data_6mtv_residue ############################ # Computer software used # ############################ 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 6mtv _Structure_validation_residue.Date_analyzed 2019-08-09 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 ' 716' ' ' LEU . . . . . . . . . . . . . 80.2 mt . . . . . 0 C--O 1.233 0.21 0 N-CA-C 109.58 -0.526 . . . . 126.78 109.58 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 717' ' ' ILE . . . . . . . . . . . . . . . -151.2 156.11 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.164 0 CA-C-O 121.745 0.783 . . . . 103.93 109.587 -167.831 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 718' ' ' GLU . . . . . 0.637 ' OE2' ' NH1' ' A' ' 721' ' ' ARG . 56.8 mt-10 -65.29 143.2 98.71 Favored Pre-proline 0 N--CA 1.453 -0.3 0 CA-C-N 115.476 -0.784 . . . . 120.61 109.749 174.721 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_exo -72.94 -174.59 1.59 Allowed 'Trans proline' 0 CA--C 1.511 -0.655 0 O-C-N 121.855 0.397 . . . . 131.71 112.571 177.361 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 720' ' ' ALA . . . . . . . . . . . . . . . -78.33 126.6 31.02 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.072 -0.714 . . . . 95.39 109.072 170.946 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 721' ' ' ARG . . . . . 0.637 ' NH1' ' OE2' ' A' ' 718' ' ' GLU . 24.4 ptt-85 -134.29 150.71 51.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.475 0.655 . . . . 94.08 110.763 -174.185 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 722' ' ' ILE . . . . . . . . . . . . . 2.6 mp -85.89 116.89 29.68 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 N-CA-C 108.115 -1.069 . . . . 86.01 108.115 178.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 723' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -80.42 -41.27 24.84 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 116.401 -0.363 . . . . 83.39 111.35 176.821 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -158.55 164.4 36.14 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 108.336 -0.987 . . . . 81.06 108.336 179.149 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 725' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -166.8 165.37 16.3 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.53 -0.915 . . . . 73.08 108.53 -176.182 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -122.35 115.17 21.84 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 107.687 -1.227 . . . . 73.08 107.687 174.107 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 727' ' ' LEU . . . . . . . . . . . . . 23.4 mt -109.3 131.21 55.28 Favored 'General case' 0 C--O 1.235 0.301 0 O-C-N 123.336 0.397 . . . . 67.11 110.308 -174.697 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 728' ' ' THR . . . . . . . . . . . . . 63.7 m -95.98 116.29 28.71 Favored 'General case' 0 C--O 1.239 0.5 0 N-CA-C 107.574 -1.269 . . . . 66.94 107.574 166.898 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 40.8 mt -121.85 146.29 47.23 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 123.136 0.574 . . . . 58.73 110.338 -174.201 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 730' ' ' THR . . . . . . . . . . . . . 86.9 m -115.06 124.78 52.45 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 108.358 -0.978 . . . . 61.62 108.358 178.073 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 731' ' ' ILE . . . . . . . . . . . . . 58.4 mt -114.22 126.96 71.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.408 0 N-CA-C 108.171 -1.048 . . . . 70.76 108.171 178.762 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 732' ' ' LEU . . . . . . . . . . . . . . . -112.15 128.97 56.38 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 109.315 -0.624 . . . . 71.67 109.315 -179.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 733' ' ' ARG . . . . . 0.438 ' NE ' ' O ' ' A' ' 803' ' ' ALA . 0.5 OUTLIER . . . . . 0 C--N 1.331 -0.233 0 CA-C-O 120.796 0.331 . . . . 87.33 111.03 177.348 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 736' ' ' GLY . . . . . 0.765 ' N ' ' O ' ' A' 1001 ' ' HOH . . . . . . . . 0 N--CA 1.451 -0.366 0 N-CA-C 113.573 0.189 . . . . 79.7 113.573 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 737' ' ' GLY . . . . . . . . . . . . . . . -104.14 173.0 21.12 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-O 122.129 0.85 . . . . 84.53 112.47 -177.865 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 738' ' ' LEU . . . . . 0.412 ' O ' ' HG2' ' A' ' 768' ' ' PRO . 81.2 mt -85.66 -30.04 23.52 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 114.83 -0.685 . . . . 