data_1c7h_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 1c7h _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' ' ' ASN . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.031 0 N-CA-C 108.261 -1.015 . . . . 54.97 108.261 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 14.2 tp -66.79 120.2 69.5 Favored Pre-proline 0 C--O 1.24 0.575 0 N-CA-C 102.554 -3.128 . . . . 51.94 102.554 177.16 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 4' ' ' PRO . . . . . . . . . . . . . 32.9 Cg_exo -52.4 147.3 29.59 Favored 'Trans proline' 0 N--CA 1.46 -0.484 0 N-CA-C 117.684 2.148 . . . . 38.23 117.684 -178.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 5' ' ' THR . . . . . 0.544 ' OG1' ' CG ' ' A' ' 8' ' ' GLU . 26.8 p -84.25 162.77 20.03 Favored 'General case' 0 C--O 1.246 0.899 0 N-CA-C 102.566 -3.124 . . . . 28.5 102.566 177.684 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -48.29 -42.56 31.16 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 109.215 -0.661 . . . . 20.85 109.215 179.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.26 -33.55 76.26 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 115.115 1.524 . . . . 63.84 115.115 -179.824 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 8' ' ' GLU . . . . . 0.544 ' CG ' ' OG1' ' A' ' 5' ' ' THR . 1.0 OUTLIER -78.23 -35.59 48.14 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 109.325 -0.62 . . . . 50.47 109.325 -178.242 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 9' ' ' VAL . . . . . . . . . . . . . 42.2 t -60.8 -41.41 88.46 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.848 0 N-CA-C 108.303 -0.999 . . . . 22.66 108.303 179.156 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 7.8 mt-30 -62.16 -41.81 98.67 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 119.057 -1.057 . . . . 27.77 110.966 179.593 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -67.05 -39.47 92.99 Favored Glycine 0 N--CA 1.447 -0.602 0 CA-C-O 118.899 -0.945 . . . . 14.69 112.709 -179.64 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 13.0 mt -66.32 -40.77 90.16 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-N 117.848 0.824 . . . . 19.44 112.358 -179.537 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 80.8 mtp -70.63 -36.26 73.36 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-N 115.494 -0.775 . . . . 22.66 110.752 -179.439 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.66 -37.33 82.24 Favored 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 106.674 -1.602 . . . . 18.44 106.674 179.109 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.0 ttt180 -61.17 -43.14 99.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.301 -0.863 . . . . 36.08 110.264 178.816 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -58.24 -38.19 76.39 Favored 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 113.189 0.811 . . . . 26.4 113.189 -179.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 7.4 mm -71.07 -25.57 25.89 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.736 0 O-C-N 121.535 -0.728 . . . . 18.7 109.342 177.577 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.04 -53.8 27.74 Favored 'General case' 0 C--O 1.21 -0.987 0 N-CA-C 107.766 -1.198 . . . . 64.3 107.766 178.338 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 14.8 mt -54.74 -47.73 73.47 Favored 'General case' 0 N--CA 1.429 -1.476 0 CA-C-N 116.282 -0.417 . . . . 25.85 110.747 178.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 59.0 t -62.7 -32.07 54.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 O-C-N 121.227 -0.921 . . . . 21.15 113.202 -179.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 21' ' ' ASP . . . . . . . . . . . . . 22.2 t0 -67.11 -42.13 85.07 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.991 -0.55 . . . . 28.64 111.063 179.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 17.7 m -83.75 -18.08 10.24 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.747 0 N-CA-C 109.645 -0.502 . . . . 33.33 109.645 179.081 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 76.43 26.91 62.44 Favored Glycine 0 N--CA 1.441 -1.014 0 C-N-CA 118.665 -1.731 . . . . 24.7 113.481 179.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 38.4 t0 -82.98 84.9 7.28 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 106.622 -1.621 . . . . 27.13 106.622 177.447 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 25' ' ' ILE . . . . . . . . . . . . . 25.3 mt -57.01 -35.94 49.18 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 N-CA-C 116.416 2.006 . . . . 20.01 116.416 -177.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -68.32 -43.25 77.99 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.709 -0.678 . . . . 59.63 111.261 -178.532 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -66.13 -31.34 72.13 Favored 'General case' 0 C--O 1.241 0.639 0 O-C-N 123.482 0.489 . . . . 20.75 112.116 179.997 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 62.3 mt -69.57 -53.75 23.08 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 N-CA-C 108.33 -0.989 . . . . 19.06 108.33 179.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 29' ' ' VAL . . . . . . . . . . . . . 97.6 t -55.9 -32.81 33.59 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.039 0 CA-C-N 115.42 -0.809 . . . . 17.53 109.918 -178.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 25.1 tp60 -76.56 -11.61 59.89 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 119.283 -0.967 . . . . 58.06 113.186 -178.333 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 27.1 mtp -79.32 -17.98 53.48 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 108.087 -1.079 . . . . 24.71 108.087 178.403 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 46.2 m-85 -87.31 164.56 16.21 Favored 'General case' 0 CA--C 1.505 -0.781 0 N-CA-C 114.12 1.156 . . . . 22.77 114.12 -179.12 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -82.27 155.31 24.91 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 102.829 -3.026 . . . . 15.88 102.829 177.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 34' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -54.1 -32.14 54.04 Favored 'General case' 0 CA--C 1.51 -0.581 0 O-C-N 123.781 0.676 . . . . 24.36 110.584 -179.184 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 28.3 p-10 -121.09 30.39 6.87 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 115.496 1.665 . . . . 31.56 115.496 -179.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.15 175.79 0.38 Allowed 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 109.27 -0.641 . . . . 19.54 109.27 179.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 73.2 p -135.93 149.3 48.89 Favored 'General case' 0 C--O 1.219 -0.547 0 N-CA-C 105.884 -1.895 . . . . 21.43 105.884 175.059 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 38' ' ' VAL . . . . . . . . . . . . . 4.2 t -124.48 143.29 38.42 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.5 0 N-CA-C 105.843 -1.91 . . . . 18.26 105.843 -179.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.0 mt-10 -130.26 96.13 4.08 Favored 'General case' 0 CA--C 1.498 -1.041 0 N-CA-C 103.734 -2.691 . . . . 42.2 103.734 178.546 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 52.0 t0 -145.75 113.51 4.64 Favored Pre-proline 0 CA--C 1.515 -0.401 0 O-C-N 124.217 0.948 . . . . 30.15 108.499 -177.684 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -79.77 158.22 88.67 Favored 'Cis proline' 0 N--CA 1.456 -0.726 0 C-N-CA 123.006 -1.664 . . . . 28.76 109.024 -0.268 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -57.88 131.77 51.38 Favored 'General case' 0 N--CA 1.441 -0.922 0 N-CA-C 106.6 -1.63 . . . . 36.2 106.6 179.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 116.64 -10.89 16.12 Favored Glycine 0 C--O 1.227 -0.34 0 N-CA-C 111.054 -0.818 . . . . 44.41 111.054 -179.406 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -105.21 160.26 26.61 Favored Pre-proline 0 N--CA 1.446 -0.667 0 N-CA-C 106.65 -1.611 . . . . 70.72 106.65 178.379 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -59.26 146.43 94.67 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 117.541 -1.173 . . . . 42.56 109.795 178.957 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -76.21 152.97 35.82 Favored 'Trans proline' 0 CA--C 1.506 -0.904 0 C-N-CA 123.998 3.132 . . . . 38.69 114.809 -179.424 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 47' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -106.86 134.66 47.86 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.738 0 N-CA-C 103.407 -2.812 . . . . 38.94 103.407 177.2 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 12.3 t60 -117.29 130.09 56.32 Favored 'General case' 0 CA--C 1.509 -0.628 0 N-CA-C 115.218 1.562 . . . . 69.7 115.218 -177.298 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 49' ' ' GLY . . . . . . . . . . . . . . . 102.42 152.1 24.1 Favored Glycine 0 C--N 1.327 0.042 0 N-CA-C 117.125 1.61 . . . . 26.57 117.125 177.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 50' ' ' ARG . . . . . . . . . . . . . 6.3 mtt180 -62.54 -39.19 92.82 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 119.545 -0.862 . . . . 24.95 110.1 178.826 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -53.21 -59.25 4.8 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 117.569 -1.652 . . . . 33.27 110.672 179.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -60.48 -40.56 91.72 Favored 'General case' 0 C--O 1.241 0.624 0 N-CA-C 114.988 1.477 . . . . 