001 113.011 -174.373 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 42' ' ' LEU . . . . . 0.538 HD22 HG22 ' A' ' 20' ' ' ILE . 61.6 tp -132.76 120.77 22.07 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 115.462 -0.79 . . . . 22.890000000000001 112.949 176.084 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 51.47 48.01 23.74 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-O 121.315 0.579 . . . . 30.739999999999998 111.407 -175.229 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 84.54 -21.1 11.46 Favored Glycine 0 CA--C 1.522 0.495 0 N-CA-C 117.515 1.766 . . . . 33.009999999999998 117.515 178.712 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 52.9 ttp85 -100.06 138.22 37.44 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 115.155 1.539 . . . . 45.68 115.155 -178.617 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 54.7 mtp85 -98.56 136.03 39.25 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.482 0.549 . . . . 38.710000000000001 112.482 174.657 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -165.19 -177.34 37.57 Favored Glycine 0 C--O 1.217 -0.95 0 N-CA-C 109.627 -1.389 . . . . 23.539999999999999 109.627 178.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 13.2 ptp -105.23 152.98 22.19 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 112.963 0.727 . . . . 33.810000000000002 112.963 179.597 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 14.7 p90 -152.72 149.43 22.3 Favored Pre-proline 0 C--O 1.244 0.803 0 N-CA-C 108.579 -0.897 . . . . 21.48 108.579 -177.384 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -70.06 135.47 29.82 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 121.435 1.423 . . . . 18.640000000000001 112.257 -174.935 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 51' ' ' ASP . . . . . 0.406 ' HB3' ' HG ' ' A' ' 38' ' ' LEU 0.252 58.6 p30 -69.19 -17.89 63.85 Favored 'General case' 0 N--CA 1.483 1.182 0 N-CA-C 117.366 2.358 . . . . 25.32 117.366 -172.841 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 22.1 p-10 -93.74 9.87 35.28 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 113.868 1.062 . . . . 25.559999999999999 113.868 -179.729 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -98.2 -3.35 37.75 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.103 -0.499 . . . . 21.91 110.048 172.119 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 27.1 m -137.47 165.33 27.22 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 CA-C-N 115.139 -0.937 . . . . 20.469999999999999 110.558 -169.469 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 26.2 tttp -137.63 132.95 33.76 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-N 115.533 -0.758 . . . . 24.52 110.538 177.485 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' GLU . . . . . 0.525 ' HG3' HG21 ' A' ' 2' ' ' VAL . 41.5 tt0 -65.08 127.52 31.97 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-N 116.242 -0.435 . . . . 36.5 110.878 179.099 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 11.8 mt -75.57 129.7 36.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 N-CA-C 108.819 -0.808 . . . . 29.5 108.819 172.405 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 79.2 mttt . . . . . 0 N--CA 1.473 0.68 0 C-N-CA 123.426 0.691 . . . . 44.289999999999999 110.091 -177.22 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 327' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_exo . . . . . 0 N--CA 1.457 -0.64 0 N-CA-C 111.752 -0.134 . . . . 30.43 111.752 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C ' 328' ' ' LEU . . . . . . . . . . . . . 3.1 mp -117.99 122.6 30.32 Favored Pre-proline 0 C--N 1.329 -0.313 0 O-C-N 123.877 0.736 . . . . 27.23 110.269 178.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 329' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -74.88 -167.43 0.42 Allowed 'Trans proline' 0 N--CA 1.454 -0.801 0 O-C-N 122.761 0.874 . . . . 24.27 110.555 174.029 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 330' ' ' ARG . . . . . . . . . . . . . 40.4 mtp180 -124.68 89.84 51.78 Favored Pre-proline 0 C--N 1.322 -0.592 0 N-CA-C 106.714 -1.587 . . . . 24.190000000000001 106.714 174.855 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 331' ' ' PRO . . . . . 0.428 ' HG3' ' O ' ' A' 2009 ' ' HOH . 53.2 Cg_exo -47.67 149.0 5.29 Favored 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 123.582 2.855 . . . . 23.170000000000002 109.622 -168.494 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' C' C ' 332' ' ' ARG . . . . . . . . . . . . . 