89.05 112.71 179.566 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 739' ' ' GLY . . . . . . . . . . . . . . . 92.98 26.0 17.95 Favored Glycine 0 N--CA 1.447 -0.597 0 N-CA-C 114.782 0.673 . . . . 74.3 114.782 -179.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 740' ' ' ILE . . . . . . . . . . . . . 28.2 pt -131.18 155.21 41.71 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.216 0 CA-C-N 118.166 0.983 . . . . 71.7 109.28 179.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 741' ' ' SER . . . . . 0.437 ' HB2' ' HB3' ' A' ' 762' ' ' ARG . 71.6 m -125.64 115.64 20.44 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 107.449 -1.315 . . . . 80.16 107.449 167.724 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 742' ' ' ILE . . . . . . . . . . . . . 40.6 pt -91.15 148.64 4.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 N-CA-C 108.941 -0.763 . . . . 73.37 108.941 179.478 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 743' ' ' ALA . . . . . . . . . . . . . . . -139.5 152.6 47.09 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.324 -0.621 . . . . 69.8 109.324 -179.777 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 744' ' ' GLY . . . . . . . . . . . . . . . 95.88 -153.51 20.62 Favored Glycine 0 N--CA 1.446 -0.647 0 CA-C-N 115.582 -0.735 . . . . 69.65 113.545 177.006 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 745' ' ' GLY . . . . . . . . . . . . . . . 113.33 162.3 14.95 Favored Glycine 0 N--CA 1.446 -0.656 0 CA-C-O 122.225 0.903 . . . . 66.31 111.585 -173.881 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 746' ' ' LYS . . . . . . . . . . . . . 16.2 mmtp -70.65 121.3 17.65 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 114.971 -0.614 . . . . 85.87 109.575 175.803 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 747' ' ' GLY . . . . . . . . . . . . . . . 97.03 4.32 58.74 Favored Glycine 0 N--CA 1.444 -0.787 0 CA-C-O 119.128 -0.818 . . . . 82.7 114.636 -176.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 748' ' ' SER . . . . . . . . . . . . . 45.7 m -121.55 156.14 33.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 118.114 0.957 . . . . 78.74 109.287 178.764 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 4.1 p -57.93 122.59 58.73 Favored Pre-proline 0 C--O 1.242 0.674 0 CA-C-N 115.589 -0.732 . . . . 92.59 109.392 178.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 750' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -62.04 161.37 26.37 Favored 'Trans proline' 0 C--O 1.232 0.224 0 CA-C-O 122.202 0.834 . . . . 90.92 112.702 -170.501 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 751' ' ' TYR . . . . . . . . . . . . . 78.6 t80 -94.77 -39.91 10.03 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 114.875 -1.057 . . . . 86.02 112.779 178.302 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 752' ' ' LYS . . . . . . . . . . . . . 20.7 ttpt -136.19 121.24 18.87 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 108.596 -0.891 . . . . 128.64 108.596 -177.385 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 753' ' ' GLY . . . . . . . . . . . . . . . 58.44 -131.88 52.27 Favored Glycine 0 C--O 1.237 0.293 0 C-N-CA 120.562 -0.828 . . . . 111.08 111.39 176.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -105.44 -0.6 25.85 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 112.389 0.514 . . . . 97.95 112.389 174.253 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 755' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -67.18 115.85 7.32 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 118.267 0.485 . . . . 84.0 109.82 177.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 756' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -91.89 23.71 3.54 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 112.824 0.675 . . . . 76.85 112.824 -179.643 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 757' ' ' GLY . . . . . . . . . . . . . . . -73.0 173.67 47.83 Favored Glycine 0 N--CA 1.449 -0.464 0 CA-C-O 122.734 1.186 . . . . 69.51 112.298 176.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 758' ' ' ILE . . . . . . . . . . . . . 4.3 mt -91.18 124.7 43.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 108.06 -1.089 . . . . 67.04 108.06 176.694 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 759' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -120.89 159.08 26.26 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 121.529 0.681 . . . . 66.84 110.52 -175.698 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 760' ' ' ILE . . . . . . . . . . . . . 43.3 mm -85.53 115.07 26.47 Favored 'Isoleucine or valine' 0 C--O 1.24 0.553 0 N-CA-C 107.687 -1.227 . . . . 