42.27 114.988 -179.075 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 7.8 mt -67.51 -36.52 76.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 C-N-CA 119.996 -0.682 . . . . 19.57 110.849 179.125 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.77 -43.81 98.12 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 106.189 -1.782 . . . . 17.05 106.189 179.275 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.74 -52.52 65.36 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 108.559 -0.904 . . . . 18.75 108.559 -179.95 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -51.19 -40.32 58.42 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 114.926 -1.034 . . . . 25.98 112.349 179.13 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 57' ' ' TYR . . . . . 0.612 ' O ' ' CD1' ' A' ' 61' ' ' LEU . 32.8 m-85 -81.44 -27.62 34.58 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 114.529 1.307 . . . . 34.73 114.529 -179.186 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 58' ' ' ARG . . . . . 0.448 ' NH1' ' CG ' ' A' ' 58' ' ' ARG . 0.0 OUTLIER -66.67 -42.7 86.17 Favored 'General case' 0 CA--C 1.508 -0.672 0 N-CA-C 107.06 -1.459 . . . . 50.34 107.06 179.724 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -56.79 -38.58 72.72 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 115.081 1.511 . . . . 66.96 115.081 179.661 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -84.34 -23.36 51.53 Favored Glycine 0 CA--C 1.53 0.969 0 N-CA-C 121.201 3.24 . . . . 50.2 121.201 -178.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 61' ' ' LEU . . . . . 0.612 ' CD1' ' O ' ' A' ' 57' ' ' TYR . 0.4 OUTLIER . . . . . 0 C--O 1.251 1.134 0 CA-C-O 113.89 -2.957 . . . . 66.28 114.379 -178.379 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.513 2.706 0 N-CA-C 105.714 -1.958 . . . . 87.12 105.714 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 66' ' ' VAL . . . . . 0.44 ' CG1' ' N ' ' A' ' 67' ' ' ARG . 50.3 t -119.51 157.75 21.42 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 CA-C-N 113.422 -1.717 . . . . 57.45 114.529 -174.894 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 67' ' ' ARG . . . . . 0.44 ' N ' ' CG1' ' A' ' 66' ' ' VAL . 3.6 ptt85 -135.17 140.8 45.65 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 104.138 -2.541 . . . . 62.54 104.138 175.141 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -129.02 141.44 51.24 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 107.778 -1.194 . . . . 32.35 107.778 -178.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 69' ' ' CYS . . . . . 0.913 ' SG ' ' O ' ' A' ' 523' ' ' HOH . 0.1 OUTLIER -136.86 156.86 47.93 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 107.891 -1.152 . . . . 30.49 107.891 176.633 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 11.1 mt -83.52 135.71 34.54 Favored 'General case' 0 C--O 1.219 -0.521 0 N-CA-C 102.89 -3.004 . . . . 24.25 102.89 177.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 76.1 p -113.75 18.29 17.53 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 118.281 -1.368 . . . . 21.51 109.071 -179.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 178.44 163.78 30.38 Favored Glycine 0 N--CA 1.445 -0.73 0 N-CA-C 108.185 -1.966 . . . . 20.03 108.185 -179.086 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -62.61 159.49 36.54 Favored 'Trans proline' 0 CA--C 1.498 -1.294 0 N-CA-C 115.667 1.372 . . . . 22.49 115.667 -179.627 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 93.8 t -85.78 122.09 38.06 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.785 0 N-CA-C 105.425 -2.065 . . . . 20.08 105.425 178.049 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -87.34 120.92 29.12 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 106.323 -1.732 . . . . 20.06 106.323 179.146 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -125.33 152.38 44.79 Favored 'General case' 0 CA--C 1.502 -0.893 0 C-N-CA 117.478 -1.689 . . . . 23.56 113.139 -178.105 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 77' ' ' SER . . . . . 0.58 ' OG ' ' ND2' ' A' ' 79' ' ' ASN . 75.1 p -113.96 -173.4 2.27 Favored 'General case' 0 CA--C 1.502 -0.889 0 N-CA-C 107.479 -1.304 . . . . 24.8 107.479 178.848 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -100.76 -0.71 36.65 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.261 -0.427 . . . . 37.27 111.694 -177.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 79' ' ' ASN . . . . . 0.58 ' ND2' ' OG ' ' A' ' 77' ' ' SER . 0.0 OUTLIER -104.03 28.71 6.49 Favored 'General case' 0 CA--C 1.553 1.073 0 N-CA-C 115.144 1.535 . . . . 38.36 115.144 179.118 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 76.04 28.77 59.89 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.185 -1.007 . . . . 25.45 114.255 178.204 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 23.9 m -124.48 154.05 41.1 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 114.849 -0.676 . . . . 28.05 110.779 -178.937 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -162.4 160.21 32.44 Favored Glycine 0 C--O 1.209 -1.419 0 N-CA-C 110.186 -1.165 . . . . 14.11 110.186 179.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -142.71 157.28 44.82 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 104.725 -2.324 . . . . 8.9 104.725 178.309 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 2.6 ptt? -161.3 145.68 10.14 Favored Pre-proline 0 C--N 1.318 -0.786 0 N-CA-C 114.484 1.29 . . . . 18.38 114.484 -177.836 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -97.85 141.09 0.53 Allowed 'Trans proline' 0 CA--C 1.496 -1.385 0 C-N-CA 120.47 0.78 . . . . 16.17 110.585 179.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 86' ' ' PHE . . . . . . . . . . . . . 33.6 p90 -160.26 158.4 29.82 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 113.27 0.841 . . . . 10.91 113.27 177.032 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 5.1 ttm180 -113.05 138.97 49.1 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 122.301 1.048 . . . . 59.81 113.598 179.893 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 77.3 t -113.25 116.18 51.89 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.912 0 N-CA-C 106.222 -1.77 . . . . 31.68 106.222 179.48 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -101.16 106.72 17.99 Favored 'General case' 0 C--N 1.316 -0.867 0 C-N-CA 119.738 -0.785 . . . . 54.49 110.545 178.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -106.12 -155.78 0.56 Allowed 'General case' 0 C--O 1.237 0.418 0 C-N-CA 119.834 -0.746 . . . . 55.31 110.106 179.292 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 91' ' ' VAL . . . . . . . . . . . . . 46.4 t -157.96 90.49 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.511 -0.523 0 N-CA-C 104.622 -2.362 . . . . 68.95 104.622 178.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 92' ' ' TRP . . . . . 0.715 ' N ' ' O ' ' A' ' 95' ' ' GLN . 6.9 t90 -81.52 117.91 22.31 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 117.508 2.41 . . . . 97.43 117.508 -178.083 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.2 m120 40.48 56.46 2.71 Favored 'General case' 0 C--O 1.238 0.471 0 O-C-N 124.413 1.07 . . . . 100.0 111.403 -179.841 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 87.5 -34.63 3.62 Favored Glycine 0 C--N 1.334 0.449 0 CA-C-N 114.857 -1.065 . . . . 89.53 110.994 -179.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 95' ' ' GLN . . . . . 0.715 ' O ' ' N ' ' A' ' 92' ' ' TRP . 1.6 tt0 -91.47 123.91 62.51 Favored Pre-proline 0 CA--C 1.508 -0.642 0 CA-C-O 121.658 0.742 . . . . 83.89 111.207 179.866 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 85.6 Cg_endo -76.73 131.73 12.59 Favored 'Trans proline' 0 N--CA 1.46 -0.447 1 C-N-CA 125.322 4.015 . . . . 68.8 109.448 179.651 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 97' ' ' CYS . . . . . 0.63 ' CB ' ' CG2' ' A' ' 127' ' ' VAL . 4.2 p -136.48 170.33 16.22 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 108.511 -0.922 . . . . 54.98 108.511 178.916 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -132.48 146.22 51.76 Favored 'General case' 0 C--O 1.216 -0.696 0 N-CA-C 108.289 -1.004 . . . . 36.37 108.289 -179.115 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 57.7 tp -129.89 131.53 46.09 Favored 'General case' 0 N--CA 1.432 -1.344 0 N-CA-C 107.778 -1.193 . . . . 21.33 107.778 -179.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -104.19 117.37 34.09 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 106.695 -1.595 . . . . 21.49 106.695 179.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 101' ' ' VAL . . . . . 0.533 ' CG1' ' N ' ' A' ' 102' ' ' ILE . 98.1 t -118.43 167.08 12.14 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.233 0 C-N-CA 119.553 -0.859 . . . . 17.14 110.273 -178.671 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 102' ' ' ILE . . . . . 0.533 ' N ' ' CG1' ' A' ' 101' ' ' VAL . 0.6 OUTLIER -134.28 120.11 32.89 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 105.436 -2.061 . . . . 13.04 105.436 172.244 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -103.1 143.0 33.17 Favored 'General case' 0 CA--C 1.507 -0.676 0 C-N-CA 120.868 -0.333 . . . . 20.65 110.775 179.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 25.1 t -125.55 120.24 57.18 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 N-CA-C 103.601 -2.741 . . . . 13.25 103.601 175.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 105' ' ' MET . . . . . . . . . . . . . 13.5 mtt -121.41 152.55 38.93 Favored 'General case' 0 CA--C 1.472 -2.043 0 N-CA-C 113.258 0.836 . . . . 