44.1 mtm105 -103.61 134.3 47.18 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 113.145 0.795 . . . . 29.190000000000001 113.145 -173.53 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' C' C ' 333' ' ' VAL . . . . . . . . . . . . . 21.2 t . . . . . 0 C--O 1.236 0.355 0 CA-C-N 116.141 -0.481 . . . . 30.289999999999999 110.215 174.44 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 . . . . . 0.428 ' O ' ' HG3' ' C' ' 331' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 0 . 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 ' C' C 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' C' C 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.525 HG21 ' HG3' ' A' ' 56' ' ' GLU . 3.0 p . . . . . 0 N--CA 1.492 1.668 0 N-CA-C 111.348 0.129 . . . . 30.68 111.348 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 -106.44 153.3 22.46 Favored 'General case' 0 C--O 1.221 -0.419 0 C-N-CA 123.449 0.7 . . . . 27.210000000000001 111.629 173.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' TYR . . . . . . . . . . . . . 14.3 m-85 -125.49 151.3 46.47 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.663 0.785 . . . . 24.84 110.994 179.121 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 8.1 tt -109.38 135.65 47.68 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-N 115.972 -0.558 . . . . 21.640000000000001 109.875 177.008 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 21.2 t -81.71 127.27 39.73 Favored 'Isoleucine or valine' 0 CA--C 1.509 -0.621 0 N-CA-C 108.775 -0.824 . . . . 16.73 108.775 -178.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -107.26 -25.22 11.59 Favored 'General case' 0 N--CA 1.467 0.399 0 O-C-N 124.429 1.081 . . . . 30.579999999999998 113.8 179.843 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 98.7 m-85 -137.75 135.46 36.4 Favored 'General case' 0 CA--C 1.508 -0.647 0 N-CA-C 109.117 -0.697 . . . . 22.640000000000001 109.117 179.461 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 86.2 m-20 -56.87 139.52 51.19 Favored 'General case' 0 C--O 1.235 0.34 0 O-C-N 123.603 0.564 . . . . 22.699999999999999 111.769 176.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 86.4 t80 -141.29 133.44 27.87 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.209 -0.45 . . . . 19.879999999999999 110.1 173.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' ASP . . . . . . . . . . . . . 76.2 m-20 -106.12 131.83 52.91 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.447 -0.342 . . . . 26.050000000000001 110.78 178.215 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -57.27 141.77 45.57 Favored 'General case' 0 C--O 1.241 0.648 0 C-N-CA 122.94 0.496 . . . . 26.149999999999999 111.877 177.038 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 13.8 m -112.35 -18.94 7.24 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.304 0 CA-C-N 115.136 -0.938 . . . . 31.710000000000001 110.331 175.883 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' HIS . . . . . . . . . . . . . 70.6 m-70 -133.44 159.44 40.33 Favored 'General case' 0 N--CA 1.463 0.219 0 N-CA-C 108.192 -1.04 . . . . 37.289999999999999 108.192 170.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 -67.56 -6.87 21.99 Favored 'General case' 0 CA--C 1.542 0.667 0 N-CA-C 113.721 1.008 . . . . 45.18 113.721 -175.398 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 52.6 p30 -102.56 -2.16 29.03 Favored 'General case' 0 CA--C 1.541 0.629 0 N-CA-C 113.882 1.067 . . . . 35.420000000000002 113.882 -179.747 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -93.45 160.29 14.87 Favored 'General case' 0 CA--C 1.51 -0.587 0 N-CA-C 108.669 -0.863 . . . . 26.239999999999998 108.669 175.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 94.5 mt -97.53 141.98 29.92 Favored 'General case' 0 N--CA 1.47 0.533 0 N-CA-C 112.59 0.589 . . . . 23.559999999999999 112.59 172.799 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 99.3 m -91.16 118.63 30.6 Favored 'General case' 0 N--CA 1.464 0.263 0 N-CA-C 107.586 -1.264 . . . . 22.84 107.586 164.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' ILE . . . . . 0.538 HG22 HD22 ' A' ' 42' ' ' LEU . 26.7 pt -127.78 152.56 36.01 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.635 0 N-CA-C 108.407 -0.961 . . . . 19.370000000000001 108.407 -165.866 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 78.9 mmt-85 -132.77 142.01 48.8 Favored 'General case' 0 C--O 1.248 0.974 0 N-CA-C 113.776 1.028 . . . . 18.719999999999999 113.776 -177.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 18.6 t -38.12 124.98 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.595 0 CA-C-N 116.01 -0.541 . . . . 