68.31 107.687 172.287 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 761' ' ' SER . . . . . . . . . . . . . 14.9 p -101.8 -18.68 15.66 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 113.442 0.904 . . . . 69.66 113.442 -177.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 762' ' ' ARG . . . . . 0.437 ' HB3' ' HB2' ' A' ' 741' ' ' SER . 29.7 tpt180 -154.1 139.09 17.27 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.775 -0.824 . . . . 119.98 108.775 179.103 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 83.9 t -123.79 122.3 64.4 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 N-CA-C 107.784 -1.191 . . . . 77.89 107.784 175.917 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 2.5 m -58.03 142.67 45.99 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.14 0.495 . . . . 78.1 110.439 178.336 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 765' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -63.47 119.18 9.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.76 -0.655 . . . . 79.66 109.872 -178.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 766' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 54.52 24.83 5.64 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 116.104 -0.498 . . . . 77.98 112.216 178.301 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 767' ' ' GLY . . . . . . . . . . . . . . . -75.28 176.55 49.85 Favored Glycine 0 N--CA 1.425 -2.042 0 O-C-N 121.918 -0.489 . . . . 71.99 112.022 174.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 768' ' ' PRO . . . . . 0.412 ' HG2' ' O ' ' A' ' 738' ' ' LEU . 19.1 Cg_endo -57.87 -31.75 93.32 Favored 'Trans proline' 0 C--O 1.237 0.472 0 O-C-N 122.786 0.887 . . . . 67.83 113.647 -179.415 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 769' ' ' ALA . . . . . . . . . . . . . . . -76.1 -35.7 59.21 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 118.769 0.713 . . . . 66.13 111.414 178.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 770' ' ' ALA . . . . . . . . . . . . . . . -66.27 -33.99 77.0 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.49 -0.484 . . . . 70.28 111.376 176.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 771' ' ' ARG . . . . . . . . . . . . . 3.4 mpp_? -69.0 -29.87 68.16 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.277 -0.569 . . . . 78.57 111.294 173.974 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 772' ' ' ALA . . . . . 0.515 ' HA ' ' H22' ' A' ' 901' ' ' PEG . . . -72.3 -16.72 61.9 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 112.379 0.511 . . . . 65.21 112.379 178.963 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 101.69 6.0 50.43 Favored Glycine 0 N--CA 1.444 -0.772 0 CA-C-O 119.029 -0.873 . . . . 62.9 114.854 -174.965 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 774' ' ' VAL . . . . . . . . . . . . . 98.7 t -63.41 131.96 29.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 CA-C-N 118.25 1.025 . . . . 62.21 109.328 179.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 775' ' ' ARG . . . . . . . . . . . . . . . -116.65 150.24 38.44 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 109.669 -0.493 . . . . 63.23 109.669 -178.306 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 776' ' ' VAL . . . . . . . . . . . . . 10.4 t -70.54 128.25 33.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 CA-C-N 115.565 -0.743 . . . . 74.96 109.088 -178.525 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 777' ' ' GLY . . . . . . . . . . . . . . . 102.24 -3.07 50.9 Favored Glycine 0 N--CA 1.443 -0.847 0 CA-C-O 119.03 -0.872 . . . . 66.86 114.771 -174.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 778' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -67.19 139.59 57.42 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 118.458 1.129 . . . . 68.79 109.895 177.911 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 779' ' ' LYS . . . . . . . . . . . . . 21.3 tttt -94.14 130.67 40.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.88 -0.6 . . . . 65.7 109.409 178.377 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 780' ' ' LEU . . . . . . . . . . . . . 10.6 mt -78.21 112.86 15.62 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 109.372 -0.603 . . . . 61.44 109.372 178.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 781' ' ' LEU . . . . . . . . . . . . . 83.4 mt -95.94 -26.33 15.62 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.955 0.724 . . . . 67.27 112.955 172.314 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 782' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -163.54 144.21 8.94 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 109.572 -0.529 . . . . 