21.62 113.258 -178.303 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 106' ' ' ARG . . . . . . . . . . . . . 1.6 ttm180 -129.21 123.79 32.91 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 106.941 -1.503 . . . . 72.37 106.941 178.44 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -95.15 160.07 14.72 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.815 -0.63 . . . . 23.84 112.041 178.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 49.6 p30 -104.67 -176.54 3.11 Favored 'General case' 0 C--O 1.24 0.559 0 CA-C-O 121.323 0.583 . . . . 29.28 110.075 178.629 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 109' ' ' GLU . . . . . . . . . . . . . 2.1 pm0 -64.5 2.77 0.58 Allowed 'General case' 0 C--O 1.209 -1.043 0 N-CA-C 114.061 1.134 . . . . 65.64 114.061 -178.987 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 40.9 m80 -115.97 -3.93 12.09 Favored 'General case' 0 CA--C 1.491 -1.317 0 C-N-CA 119.98 -0.688 . . . . 51.75 109.6 178.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 87.1 16.83 60.27 Favored Glycine 0 C--O 1.229 -0.201 0 C-N-CA 119.831 -1.176 . . . . 25.34 111.933 -179.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 23.4 mtm-85 -102.92 157.38 17.01 Favored 'General case' 0 N--CA 1.44 -0.946 0 N-CA-C 106.73 -1.582 . . . . 59.64 106.73 179.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 113' ' ' ILE . . . . . . . . . . . . . 44.6 mt -78.96 105.97 9.13 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.121 0 N-CA-C 112.862 0.69 . . . . 14.35 112.862 -179.098 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -71.29 -44.51 65.05 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 122.598 1.189 . . . . 53.65 110.415 179.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 115' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -147.64 140.18 24.62 Favored 'General case' 0 N--CA 1.437 -1.1 0 C-N-CA 118.933 -1.107 . . . . 28.72 111.829 -178.611 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 2.9 tmm? -126.6 144.47 50.89 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 107.318 -1.364 . . . . 27.21 107.318 179.854 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -141.71 127.87 19.7 Favored 'General case' 0 CA--C 1.505 -0.763 0 N-CA-C 108.101 -1.074 . . . . 33.11 108.101 178.779 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -109.19 135.72 49.84 Favored 'General case' 0 CA--C 1.499 -1.003 0 C-N-CA 119.347 -0.941 . . . . 18.12 109.424 -178.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -110.18 115.37 29.6 Favored 'General case' 0 CA--C 1.504 -0.796 0 N-CA-C 107.987 -1.116 . . . . 26.05 107.987 178.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 120' ' ' TRP . . . . . . . . . . . . . 55.3 p-90 -171.86 164.68 6.44 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 108.002 -1.11 . . . . 23.65 108.002 177.989 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 121' ' ' SER . . . . . . . . . . . . . 27.0 p -163.75 -172.78 2.99 Favored 'General case' 0 C--O 1.216 -0.671 0 N-CA-C 105.207 -2.145 . . . . 26.01 105.207 178.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 122' ' ' GLU . . . . . . . . . . . . . 2.1 mp0 -68.56 -1.42 6.68 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 118.19 -1.404 . . . . 43.09 114.656 -177.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 123' ' ' VAL . . . . . . . . . . . . . 29.4 m -84.03 -12.7 11.74 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.516 0 O-C-N 124.226 0.954 . . . . 26.97 109.218 -178.778 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 124' ' ' ASN . . . . . . . . . . . . . 35.5 m120 -106.39 -2.71 21.86 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.226 -0.897 . . . . 20.62 112.207 -177.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.05 141.17 29.64 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.249 -0.887 . . . . 36.49 109.605 178.982 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 18.7 m -130.1 98.4 4.74 Favored 'General case' 0 CA--C 1.5 -0.971 0 N-CA-C 101.44 -3.541 . . . . 48.31 101.44 177.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 127' ' ' VAL . . . . . 0.63 ' CG2' ' CB ' ' A' ' 97' ' ' CYS . 0.3 OUTLIER . . . . . 0 C--O 1.264 1.854 0 CA-C-O 116.41 -1.757 . . . . 55.08 110.832 -178.964 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 511' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 520' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 523' ' ' HOH . . . . . 0.913 ' O ' ' SG ' ' A' ' 69' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.031 0 N-CA-C 108.261 -1.015 . . . . 54.97 108.261 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 14.2 tp -66.79 120.2 69.5 Favored Pre-proline 0 C--O 1.24 0.575 0 N-CA-C 102.554 -3.128 . . . . 51.94 102.554 177.16 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 4' ' ' PRO . . . . . 0.697 ' HB2' HG23 ' A' ' 9' ' ' VAL . 32.9 Cg_exo -52.4 147.3 29.59 Favored 'Trans proline' 0 N--CA 1.46 -0.484 0 N-CA-C 117.684 2.148 . . . . 38.23 117.684 -178.717 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 5' ' ' THR . . . . . 0.734 ' H ' ' HG3' ' A' ' 8' ' ' GLU . 26.8 p -84.25 162.77 20.03 Favored 'General case' 0 C--O 1.246 0.899 0 N-CA-C 102.566 -3.124 . . . . 28.5 102.566 177.684 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -48.29 -42.56 31.16 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 109.215 -0.661 . . . . 20.85 109.215 179.334 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.26 -33.55 76.26 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 115.115 1.524 . . . . 63.84 115.115 -179.824 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 8' ' ' GLU . . . . . 0.734 ' HG3' ' H ' ' A' ' 5' ' ' THR . 1.0 OUTLIER -78.23 -35.59 48.14 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 109.325 -0.62 . . . . 50.47 109.325 -178.242 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 9' ' ' VAL . . . . . 0.697 HG23 ' HB2' ' A' ' 4' ' ' PRO . 42.2 t -60.8 -41.41 88.46 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.848 0 N-CA-C 108.303 -0.999 . . . . 22.66 108.303 179.156 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 10' ' ' GLN . . . . . 0.562 ' HG2' ' HB ' ' A' ' 74' ' ' VAL . 29.6 mt-30 -62.16 -41.81 98.67 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 119.057 -1.057 . . . . 27.77 110.966 179.593 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -67.05 -39.47 92.99 Favored Glycine 0 N--CA 1.447 -0.602 0 CA-C-O 118.899 -0.945 . . . . 14.69 112.709 -179.64 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 13.0 mt -66.32 -40.77 90.16 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-N 117.848 0.824 . . . . 19.44 112.358 -179.537 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 80.8 mtp -70.63 -36.26 73.36 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-N 115.494 -0.775 . . . . 22.66 110.752 -179.439 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.66 -37.33 82.24 Favored 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 106.674 -1.602 . . . . 18.44 106.674 179.109 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.0 ttt180 -61.17 -43.14 99.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.301 -0.863 . . . . 36.08 110.264 178.816 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -58.24 -38.19 76.39 Favored 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 113.189 0.811 . . . . 26.4 113.189 -179.594 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 7.4 mm -71.07 -25.57 25.89 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.736 0 O-C-N 121.535 -0.728 . . . . 18.7 109.342 177.577 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.04 -53.8 27.74 Favored 'General case' 0 C--O 1.21 -0.987 0 N-CA-C 107.766 -1.198 . . . . 64.3 107.766 178.338 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 14.8 mt -54.74 -47.73 73.47 Favored 'General case' 0 N--CA 1.429 -1.476 0 CA-C-N 116.282 -0.417 . . . . 25.85 110.747 178.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 59.0 t -62.7 -32.07 54.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 O-C-N 121.227 -0.921 . . . . 21.15 113.202 -179.099 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 21' ' ' ASP . . . . . 0.419 ' OD1' ' HB2' ' A' ' 67' ' ' ARG . 22.2 t0 -67.11 -42.13 85.07 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.991 -0.55 . . . . 28.64 111.063 179.491 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 17.7 m -83.75 -18.08 10.24 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.747 0 N-CA-C 109.645 -0.502 . . . . 33.33 109.645 179.081 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 76.43 26.91 62.44 Favored Glycine 0 N--CA 1.441 -1.014 0 C-N-CA 118.665 -1.731 . . . . 24.7 113.481 179.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 38.4 t0 -82.98 84.9 7.28 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 106.622 -1.621 . . . . 27.13 106.622 177.447 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 25' ' ' ILE . . . . . 0.53 ' O ' HG23 ' A' ' 29' ' ' VAL . 25.3 mt -57.01 -35.94 49.18 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 N-CA-C 116.416 2.006 . . . . 20.01 116.416 -177.867 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -68.32 -43.25 77.99 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.709 -0.678 . . . . 59.63 111.261 -178.532 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -66.13 -31.34 72.13 Favored 'General case' 0 C--O 1.241 0.639 0 O-C-N 123.482 0.489 . . . . 20.75 112.116 179.997 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 62.3 mt -69.57 -53.75 23.08 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 N-CA-C 108.33 -0.989 . . . . 