17.469999999999999 112.417 179.307 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 98.83 -21.33 46.44 Favored Glycine 0 CA--C 1.523 0.567 0 N-CA-C 116.553 1.381 . . . . 18.82 116.553 178.8 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 70.5 mt-10 -68.88 145.41 53.72 Favored 'General case' 0 C--O 1.219 -0.542 0 N-CA-C 112.428 0.529 . . . . 16.59 112.428 178.723 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 19.5 mm -102.47 129.08 54.55 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 N-CA-C 107.223 -1.399 . . . . 20.949999999999999 107.223 177.049 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' ILE . . . . . . . . . . . . . 42.8 mt -101.91 124.33 55.68 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.614 0 N-CA-C 107.418 -1.326 . . . . 18.52 107.418 175.66 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 18.5 mtt180 -95.6 146.95 24.08 Favored 'General case' 0 N--CA 1.471 0.614 0 N-CA-C 115.594 1.702 . . . . 21.550000000000001 115.594 -173.789 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 61.13 55.48 3.01 Favored 'General case' 0 C--O 1.248 0.989 0 CA-C-O 122.838 1.304 . . . . 24.050000000000001 109.55 166.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 76.5 t -91.97 126.24 44.57 Favored 'Isoleucine or valine' 0 C--O 1.234 0.278 0 CA-C-N 113.126 -1.852 . . . . 26.149999999999999 113.127 -168.288 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 4.2 mttt -117.37 138.45 51.79 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 114.569 -1.196 . . . . 42.509999999999998 111.026 -177.041 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.52 134.7 37.25 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 124.086 0.954 . . . . 33.310000000000002 108.768 175.512 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 18.4 mt -108.54 170.44 8.02 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 114.183 1.179 . . . . 37.710000000000001 114.183 -176.295 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -66.23 -45.48 80.52 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 116.0 -0.546 . . . . 40.380000000000003 112.075 178.587 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -52.31 108.81 0.32 Allowed 'General case' 0 CA--C 1.528 0.127 0 N-CA-C 108.114 -1.069 . . . . 38.539999999999999 108.114 167.637 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -68.39 132.08 46.42 Favored 'General case' 0 C--N 1.331 -0.196 0 CA-C-N 115.312 -0.858 . . . . 33.439999999999998 111.3 -175.886 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' GLY . . . . . . . . . . . . . . . 90.88 1.1 73.79 Favored Glycine 0 CA--C 1.53 1.014 0 CA-C-N 116.183 -0.462 . . . . 28.280000000000001 114.121 -174.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 84.0 m95 -120.73 147.58 45.11 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 113.34 0.867 . . . . 23.140000000000001 113.34 -176.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' LEU . . . . . 0.406 ' HG ' ' HB3' ' A' ' 51' ' ' ASP . 84.9 mt -132.99 162.21 32.27 Favored 'General case' 0 C--O 1.24 0.566 0 CA-C-N 114.487 -1.233 . . . . 23.91 108.774 -176.949 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -134.26 130.38 37.03 Favored 'General case' 0 N--CA 1.442 -0.832 0 CA-C-N 115.74 -0.664 . . . . 43.399999999999999 109.337 179.575 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -161.79 -175.91 33.33 Favored Glycine 0 CA--C 1.504 -0.614 0 N-CA-C 110.525 -1.03 . . . . 20.079999999999998 110.525 -178.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' GLU . . . . . . . . . . . . . 17.1 tt0 -112.44 129.57 56.28 Favored 'General case' 0 C--N 1.321 -0.639 0 N-CA-C 113.011 0.745 . . . . 32.100000000000001 113.011 -174.373 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.538 HD22 HG22 ' A' ' 20' ' ' ILE . 61.6 tp -132.76 120.77 22.07 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 115.462 -0.79 . . . . 22.890000000000001 112.949 176.084 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' ASN . . . . . . . . . . . . . 24.1 t-20 51.47 48.01 23.74 Favored 'General case' 0 N--CA 1.479 0.988 0 CA-C-O 121.315 0.579 . . . . 30.739999999999998 111.407 -175.229 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLY . . . . . . . . . . . . . . . 84.54 -21.1 11.46 Favored Glycine 0 CA--C 1.522 0.495 0 N-CA-C 117.515 1.766 . . . . 33.009999999999998 117.515 178.712 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' ARG . . . . . . . . . . . . . 52.9 ttp85 -100.06 138.22 37.44 Favored 'General case' 0 N--CA 1.475 0.81 0 N-CA-C 115.155 1.539 . . . . 