71.78 109.572 -170.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 783' ' ' VAL . . . . . . . . . . . . . 8.8 t -141.81 120.2 9.18 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 N-CA-C 107.879 -1.156 . . . . 69.91 107.879 176.655 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 784' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 50.11 35.44 10.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.351 0.596 . . . . 79.94 111.871 175.734 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 785' ' ' GLY . . . . . . . . . . . . . . . 88.64 -9.34 76.37 Favored Glycine 0 N--CA 1.447 -0.58 0 N-CA-C 115.396 0.918 . . . . 74.54 115.396 -178.43 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 786' ' ' VAL . . . . . . . . . . . . . 80.6 t -87.1 116.89 30.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 118.723 1.261 . . . . 81.12 108.374 177.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . -71.96 117.49 13.63 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 109.672 -0.492 . . . . 73.14 109.672 176.18 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 788' ' ' LEU . . . . . . . . . . . . . 95.4 mt -102.51 23.98 11.1 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 112.425 0.528 . . . . 71.67 112.425 -179.475 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 789' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -82.89 124.33 30.24 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 108.817 -0.809 . . . . 76.49 108.817 177.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 790' ' ' GLY . . . . . . . . . . . . . . . 64.89 39.63 96.66 Favored Glycine 0 C--O 1.237 0.325 0 C-N-CA 120.005 -1.093 . . . . 60.92 112.398 -175.892 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 791' ' ' ALA . . . . . . . . . . . . . . . -110.95 166.1 11.32 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.99 0.9 . . . . 70.12 109.93 -178.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 792' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -86.93 163.73 16.96 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.988 -1.005 . . . . 77.94 110.19 178.931 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 793' ' ' HIS . . . . . 0.496 ' NE2' ' OG1' ' D' ' 827' ' ' THR . 47.2 t60 -62.3 -48.04 81.62 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 115.255 -0.884 . . . . 77.99 111.005 -175.238 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 794' ' ' HIS . . . . . . . . . . . . . 6.6 p-80 -64.62 -18.36 64.84 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 119.968 -0.693 . . . . 83.32 111.607 179.899 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 795' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -70.32 -37.77 74.8 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.856 -0.338 . . . . 93.23 110.922 178.242 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 796' ' ' ALA . . . . . . . . . . . . . . . -80.49 -31.83 37.14 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 112.009 0.374 . . . . 79.05 112.009 178.243 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 797' ' ' VAL . . . . . . . . . . . . . 54.3 t -65.33 -45.71 92.57 Favored 'Isoleucine or valine' 0 C--O 1.236 0.361 0 CA-C-O 121.082 0.468 . . . . 97.89 110.386 179.565 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 798' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -68.1 -26.44 65.82 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 119.75 -0.78 . . . . 89.07 111.202 179.101 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 799' ' ' ALA . . . . . . . . . . . . . . . -76.9 -15.71 59.61 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 112.501 0.556 . . . . 77.18 112.501 175.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 74.0 mt -113.77 -10.03 13.07 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 113.407 0.892 . . . . 77.27 113.407 -179.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 801' ' ' ARG . . . . . . . . . . . . . 34.7 ptt180 -81.43 -29.94 33.67 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 119.703 -0.799 . . . . 94.58 112.003 -177.273 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 802' ' ' GLY . . . . . . . . . . . . . . . -59.23 -75.65 0.26 Allowed Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.032 -1.08 . . . . 90.78 111.181 175.618 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 803' ' ' ALA . . . . . 0.438 ' O ' ' NE ' ' A' ' 733' ' ' ARG . . . 40.32 55.9 2.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 122.306 1.05 . . . . 