19.06 108.33 179.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 29' ' ' VAL . . . . . 0.596 HG12 ' HD3' ' A' ' 50' ' ' ARG . 97.6 t -55.9 -32.81 33.59 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.039 0 CA-C-N 115.42 -0.809 . . . . 17.53 109.918 -178.662 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 25.1 tp60 -76.56 -11.61 59.89 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 119.283 -0.967 . . . . 58.06 113.186 -178.333 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 27.1 mtp -79.32 -17.98 53.48 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 108.087 -1.079 . . . . 24.71 108.087 178.403 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 46.2 m-85 -87.31 164.56 16.21 Favored 'General case' 0 CA--C 1.505 -0.781 0 N-CA-C 114.12 1.156 . . . . 22.77 114.12 -179.12 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -82.27 155.31 24.91 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 102.829 -3.026 . . . . 15.88 102.829 177.101 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 34' ' ' ASP . . . . . 0.613 ' HA ' ' HG3' ' A' ' 50' ' ' ARG . 1.0 OUTLIER -54.1 -32.14 54.04 Favored 'General case' 0 CA--C 1.51 -0.581 0 O-C-N 123.781 0.676 . . . . 24.36 110.584 -179.184 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 35' ' ' ASP . . . . . 0.515 ' HB2' ' NE2' ' A' ' 48' ' ' HIS . 28.3 p-10 -121.09 30.39 6.87 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 115.496 1.665 . . . . 31.56 115.496 -179.68 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.15 175.79 0.38 Allowed 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 109.27 -0.641 . . . . 19.54 109.27 179.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 37' ' ' THR . . . . . 0.467 ' HA ' ' O ' ' A' ' 47' ' ' ILE . 73.2 p -135.93 149.3 48.89 Favored 'General case' 0 C--O 1.219 -0.547 0 N-CA-C 105.884 -1.895 . . . . 21.43 105.884 175.059 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 38' ' ' VAL . . . . . 0.471 ' HB ' HG12 ' A' ' 47' ' ' ILE . 4.2 t -124.48 143.29 38.42 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.5 0 N-CA-C 105.843 -1.91 . . . . 18.26 105.843 -179.858 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 39' ' ' GLU . . . . . 0.663 ' HG2' ' O ' ' A' ' 520' ' ' HOH . 2.0 mt-10 -130.26 96.13 4.08 Favored 'General case' 0 CA--C 1.498 -1.041 0 N-CA-C 103.734 -2.691 . . . . 42.2 103.734 178.546 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 52.0 t0 -145.75 113.51 4.64 Favored Pre-proline 0 CA--C 1.515 -0.401 0 O-C-N 124.217 0.948 . . . . 30.15 108.499 -177.684 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 41' ' ' PRO . . . . . 0.547 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 53.8 Cg_endo -79.77 158.22 88.67 Favored 'Cis proline' 0 N--CA 1.456 -0.726 0 C-N-CA 123.006 -1.664 . . . . 28.76 109.024 -0.268 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -57.88 131.77 51.38 Favored 'General case' 0 N--CA 1.441 -0.922 0 N-CA-C 106.6 -1.63 . . . . 36.2 106.6 179.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 116.64 -10.89 16.12 Favored Glycine 0 C--O 1.227 -0.34 0 N-CA-C 111.054 -0.818 . . . . 44.41 111.054 -179.406 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 44' ' ' GLN . . . . . 0.701 ' HG3' ' HD2' ' A' ' 45' ' ' PRO . 0.6 OUTLIER -105.21 160.26 26.61 Favored Pre-proline 0 N--CA 1.446 -0.667 0 N-CA-C 106.65 -1.611 . . . . 70.72 106.65 178.379 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 45' ' ' PRO . . . . . 0.701 ' HD2' ' HG3' ' A' ' 44' ' ' GLN . 9.9 Cg_endo -59.26 146.43 94.67 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 117.541 -1.173 . . . . 42.56 109.795 178.957 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -76.21 152.97 35.82 Favored 'Trans proline' 0 CA--C 1.506 -0.904 0 C-N-CA 123.998 3.132 . . . . 38.69 114.809 -179.424 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 47' ' ' ILE . . . . . 0.471 HG12 ' HB ' ' A' ' 38' ' ' VAL . 0.7 OUTLIER -106.86 134.66 47.86 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.738 0 N-CA-C 103.407 -2.812 . . . . 38.94 103.407 177.2 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 48' ' ' HIS . . . . . 0.515 ' NE2' ' HB2' ' A' ' 35' ' ' ASP . 12.3 t60 -117.29 130.09 56.32 Favored 'General case' 0 CA--C 1.509 -0.628 0 N-CA-C 115.218 1.562 . . . . 69.7 115.218 -177.298 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 49' ' ' GLY . . . . . 0.644 ' O ' HD12 ' A' ' 53' ' ' ILE . . . 102.42 152.1 24.1 Favored Glycine 0 C--N 1.327 0.042 0 N-CA-C 117.125 1.61 . . . . 26.57 117.125 177.343 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 50' ' ' ARG . . . . . 0.613 ' HG3' ' HA ' ' A' ' 34' ' ' ASP . 6.3 mtt180 -62.54 -39.19 92.82 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 119.545 -0.862 . . . . 24.95 110.1 178.826 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -53.21 -59.25 4.8 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 117.569 -1.652 . . . . 33.27 110.672 179.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -60.48 -40.56 91.72 Favored 'General case' 0 C--O 1.241 0.624 0 N-CA-C 114.988 1.477 . . . . 42.27 114.988 -179.075 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 53' ' ' ILE . . . . . 0.644 HD12 ' O ' ' A' ' 49' ' ' GLY . 7.8 mt -67.51 -36.52 76.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 C-N-CA 119.996 -0.682 . . . . 19.57 110.849 179.125 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.77 -43.81 98.12 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 106.189 -1.782 . . . . 17.05 106.189 179.275 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.74 -52.52 65.36 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 108.559 -0.904 . . . . 18.75 108.559 -179.95 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -51.19 -40.32 58.42 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 114.926 -1.034 . . . . 25.98 112.349 179.13 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 57' ' ' TYR . . . . . 0.612 ' O ' ' CD1' ' A' ' 61' ' ' LEU . 32.8 m-85 -81.44 -27.62 34.58 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 114.529 1.307 . . . . 34.73 114.529 -179.186 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 58' ' ' ARG . . . . . 0.541 ' CG ' HH11 ' A' ' 58' ' ' ARG . 0.0 OUTLIER -66.67 -42.7 86.17 Favored 'General case' 0 CA--C 1.508 -0.672 0 N-CA-C 107.06 -1.459 . . . . 50.34 107.06 179.724 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -56.79 -38.58 72.72 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 115.081 1.511 . . . . 66.96 115.081 179.661 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -84.34 -23.36 51.53 Favored Glycine 0 CA--C 1.53 0.969 0 N-CA-C 121.201 3.24 . . . . 50.2 121.201 -178.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 61' ' ' LEU . . . . . 0.625 ' N ' HD12 ' A' ' 61' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--O 1.251 1.134 0 CA-C-O 113.89 -2.957 . . . . 66.28 114.379 -178.379 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.513 2.706 0 N-CA-C 105.714 -1.958 . . . . 87.12 105.714 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 66' ' ' VAL . . . . . 0.44 ' CG1' ' N ' ' A' ' 67' ' ' ARG . 50.3 t -119.51 157.75 21.42 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 CA-C-N 113.422 -1.717 . . . . 57.45 114.529 -174.894 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 67' ' ' ARG . . . . . 0.44 ' N ' ' CG1' ' A' ' 66' ' ' VAL . 3.6 ptt85 -135.17 140.8 45.65 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 104.138 -2.541 . . . . 62.54 104.138 175.141 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -129.02 141.44 51.24 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 107.778 -1.194 . . . . 32.35 107.778 -178.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 69' ' ' CYS . . . . . 0.913 ' SG ' ' O ' ' A' ' 523' ' ' HOH . 0.1 OUTLIER -136.86 156.86 47.93 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 107.891 -1.152 . . . . 30.49 107.891 176.633 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 11.1 mt -83.52 135.71 34.54 Favored 'General case' 0 C--O 1.219 -0.521 0 N-CA-C 102.89 -3.004 . . . . 24.25 102.89 177.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 76.1 p -113.75 18.29 17.53 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 118.281 -1.368 . . . . 21.51 109.071 -179.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 178.44 163.78 30.38 Favored Glycine 0 N--CA 1.445 -0.73 0 N-CA-C 108.185 -1.966 . . . . 20.03 108.185 -179.086 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -62.61 159.49 36.54 Favored 'Trans proline' 0 CA--C 1.498 -1.294 0 N-CA-C 115.667 1.372 . . . . 22.49 115.667 -179.627 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 74' ' ' VAL . . . . . 0.562 ' HB ' ' HG2' ' A' ' 10' ' ' GLN . 93.8 t -85.78 122.09 38.06 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.785 0 N-CA-C 105.425 -2.065 . . . . 20.08 105.425 178.049 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -87.34 120.92 29.12 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 106.323 -1.732 . . . . 20.06 106.323 179.146 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -125.33 152.38 44.79 Favored 'General case' 0 CA--C 1.502 -0.893 0 C-N-CA 117.478 -1.689 . . . . 23.56 113.139 -178.105 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 77' ' ' SER . . . . . . . . . . . . . 75.1 p -113.96 -173.4 2.27 Favored 'General case' 0 CA--C 1.502 -0.889 0 N-CA-C 107.479 -1.304 . . . . 24.8 107.479 178.848 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -100.76 -0.71 36.65 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.261 -0.427 . . . . 