45.68 115.155 -178.617 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 54.7 mtp85 -98.56 136.03 39.25 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 112.482 0.549 . . . . 38.710000000000001 112.482 174.657 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' GLY . . . . . . . . . . . . . . . -165.19 -177.34 37.57 Favored Glycine 0 C--O 1.217 -0.95 0 N-CA-C 109.627 -1.389 . . . . 23.539999999999999 109.627 178.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' MET . . . . . . . . . . . . . 13.2 ptp -105.23 152.98 22.19 Favored 'General case' 0 N--CA 1.451 -0.405 0 N-CA-C 112.963 0.727 . . . . 33.810000000000002 112.963 179.597 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 14.7 p90 -152.72 149.43 22.3 Favored Pre-proline 0 C--O 1.244 0.803 0 N-CA-C 108.579 -0.897 . . . . 21.48 108.579 -177.384 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' PRO . . . . . . . . . . . . . 18.3 Cg_endo -70.06 135.47 29.82 Favored 'Trans proline' 0 C--N 1.349 0.573 0 C-N-CA 121.435 1.423 . . . . 18.640000000000001 112.257 -174.935 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' ASP . . . . . 0.406 ' HB3' ' HG ' ' A' ' 38' ' ' LEU 0.252 58.6 p30 -69.19 -17.89 63.85 Favored 'General case' 0 N--CA 1.483 1.182 0 N-CA-C 117.366 2.358 . . . . 25.32 117.366 -172.841 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 22.1 p-10 -93.74 9.87 35.28 Favored 'General case' 0 C--N 1.319 -0.742 0 N-CA-C 113.868 1.062 . . . . 25.559999999999999 113.868 -179.729 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' PHE . . . . . . . . . . . . . 19.5 m-85 -98.2 -3.35 37.75 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 116.103 -0.499 . . . . 21.91 110.048 172.119 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 27.1 m -137.47 165.33 27.22 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.62 0 CA-C-N 115.139 -0.937 . . . . 20.469999999999999 110.558 -169.469 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' LYS . . . . . . . . . . . . . 26.2 tttp -137.63 132.95 33.76 Favored 'General case' 0 C--O 1.242 0.704 0 CA-C-N 115.533 -0.758 . . . . 24.52 110.538 177.485 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.525 ' HG3' HG21 ' A' ' 2' ' ' VAL . 41.5 tt0 -65.08 127.52 31.97 Favored 'General case' 0 CA--C 1.515 -0.379 0 CA-C-N 116.242 -0.435 . . . . 36.5 110.878 179.099 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 11.8 mt -75.57 129.7 36.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.399 0 N-CA-C 108.819 -0.808 . . . . 29.5 108.819 172.405 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 79.2 mttt . . . . . 0 N--CA 1.473 0.68 0 C-N-CA 123.426 0.691 . . . . 44.289999999999999 110.091 -177.22 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 327' ' ' PRO . . . . . . . . . . . . . 13.2 Cg_exo . . . . . 0 N--CA 1.457 -0.64 0 N-CA-C 111.752 -0.134 . . . . 30.43 111.752 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C ' 328' ' ' LEU . . . . . . . . . . . . . 3.1 mp -117.99 122.6 30.32 Favored Pre-proline 0 C--N 1.329 -0.313 0 O-C-N 123.877 0.736 . . . . 27.23 110.269 178.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 329' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -74.88 -167.43 0.42 Allowed 'Trans proline' 0 N--CA 1.454 -0.801 0 O-C-N 122.761 0.874 . . . . 24.27 110.555 174.029 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 330' ' ' ARG . . . . . . . . . . . . . 40.4 mtp180 -124.68 89.84 51.78 Favored Pre-proline 0 C--N 1.322 -0.592 0 N-CA-C 106.714 -1.587 . . . . 24.190000000000001 106.714 174.855 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 331' ' ' PRO . . . . . 0.428 ' HG3' ' O ' ' A' 2009 ' ' HOH . 53.2 Cg_exo -47.67 149.0 5.29 Favored 'Trans proline' 0 N--CA 1.458 -0.6 0 C-N-CA 123.582 2.855 . . . . 23.170000000000002 109.622 -168.494 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' C' C ' 332' ' ' ARG . . . . . . . . . . . . . 44.1 mtm105 -103.61 134.3 47.18 Favored 'General case' 0 C--N 1.326 -0.437 0 N-CA-C 113.145 0.795 . . . . 29.190000000000001 113.145 -173.53 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' C' C ' 333' ' ' VAL . . . . . . . . . . . . . 21.2 t . . . . . 0 C--O 1.236 0.355 0 CA-C-N 116.141 -0.481 . . . . 30.289999999999999 110.215 174.44 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 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 . . . . . 0.428 ' O ' ' HG3' ' C' ' 331' ' ' PRO . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 0 . 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 ' C' C 2001 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' C' C 2002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_