37.27 111.694 -177.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 79' ' ' ASN . . . . . . . . . . . . . 48.6 p-10 -104.03 28.71 6.49 Favored 'General case' 0 CA--C 1.553 1.073 0 N-CA-C 115.144 1.535 . . . . 38.36 115.144 179.118 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 76.04 28.77 59.89 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.185 -1.007 . . . . 25.45 114.255 178.204 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 23.9 m -124.48 154.05 41.1 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 114.849 -0.676 . . . . 28.05 110.779 -178.937 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -162.4 160.21 32.44 Favored Glycine 0 C--O 1.209 -1.419 0 N-CA-C 110.186 -1.165 . . . . 14.11 110.186 179.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -142.71 157.28 44.82 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 104.725 -2.324 . . . . 8.9 104.725 178.309 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 2.6 ptt? -161.3 145.68 10.14 Favored Pre-proline 0 C--N 1.318 -0.786 0 N-CA-C 114.484 1.29 . . . . 18.38 114.484 -177.836 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -97.85 141.09 0.53 Allowed 'Trans proline' 0 CA--C 1.496 -1.385 0 C-N-CA 120.47 0.78 . . . . 16.17 110.585 179.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 86' ' ' PHE . . . . . 0.631 ' HB2' ' O ' ' A' ' 69' ' ' CYS . 33.6 p90 -160.26 158.4 29.82 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 113.27 0.841 . . . . 10.91 113.27 177.032 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 5.1 ttm180 -113.05 138.97 49.1 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 122.301 1.048 . . . . 59.81 113.598 179.893 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 77.3 t -113.25 116.18 51.89 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.912 0 N-CA-C 106.222 -1.77 . . . . 31.68 106.222 179.48 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -101.16 106.72 17.99 Favored 'General case' 0 C--N 1.316 -0.867 0 C-N-CA 119.738 -0.785 . . . . 54.49 110.545 178.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -106.12 -155.78 0.56 Allowed 'General case' 0 C--O 1.237 0.418 0 C-N-CA 119.834 -0.746 . . . . 55.31 110.106 179.292 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 91' ' ' VAL . . . . . 1.007 ' HA ' ' HA ' ' A' ' 96' ' ' PRO . 46.4 t -157.96 90.49 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.511 -0.523 0 N-CA-C 104.622 -2.362 . . . . 68.95 104.622 178.239 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 92' ' ' TRP . . . . . 0.715 ' N ' ' O ' ' A' ' 95' ' ' GLN . 6.9 t90 -81.52 117.91 22.31 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 117.508 2.41 . . . . 97.43 117.508 -178.083 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 13.4 m-20 40.48 56.46 2.71 Favored 'General case' 0 C--O 1.238 0.471 0 O-C-N 124.413 1.07 . . . . 100.0 111.403 -179.841 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 87.5 -34.63 3.62 Favored Glycine 0 C--N 1.334 0.449 0 CA-C-N 114.857 -1.065 . . . . 89.53 110.994 -179.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 95' ' ' GLN . . . . . 0.715 ' O ' ' N ' ' A' ' 92' ' ' TRP . 1.6 tt0 -91.47 123.91 62.51 Favored Pre-proline 0 CA--C 1.508 -0.642 0 CA-C-O 121.658 0.742 . . . . 83.89 111.207 179.866 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 96' ' ' PRO . . . . . 1.007 ' HA ' ' HA ' ' A' ' 91' ' ' VAL . 85.6 Cg_endo -76.73 131.73 12.59 Favored 'Trans proline' 0 N--CA 1.46 -0.447 1 C-N-CA 125.322 4.015 . . . . 68.8 109.448 179.651 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 97' ' ' CYS . . . . . 1.082 ' CB ' HG23 ' A' ' 127' ' ' VAL . 4.2 p -136.48 170.33 16.22 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 108.511 -0.922 . . . . 54.98 108.511 178.916 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -132.48 146.22 51.76 Favored 'General case' 0 C--O 1.216 -0.696 0 N-CA-C 108.289 -1.004 . . . . 36.37 108.289 -179.115 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 57.7 tp -129.89 131.53 46.09 Favored 'General case' 0 N--CA 1.432 -1.344 0 N-CA-C 107.778 -1.193 . . . . 21.33 107.778 -179.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -104.19 117.37 34.09 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 106.695 -1.595 . . . . 21.49 106.695 179.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 101' ' ' VAL . . . . . 0.646 HG12 ' N ' ' A' ' 102' ' ' ILE . 98.1 t -118.43 167.08 12.14 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.233 0 C-N-CA 119.553 -0.859 . . . . 17.14 110.273 -178.671 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 102' ' ' ILE . . . . . 0.646 ' N ' HG12 ' A' ' 101' ' ' VAL . 0.6 OUTLIER -134.28 120.11 32.89 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 105.436 -2.061 . . . . 13.04 105.436 172.244 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -103.1 143.0 33.17 Favored 'General case' 0 CA--C 1.507 -0.676 0 C-N-CA 120.868 -0.333 . . . . 20.65 110.775 179.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 25.1 t -125.55 120.24 57.18 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 N-CA-C 103.601 -2.741 . . . . 13.25 103.601 175.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 105' ' ' MET . . . . . 0.669 ' HE2' HD13 ' A' ' 113' ' ' ILE . 13.5 mtt -121.41 152.55 38.93 Favored 'General case' 0 CA--C 1.472 -2.043 0 N-CA-C 113.258 0.836 . . . . 21.62 113.258 -178.303 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 106' ' ' ARG . . . . . 0.636 ' HB3' HG23 ' A' ' 115' ' ' THR . 1.6 ttm180 -129.21 123.79 32.91 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 106.941 -1.503 . . . . 72.37 106.941 178.44 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -95.15 160.07 14.72 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.815 -0.63 . . . . 23.84 112.041 178.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 49.6 p30 -104.67 -176.54 3.11 Favored 'General case' 0 C--O 1.24 0.559 0 CA-C-O 121.323 0.583 . . . . 29.28 110.075 178.629 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 109' ' ' GLU . . . . . 0.438 ' CD ' ' H ' ' A' ' 109' ' ' GLU . 2.1 pm0 -64.5 2.77 0.58 Allowed 'General case' 0 C--O 1.209 -1.043 0 N-CA-C 114.061 1.134 . . . . 65.64 114.061 -178.987 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 40.9 m80 -115.97 -3.93 12.09 Favored 'General case' 0 CA--C 1.491 -1.317 0 C-N-CA 119.98 -0.688 . . . . 51.75 109.6 178.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 87.1 16.83 60.27 Favored Glycine 0 C--O 1.229 -0.201 0 C-N-CA 119.831 -1.176 . . . . 25.34 111.933 -179.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 23.4 mtm-85 -102.92 157.38 17.01 Favored 'General case' 0 N--CA 1.44 -0.946 0 N-CA-C 106.73 -1.582 . . . . 59.64 106.73 179.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 113' ' ' ILE . . . . . 0.669 HD13 ' HE2' ' A' ' 105' ' ' MET . 44.6 mt -78.96 105.97 9.13 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.121 0 N-CA-C 112.862 0.69 . . . . 14.35 112.862 -179.098 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -71.29 -44.51 65.05 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 122.598 1.189 . . . . 53.65 110.415 179.418 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 115' ' ' THR . . . . . 0.636 HG23 ' HB3' ' A' ' 106' ' ' ARG . 0.5 OUTLIER -147.64 140.18 24.62 Favored 'General case' 0 N--CA 1.437 -1.1 0 C-N-CA 118.933 -1.107 . . . . 28.72 111.829 -178.611 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 2.9 tmm? -126.6 144.47 50.89 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 107.318 -1.364 . . . . 27.21 107.318 179.854 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -141.71 127.87 19.7 Favored 'General case' 0 CA--C 1.505 -0.763 0 N-CA-C 108.101 -1.074 . . . . 33.11 108.101 178.779 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -109.19 135.72 49.84 Favored 'General case' 0 CA--C 1.499 -1.003 0 C-N-CA 119.347 -0.941 . . . . 18.12 109.424 -178.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -110.18 115.37 29.6 Favored 'General case' 0 CA--C 1.504 -0.796 0 N-CA-C 107.987 -1.116 . . . . 26.05 107.987 178.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 120' ' ' TRP . . . . . 0.547 ' CE2' ' HB3' ' A' ' 41' ' ' PRO . 55.3 p-90 -171.86 164.68 6.44 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 108.002 -1.11 . . . . 23.65 108.002 177.989 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 121' ' ' SER . . . . . 0.717 ' OG ' HG22 ' A' ' 123' ' ' VAL . 27.0 p -163.75 -172.78 2.99 Favored 'General case' 0 C--O 1.216 -0.671 0 N-CA-C 105.207 -2.145 . . . . 26.01 105.207 178.199 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 122' ' ' GLU . . . . . 0.529 ' CD ' ' H ' ' A' ' 122' ' ' GLU . 2.1 mp0 -68.56 -1.42 6.68 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 118.19 -1.404 . . . . 43.09 114.656 -177.065 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 123' ' ' VAL . . . . . 0.717 HG22 ' OG ' ' A' ' 121' ' ' SER . 29.4 m -84.03 -12.7 11.74 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.516 0 O-C-N 124.226 0.954 . . . . 26.97 109.218 -178.778 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 124' ' ' ASN . . . . . 0.479 ' HA ' ' O ' ' A' ' 511' ' ' HOH . 35.5 m120 -106.39 -2.71 21.86 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.226 -0.897 . . . . 20.62 112.207 -177.969 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.05 141.17 29.64 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.249 -0.887 . . . . 36.49 109.605 178.982 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 18.7 m -130.1 98.4 4.74 Favored 'General case' 0 CA--C 1.5 -0.971 0 N-CA-C 101.44 -3.541 . . . . 48.31 101.44 177.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 127' ' ' VAL . . . . . 1.082 HG23 ' CB ' ' A' ' 97' ' ' CYS . 0.3 OUTLIER . . . . . 0 C--O 1.264 1.854 0 CA-C-O 116.41 -1.757 . . . . 55.08 110.832 -178.964 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 511' ' ' HOH . . . . . 0.479 ' O ' ' HA ' ' A' ' 124' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 520' ' ' HOH . . . . . 0.663 ' O ' ' HG2' ' A' ' 39' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 523' ' ' HOH . . . . . 0.913 ' O ' ' SG ' ' A' ' 69' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.5 2.031 0 N-CA-C 108.261 -1.015 . . . . 54.97 108.261 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 14.2 tp -66.79 120.2 69.5 Favored Pre-proline 0 C--O 1.24 0.575 0 N-CA-C 102.554 -3.128 . . . . 51.94 102.554 177.16 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.697 ' HB2' HG23 ' A' ' 9' ' ' VAL . 32.9 Cg_exo -52.4 147.3 29.59 Favored 'Trans proline' 0 N--CA 1.46 -0.484 0 N-CA-C 117.684 2.148 . . . . 38.23 117.684 -178.717 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 5' ' ' THR . . . . . 0.734 ' H ' ' HG3' ' A' ' 8' ' ' GLU . 26.8 p -84.25 162.77 20.03 Favored 'General case' 0 C--O 1.246 0.899 0 N-CA-C 102.566 -3.124 . . . . 28.5 102.566 177.684 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -48.29 -42.56 31.16 Favored 'General case' 0 N--CA 1.446 -0.664 0 N-CA-C 109.215 -0.661 . . . . 20.85 109.215 179.334 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 7' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.26 -33.55 76.26 Favored 'General case' 0 C--N 1.324 -0.531 0 N-CA-C 115.115 1.524 . . . . 63.84 115.115 -179.824 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.734 ' HG3' ' H ' ' A' ' 5' ' ' THR . 1.0 OUTLIER -78.23 -35.59 48.14 Favored 'General case' 0 CA--C 1.51 -0.588 0 N-CA-C 109.325 -0.62 . . . . 50.47 109.325 -178.242 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 9' ' ' VAL . . . . . 0.697 HG23 ' HB2' ' A' ' 4' ' ' PRO . 42.2 t -60.8 -41.41 88.46 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.848 0 N-CA-C 108.303 -0.999 . . . . 22.66 108.303 179.156 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 10' ' ' GLN . . . . . 0.562 ' HG2' ' HB ' ' A' ' 74' ' ' VAL . 7.8 mt-30 -62.16 -41.81 98.67 Favored 'General case' 0 C--N 1.323 -0.558 0 C-N-CA 119.057 -1.057 . . . . 27.77 110.966 179.593 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 11' ' ' GLY . . . . . . . . . . . . . . . -67.05 -39.47 92.99 Favored Glycine 0 N--CA 1.447 -0.602 0 CA-C-O 118.899 -0.945 . . . . 14.69 112.709 -179.64 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 12' ' ' LEU . . . . . . . . . . . . . 13.0 mt -66.32 -40.77 90.16 Favored 'General case' 0 CA--C 1.509 -0.626 0 CA-C-N 117.848 0.824 . . . . 19.44 112.358 -179.537 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 80.8 mtp -70.63 -36.26 73.36 Favored 'General case' 0 N--CA 1.43 -1.456 0 CA-C-N 115.494 -0.775 . . . . 22.66 110.752 -179.439 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.66 -37.33 82.24 Favored 'General case' 0 CA--C 1.509 -0.601 0 N-CA-C 106.674 -1.602 . . . . 18.44 106.674 179.109 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 16.0 ttt180 -61.17 -43.14 99.35 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 115.301 -0.863 . . . . 36.08 110.264 178.816 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 16' ' ' TYR . . . . . . . . . . . . . 45.3 t80 -58.24 -38.19 76.39 Favored 'General case' 0 CA--C 1.547 0.853 0 N-CA-C 113.189 0.811 . . . . 26.4 113.189 -179.594 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 17' ' ' ILE . . . . . . . . . . . . . 7.4 mm -71.07 -25.57 25.89 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.736 0 O-C-N 121.535 -0.728 . . . . 18.7 109.342 177.577 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -67.04 -53.8 27.74 Favored 'General case' 0 C--O 1.21 -0.987 0 N-CA-C 107.766 -1.198 . . . . 64.3 107.766 178.338 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 14.8 mt -54.74 -47.73 73.47 Favored 'General case' 0 N--CA 1.429 -1.476 0 CA-C-N 116.282 -0.417 . . . . 25.85 110.747 178.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 59.0 t -62.7 -32.07 54.33 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 O-C-N 121.227 -0.921 . . . . 21.15 113.202 -179.099 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 21' ' ' ASP . . . . . 0.419 ' OD1' ' HB2' ' A' ' 67' ' ' ARG . 22.2 t0 -67.11 -42.13 85.07 Favored 'General case' 0 C--N 1.324 -0.512 0 CA-C-N 115.991 -0.55 . . . . 28.64 111.063 179.491 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 17.7 m -83.75 -18.08 10.24 Favored 'Isoleucine or valine' 0 C--O 1.215 -0.747 0 N-CA-C 109.645 -0.502 . . . . 33.33 109.645 179.081 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 76.43 26.91 62.44 Favored Glycine 0 N--CA 1.441 -1.014 0 C-N-CA 118.665 -1.731 . . . . 24.7 113.481 179.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 24' ' ' ASP . . . . . . . . . . . . . 38.4 t0 -82.98 84.9 7.28 Favored 'General case' 0 N--CA 1.464 0.227 0 N-CA-C 106.622 -1.621 . . . . 27.13 106.622 177.447 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 25' ' ' ILE . . . . . 0.53 ' O ' HG23 ' A' ' 29' ' ' VAL . 25.3 mt -57.01 -35.94 49.18 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.443 0 N-CA-C 116.416 2.006 . . . . 20.01 116.416 -177.867 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -68.32 -43.25 77.99 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.709 -0.678 . . . . 59.63 111.261 -178.532 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 27' ' ' ALA . . . . . . . . . . . . . . . -66.13 -31.34 72.13 Favored 'General case' 0 C--O 1.241 0.639 0 O-C-N 123.482 0.489 . . . . 20.75 112.116 179.997 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 62.3 mt -69.57 -53.75 23.08 Favored 'Isoleucine or valine' 0 C--O 1.236 0.38 0 N-CA-C 108.33 -0.989 . . . . 19.06 108.33 179.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 29' ' ' VAL . . . . . 0.596 HG12 ' HD3' ' A' ' 50' ' ' ARG . 97.6 t -55.9 -32.81 33.59 Favored 'Isoleucine or valine' 0 CA--C 1.498 -1.039 0 CA-C-N 115.42 -0.809 . . . . 17.53 109.918 -178.662 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 30' ' ' GLN . . . . . . . . . . . . . 25.1 tp60 -76.56 -11.61 59.89 Favored 'General case' 0 C--N 1.319 -0.727 0 C-N-CA 119.283 -0.967 . . . . 58.06 113.186 -178.333 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 31' ' ' MET . . . . . . . . . . . . . 27.1 mtp -79.32 -17.98 53.48 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 108.087 -1.079 . . . . 24.71 108.087 178.403 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 46.2 m-85 -87.31 164.56 16.21 Favored 'General case' 0 CA--C 1.505 -0.781 0 N-CA-C 114.12 1.156 . . . . 22.77 114.12 -179.12 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 33' ' ' ALA . . . . . . . . . . . . . . . -82.27 155.31 24.91 Favored 'General case' 0 C--N 1.326 -0.432 0 N-CA-C 102.829 -3.026 . . . . 15.88 102.829 177.101 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 34' ' ' ASP . . . . . 0.613 ' HA ' ' HG3' ' A' ' 50' ' ' ARG . 1.0 OUTLIER -54.1 -32.14 54.04 Favored 'General case' 0 CA--C 1.51 -0.581 0 O-C-N 123.781 0.676 . . . . 24.36 110.584 -179.184 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 35' ' ' ASP . . . . . 0.515 ' HB2' ' NE2' ' A' ' 48' ' ' HIS . 28.3 p-10 -121.09 30.39 6.87 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 115.496 1.665 . . . . 31.56 115.496 -179.68 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 36' ' ' ALA . . . . . . . . . . . . . . . -60.15 175.79 0.38 Allowed 'General case' 0 CA--C 1.515 -0.383 0 N-CA-C 109.27 -0.641 . . . . 19.54 109.27 179.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 37' ' ' THR . . . . . 0.467 ' HA ' ' O ' ' A' ' 47' ' ' ILE . 73.2 p -135.93 149.3 48.89 Favored 'General case' 0 C--O 1.219 -0.547 0 N-CA-C 105.884 -1.895 . . . . 21.43 105.884 175.059 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 38' ' ' VAL . . . . . 0.471 ' HB ' HG12 ' A' ' 47' ' ' ILE . 4.2 t -124.48 143.29 38.42 Favored 'Isoleucine or valine' 0 N--CA 1.429 -1.5 0 N-CA-C 105.843 -1.91 . . . . 18.26 105.843 -179.858 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.663 ' HG2' ' O ' ' A' ' 520' ' ' HOH . 2.0 mt-10 -130.26 96.13 4.08 Favored 'General case' 0 CA--C 1.498 -1.041 0 N-CA-C 103.734 -2.691 . . . . 42.2 103.734 178.546 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 40' ' ' ASP . . . . . . . . . . . . . 52.0 t0 -145.75 113.51 4.64 Favored Pre-proline 0 CA--C 1.515 -0.401 0 O-C-N 124.217 0.948 . . . . 30.15 108.499 -177.684 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.547 ' HB3' ' CE2' ' A' ' 120' ' ' TRP . 53.8 Cg_endo -79.77 158.22 88.67 Favored 'Cis proline' 0 N--CA 1.456 -0.726 0 C-N-CA 123.006 -1.664 . . . . 28.76 109.024 -0.268 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 86.4 t80 -57.88 131.77 51.38 Favored 'General case' 0 N--CA 1.441 -0.922 0 N-CA-C 106.6 -1.63 . . . . 36.2 106.6 179.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 43' ' ' GLY . . . . . . . . . . . . . . . 116.64 -10.89 16.12 Favored Glycine 0 C--O 1.227 -0.34 0 N-CA-C 111.054 -0.818 . . . . 44.41 111.054 -179.406 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 44' ' ' GLN . . . . . 0.701 ' HG3' ' HD2' ' A' ' 45' ' ' PRO . 0.6 OUTLIER -105.21 160.26 26.61 Favored Pre-proline 0 N--CA 1.446 -0.667 0 N-CA-C 106.65 -1.611 . . . . 70.72 106.65 178.379 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.701 ' HD2' ' HG3' ' A' ' 44' ' ' GLN . 9.9 Cg_endo -59.26 146.43 94.67 Favored 'Trans proline' 0 CA--C 1.541 0.839 0 C-N-CA 117.541 -1.173 . . . . 42.56 109.795 178.957 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 46' ' ' PRO . . . . . . . . . . . . . 56.0 Cg_endo -76.21 152.97 35.82 Favored 'Trans proline' 0 CA--C 1.506 -0.904 0 C-N-CA 123.998 3.132 . . . . 38.69 114.809 -179.424 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 47' ' ' ILE . . . . . 0.471 HG12 ' HB ' ' A' ' 38' ' ' VAL . 0.7 OUTLIER -106.86 134.66 47.86 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.738 0 N-CA-C 103.407 -2.812 . . . . 38.94 103.407 177.2 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 48' ' ' HIS . . . . . 0.515 ' NE2' ' HB2' ' A' ' 35' ' ' ASP . 12.3 t60 -117.29 130.09 56.32 Favored 'General case' 0 CA--C 1.509 -0.628 0 N-CA-C 115.218 1.562 . . . . 69.7 115.218 -177.298 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.644 ' O ' HD12 ' A' ' 53' ' ' ILE . . . 102.42 152.1 24.1 Favored Glycine 0 C--N 1.327 0.042 0 N-CA-C 117.125 1.61 . . . . 26.57 117.125 177.343 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 50' ' ' ARG . . . . . 0.613 ' HG3' ' HA ' ' A' ' 34' ' ' ASP . 6.3 mtt180 -62.54 -39.19 92.82 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 119.545 -0.862 . . . . 24.95 110.1 178.826 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 7.5 tt0 -53.21 -59.25 4.8 Favored 'General case' 0 C--N 1.325 -0.481 0 C-N-CA 117.569 -1.652 . . . . 33.27 110.672 179.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -60.48 -40.56 91.72 Favored 'General case' 0 C--O 1.241 0.624 0 N-CA-C 114.988 1.477 . . . . 42.27 114.988 -179.075 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.644 HD12 ' O ' ' A' ' 49' ' ' GLY . 7.8 mt -67.51 -36.52 76.58 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.51 0 C-N-CA 119.996 -0.682 . . . . 19.57 110.849 179.125 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 54' ' ' ALA . . . . . . . . . . . . . . . -61.77 -43.81 98.12 Favored 'General case' 0 C--N 1.32 -0.683 0 N-CA-C 106.189 -1.782 . . . . 17.05 106.189 179.275 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -58.74 -52.52 65.36 Favored 'General case' 0 CA--C 1.512 -0.491 0 N-CA-C 108.559 -0.904 . . . . 18.75 108.559 -179.95 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 56' ' ' PHE . . . . . . . . . . . . . 17.0 t80 -51.19 -40.32 58.42 Favored 'General case' 0 N--CA 1.44 -0.948 0 CA-C-N 114.926 -1.034 . . . . 25.98 112.349 179.13 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 57' ' ' TYR . . . . . 0.612 ' O ' ' CD1' ' A' ' 61' ' ' LEU . 32.8 m-85 -81.44 -27.62 34.58 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 114.529 1.307 . . . . 34.73 114.529 -179.186 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 58' ' ' ARG . . . . . 0.541 ' CG ' HH11 ' A' ' 58' ' ' ARG . 0.0 OUTLIER -66.67 -42.7 86.17 Favored 'General case' 0 CA--C 1.508 -0.672 0 N-CA-C 107.06 -1.459 . . . . 50.34 107.06 179.724 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 59' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -56.79 -38.58 72.72 Favored 'General case' 0 C--N 1.326 -0.441 0 N-CA-C 115.081 1.511 . . . . 66.96 115.081 179.661 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -84.34 -23.36 51.53 Favored Glycine 0 CA--C 1.53 0.969 0 N-CA-C 121.201 3.24 . . . . 50.2 121.201 -178.509 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.625 ' N ' HD12 ' A' ' 61' ' ' LEU . 0.4 OUTLIER . . . . . 0 C--O 1.251 1.134 0 CA-C-O 113.89 -2.957 . . . . 66.28 114.379 -178.379 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.513 2.706 0 N-CA-C 105.714 -1.958 . . . . 87.12 105.714 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 66' ' ' VAL . . . . . 0.44 ' CG1' ' N ' ' A' ' 67' ' ' ARG . 50.3 t -119.51 157.75 21.42 Favored 'Isoleucine or valine' 0 N--CA 1.43 -1.431 0 CA-C-N 113.422 -1.717 . . . . 57.45 114.529 -174.894 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 67' ' ' ARG . . . . . 0.44 ' N ' ' CG1' ' A' ' 66' ' ' VAL . 3.6 ptt85 -135.17 140.8 45.65 Favored 'General case' 0 C--O 1.235 0.296 0 N-CA-C 104.138 -2.541 . . . . 62.54 104.138 175.141 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 68' ' ' ALA . . . . . . . . . . . . . . . -129.02 141.44 51.24 Favored 'General case' 0 N--CA 1.445 -0.711 0 N-CA-C 107.778 -1.194 . . . . 32.35 107.778 -178.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 69' ' ' CYS . . . . . 0.913 ' SG ' ' O ' ' A' ' 523' ' ' HOH . 0.1 OUTLIER -136.86 156.86 47.93 Favored 'General case' 0 C--N 1.32 -0.695 0 N-CA-C 107.891 -1.152 . . . . 30.49 107.891 176.633 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 70' ' ' LEU . . . . . . . . . . . . . 11.1 mt -83.52 135.71 34.54 Favored 'General case' 0 C--O 1.219 -0.521 0 N-CA-C 102.89 -3.004 . . . . 24.25 102.89 177.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 76.1 p -113.75 18.29 17.53 Favored 'General case' 0 N--CA 1.446 -0.636 0 C-N-CA 118.281 -1.368 . . . . 21.51 109.071 -179.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 72' ' ' GLY . . . . . . . . . . . . . . . 178.44 163.78 30.38 Favored Glycine 0 N--CA 1.445 -0.73 0 N-CA-C 108.185 -1.966 . . . . 20.03 108.185 -179.086 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 73' ' ' PRO . . . . . . . . . . . . . 49.1 Cg_endo -62.61 159.49 36.54 Favored 'Trans proline' 0 CA--C 1.498 -1.294 0 N-CA-C 115.667 1.372 . . . . 22.49 115.667 -179.627 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.562 ' HB ' ' HG2' ' A' ' 10' ' ' GLN . 93.8 t -85.78 122.09 38.06 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.785 0 N-CA-C 105.425 -2.065 . . . . 20.08 105.425 178.049 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 75' ' ' ALA . . . . . . . . . . . . . . . -87.34 120.92 29.12 Favored 'General case' 0 C--N 1.327 -0.387 0 N-CA-C 106.323 -1.732 . . . . 20.06 106.323 179.146 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 76' ' ' ALA . . . . . . . . . . . . . . . -125.33 152.38 44.79 Favored 'General case' 0 CA--C 1.502 -0.893 0 C-N-CA 117.478 -1.689 . . . . 23.56 113.139 -178.105 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 77' ' ' SER . . . . . 0.58 ' OG ' ' ND2' ' A' ' 79' ' ' ASN . 75.1 p -113.96 -173.4 2.27 Favored 'General case' 0 CA--C 1.502 -0.889 0 N-CA-C 107.479 -1.304 . . . . 24.8 107.479 178.848 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 78' ' ' HIS . . . . . . . . . . . . . 95.5 m-70 -100.76 -0.71 36.65 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 116.261 -0.427 . . . . 37.27 111.694 -177.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 79' ' ' ASN . . . . . 0.624 ' H ' HD22 ' A' ' 79' ' ' ASN . 0.0 OUTLIER -104.03 28.71 6.49 Favored 'General case' 0 CA--C 1.553 1.073 0 N-CA-C 115.144 1.535 . . . . 38.36 115.144 179.118 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 80' ' ' GLY . . . . . . . . . . . . . . . 76.04 28.77 59.89 Favored Glycine 0 N--CA 1.449 -0.442 0 C-N-CA 120.185 -1.007 . . . . 25.45 114.255 178.204 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 81' ' ' CYS . . . . . . . . . . . . . 23.9 m -124.48 154.05 41.1 Favored 'General case' 0 N--CA 1.447 -0.6 0 CA-C-N 114.849 -0.676 . . . . 28.05 110.779 -178.937 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 82' ' ' GLY . . . . . . . . . . . . . . . -162.4 160.21 32.44 Favored Glycine 0 C--O 1.209 -1.419 0 N-CA-C 110.186 -1.165 . . . . 14.11 110.186 179.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 83' ' ' ALA . . . . . . . . . . . . . . . -142.71 157.28 44.82 Favored 'General case' 0 N--CA 1.444 -0.772 0 N-CA-C 104.725 -2.324 . . . . 8.9 104.725 178.309 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 84' ' ' MET . . . . . . . . . . . . . 2.6 ptt? -161.3 145.68 10.14 Favored Pre-proline 0 C--N 1.318 -0.786 0 N-CA-C 114.484 1.29 . . . . 18.38 114.484 -177.836 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 85' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -97.85 141.09 0.53 Allowed 'Trans proline' 0 CA--C 1.496 -1.385 0 C-N-CA 120.47 0.78 . . . . 16.17 110.585 179.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 86' ' ' PHE . . . . . 0.631 ' HB2' ' O ' ' A' ' 69' ' ' CYS . 33.6 p90 -160.26 158.4 29.82 Favored 'General case' 0 C--O 1.217 -0.618 0 N-CA-C 113.27 0.841 . . . . 10.91 113.27 177.032 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 87' ' ' ARG . . . . . . . . . . . . . 5.1 ttm180 -113.05 138.97 49.1 Favored 'General case' 0 C--N 1.326 -0.449 0 CA-C-O 122.301 1.048 . . . . 59.81 113.598 179.893 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 77.3 t -113.25 116.18 51.89 Favored 'Isoleucine or valine' 0 N--CA 1.441 -0.912 0 N-CA-C 106.222 -1.77 . . . . 31.68 106.222 179.48 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 30.7 mt-10 -101.16 106.72 17.99 Favored 'General case' 0 C--N 1.316 -0.867 0 C-N-CA 119.738 -0.785 . . . . 54.49 110.545 178.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 90' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -106.12 -155.78 0.56 Allowed 'General case' 0 C--O 1.237 0.418 0 C-N-CA 119.834 -0.746 . . . . 55.31 110.106 179.292 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 91' ' ' VAL . . . . . 1.007 ' HA ' ' HA ' ' A' ' 96' ' ' PRO . 46.4 t -157.96 90.49 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.511 -0.523 0 N-CA-C 104.622 -2.362 . . . . 68.95 104.622 178.239 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.715 ' N ' ' O ' ' A' ' 95' ' ' GLN . 6.9 t90 -81.52 117.91 22.31 Favored 'General case' 0 N--CA 1.443 -0.78 0 N-CA-C 117.508 2.41 . . . . 97.43 117.508 -178.083 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 1.2 m120 40.48 56.46 2.71 Favored 'General case' 0 C--O 1.238 0.471 0 O-C-N 124.413 1.07 . . . . 100.0 111.403 -179.841 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 94' ' ' GLY . . . . . . . . . . . . . . . 87.5 -34.63 3.62 Favored Glycine 0 C--N 1.334 0.449 0 CA-C-N 114.857 -1.065 . . . . 89.53 110.994 -179.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.715 ' O ' ' N ' ' A' ' 92' ' ' TRP . 1.6 tt0 -91.47 123.91 62.51 Favored Pre-proline 0 CA--C 1.508 -0.642 0 CA-C-O 121.658 0.742 . . . . 83.89 111.207 179.866 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 96' ' ' PRO . . . . . 1.007 ' HA ' ' HA ' ' A' ' 91' ' ' VAL . 85.6 Cg_endo -76.73 131.73 12.59 Favored 'Trans proline' 0 N--CA 1.46 -0.447 1 C-N-CA 125.322 4.015 . . . . 68.8 109.448 179.651 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 97' ' ' CYS . . . . . 1.082 ' CB ' HG23 ' A' ' 127' ' ' VAL . 4.2 p -136.48 170.33 16.22 Favored 'General case' 0 CA--C 1.511 -0.525 0 N-CA-C 108.511 -0.922 . . . . 54.98 108.511 178.916 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 98' ' ' ALA . . . . . . . . . . . . . . . -132.48 146.22 51.76 Favored 'General case' 0 C--O 1.216 -0.696 0 N-CA-C 108.289 -1.004 . . . . 36.37 108.289 -179.115 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 99' ' ' LEU . . . . . . . . . . . . . 57.7 tp -129.89 131.53 46.09 Favored 'General case' 0 N--CA 1.432 -1.344 0 N-CA-C 107.778 -1.193 . . . . 21.33 107.778 -179.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 100' ' ' ASP . . . . . . . . . . . . . 23.6 m-20 -104.19 117.37 34.09 Favored 'General case' 0 CA--C 1.509 -0.613 0 N-CA-C 106.695 -1.595 . . . . 21.49 106.695 179.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 101' ' ' VAL . . . . . 0.646 HG12 ' N ' ' A' ' 102' ' ' ILE . 98.1 t -118.43 167.08 12.14 Favored 'Isoleucine or valine' 0 CA--C 1.493 -1.233 0 C-N-CA 119.553 -0.859 . . . . 17.14 110.273 -178.671 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 102' ' ' ILE . . . . . 0.646 ' N ' HG12 ' A' ' 101' ' ' VAL . 0.6 OUTLIER -134.28 120.11 32.89 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.716 0 N-CA-C 105.436 -2.061 . . . . 13.04 105.436 172.244 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 103' ' ' ASP . . . . . . . . . . . . . 8.1 m-20 -103.1 143.0 33.17 Favored 'General case' 0 CA--C 1.507 -0.676 0 C-N-CA 120.868 -0.333 . . . . 20.65 110.775 179.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 104' ' ' VAL . . . . . . . . . . . . . 25.1 t -125.55 120.24 57.18 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.563 0 N-CA-C 103.601 -2.741 . . . . 13.25 103.601 175.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 105' ' ' MET . . . . . 0.669 ' HE2' HD13 ' A' ' 113' ' ' ILE . 13.5 mtt -121.41 152.55 38.93 Favored 'General case' 0 CA--C 1.472 -2.043 0 N-CA-C 113.258 0.836 . . . . 21.62 113.258 -178.303 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 106' ' ' ARG . . . . . 0.636 ' HB3' HG23 ' A' ' 115' ' ' THR . 1.6 ttm180 -129.21 123.79 32.91 Favored 'General case' 0 N--CA 1.441 -0.91 0 N-CA-C 106.941 -1.503 . . . . 72.37 106.941 178.44 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 107' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -95.15 160.07 14.72 Favored 'General case' 0 N--CA 1.443 -0.778 0 CA-C-N 115.815 -0.63 . . . . 23.84 112.041 178.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 108' ' ' ASP . . . . . . . . . . . . . 49.6 p30 -104.67 -176.54 3.11 Favored 'General case' 0 C--O 1.24 0.559 0 CA-C-O 121.323 0.583 . . . . 29.28 110.075 178.629 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 109' ' ' GLU . . . . . 0.438 ' CD ' ' H ' ' A' ' 109' ' ' GLU . 2.1 pm0 -64.5 2.77 0.58 Allowed 'General case' 0 C--O 1.209 -1.043 0 N-CA-C 114.061 1.134 . . . . 65.64 114.061 -178.987 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 40.9 m80 -115.97 -3.93 12.09 Favored 'General case' 0 CA--C 1.491 -1.317 0 C-N-CA 119.98 -0.688 . . . . 51.75 109.6 178.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 87.1 16.83 60.27 Favored Glycine 0 C--O 1.229 -0.201 0 C-N-CA 119.831 -1.176 . . . . 25.34 111.933 -179.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 112' ' ' ARG . . . . . . . . . . . . . 23.4 mtm-85 -102.92 157.38 17.01 Favored 'General case' 0 N--CA 1.44 -0.946 0 N-CA-C 106.73 -1.582 . . . . 59.64 106.73 179.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 113' ' ' ILE . . . . . 0.669 HD13 ' HE2' ' A' ' 105' ' ' MET . 44.6 mt -78.96 105.97 9.13 Favored 'Isoleucine or valine' 0 CA--C 1.496 -1.121 0 N-CA-C 112.862 0.69 . . . . 14.35 112.862 -179.098 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -71.29 -44.51 65.05 Favored 'General case' 0 C--N 1.316 -0.858 0 CA-C-O 122.598 1.189 . . . . 53.65 110.415 179.418 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 115' ' ' THR . . . . . 0.636 HG23 ' HB3' ' A' ' 106' ' ' ARG . 0.5 OUTLIER -147.64 140.18 24.62 Favored 'General case' 0 N--CA 1.437 -1.1 0 C-N-CA 118.933 -1.107 . . . . 28.72 111.829 -178.611 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' A' A ' 116' ' ' MET . . . . . . . . . . . . . 2.9 tmm? -126.6 144.47 50.89 Favored 'General case' 0 C--N 1.32 -0.676 0 N-CA-C 107.318 -1.364 . . . . 27.21 107.318 179.854 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 117' ' ' GLN . . . . . . . . . . . . . 91.5 mt-30 -141.71 127.87 19.7 Favored 'General case' 0 CA--C 1.505 -0.763 0 N-CA-C 108.101 -1.074 . . . . 33.11 108.101 178.779 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 118' ' ' ALA . . . . . . . . . . . . . . . -109.19 135.72 49.84 Favored 'General case' 0 CA--C 1.499 -1.003 0 C-N-CA 119.347 -0.941 . . . . 18.12 109.424 -178.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 119' ' ' TYR . . . . . . . . . . . . . 67.5 m-85 -110.18 115.37 29.6 Favored 'General case' 0 CA--C 1.504 -0.796 0 N-CA-C 107.987 -1.116 . . . . 26.05 107.987 178.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 120' ' ' TRP . . . . . 0.547 ' CE2' ' HB3' ' A' ' 41' ' ' PRO . 55.3 p-90 -171.86 164.68 6.44 Favored 'General case' 0 N--CA 1.469 0.482 0 N-CA-C 108.002 -1.11 . . . . 23.65 108.002 177.989 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 121' ' ' SER . . . . . 0.717 ' OG ' HG22 ' A' ' 123' ' ' VAL . 27.0 p -163.75 -172.78 2.99 Favored 'General case' 0 C--O 1.216 -0.671 0 N-CA-C 105.207 -2.145 . . . . 26.01 105.207 178.199 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 122' ' ' GLU . . . . . 0.529 ' CD ' ' H ' ' A' ' 122' ' ' GLU . 2.1 mp0 -68.56 -1.42 6.68 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 118.19 -1.404 . . . . 43.09 114.656 -177.065 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 123' ' ' VAL . . . . . 0.717 HG22 ' OG ' ' A' ' 121' ' ' SER . 29.4 m -84.03 -12.7 11.74 Favored 'Isoleucine or valine' 0 CA--C 1.512 -0.516 0 O-C-N 124.226 0.954 . . . . 26.97 109.218 -178.778 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.479 ' HA ' ' O ' ' A' ' 511' ' ' HOH . 35.5 m120 -106.39 -2.71 21.86 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.226 -0.897 . . . . 20.62 112.207 -177.969 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 125' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -86.05 141.17 29.64 Favored 'General case' 0 N--CA 1.442 -0.836 0 CA-C-N 115.249 -0.887 . . . . 36.49 109.605 178.982 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 126' ' ' SER . . . . . . . . . . . . . 18.7 m -130.1 98.4 4.74 Favored 'General case' 0 CA--C 1.5 -0.971 0 N-CA-C 101.44 -3.541 . . . . 48.31 101.44 177.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 127' ' ' VAL . . . . . 1.082 HG23 ' CB ' ' A' ' 97' ' ' CYS . 0.3 OUTLIER . . . . . 0 C--O 1.264 1.854 0 CA-C-O 116.41 -1.757 . . . . 55.08 110.832 -178.964 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 501' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 502' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 503' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 504' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 505' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 506' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 507' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 508' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 509' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 510' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 511' ' ' HOH . . . . . 0.479 ' O ' ' HA ' ' A' ' 124' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 512' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 513' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 514' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 515' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 516' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 517' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 518' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 519' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 520' ' ' HOH . . . . . 0.663 ' O ' ' HG2' ' A' ' 39' ' ' GLU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 521' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 522' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 523' ' ' HOH . . . . . 0.913 ' O ' ' SG ' ' A' ' 69' ' ' CYS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 524' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 525' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 526' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_