90.69 111.44 171.011 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 804' ' ' GLY . . . . . . . . . . . . . . . -47.85 -51.99 17.14 Favored Glycine 0 C--N 1.333 0.401 0 CA-C-N 114.721 -1.127 . . . . 94.93 112.414 -179.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 805' ' ' THR . . . . . 0.474 ' CG2' ' HA ' ' B' ' 799' ' ' ALA . 14.3 t -141.33 -31.2 0.59 Allowed 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 114.358 1.244 . . . . 92.49 114.358 176.844 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 806' ' ' ALA . . . . . . . . . . . . . . . -144.16 150.09 37.5 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 119.795 1.18 . . . . 81.2 110.136 -179.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 807' ' ' VAL . . . . . . . . . . . . . . . -128.56 137.69 56.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 106.681 -1.6 . . . . 71.21 106.681 172.552 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 808' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -117.04 121.99 42.9 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 107.178 -1.415 . . . . 64.01 107.178 174.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 809' ' ' MET . . . . . . . . . . . . . 2.4 ptm -129.63 134.91 47.95 Favored 'General case' 0 C--O 1.235 0.299 0 O-C-N 123.353 0.408 . . . . 62.2 110.009 -176.194 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 810' ' ' ARG . . . . . . . . . . . . . 38.1 mtp85 -88.67 133.32 34.24 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 108.222 -1.029 . . . . 87.08 108.222 167.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 811' ' ' VAL . . . . . . . . . . . . . 31.9 m -128.08 157.98 40.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-O 121.757 0.789 . . . . 61.22 109.39 -176.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 812' ' ' TRP . . . . . . . . . . . . . 62.4 t-105 -112.95 113.04 24.92 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 107.795 -1.187 . . . . 78.38 107.795 175.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 813' ' ' ARG . . . . . . . . . . . . . 35.8 ttm180 -106.83 135.81 47.74 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.448 -0.945 . . . . 75.89 108.448 -179.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 814' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -128.92 108.2 10.23 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 108.477 -0.934 . . . . 83.9 108.477 -177.258 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 815' ' ' ARG . . . . . . . . . . . . . 3.0 mtp85 . . . . . 0 C--N 1.331 -0.21 0 O-C-N 123.36 0.413 . . . . 125.71 110.62 -173.713 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 712' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 -0.151 0 N-CA-C 110.158 -0.312 . . . . 129.54 110.158 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 713' ' ' ASN . . . . . 0.653 ' OD1' ' O ' ' B' 1001 ' ' HOH . 0.7 OUTLIER -96.09 -33.79 11.96 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 113.468 0.914 . . . . 112.39 113.468 -173.333 . . . . . . . . 3 3 . 1 . 001 ecloud orig full ' B' B ' 714' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -116.43 47.65 1.39 Allowed 'General case' 0 C--O 1.234 0.272 0 C-N-CA 119.136 -1.026 . . . . 104.84 112.464 -175.08 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 715' ' ' LEU . . . . . . . . . . . . . 7.9 tp -99.92 120.84 40.42 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 106.951 -1.499 . . . . 89.12 106.951 164.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 716' ' ' LEU . . . . . . . . . . . . . 31.2 mt -113.71 159.66 19.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.436 0.636 . . . . 89.16 109.914 -176.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 717' ' ' ILE . . . . . . . . . . . . . 11.8 pt -130.11 163.99 34.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-O 121.788 0.804 . . . . 61.63 109.605 -177.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 718' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -86.6 132.18 43.37 Favored Pre-proline 0 C--O 1.237 0.426 0 CA-C-N 115.163 -0.926 . . . . 72.8 109.578 173.619 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 719' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_exo -64.03 160.4 37.98 Favored 'Trans proline' 0 C--O 1.233 0.236 0 CA-C-O 121.981 0.742 . . . . 62.96 112.139 -173.879 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 720' ' ' ALA . . . . . . . . . . . . . . . -65.63 122.2 16.71 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 114.962 -1.017 . . . . 59.78 108.918 170.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 721' ' ' ARG . . . . . . . . . . . . . 28.5 ptt85 -127.32 133.54 50.1 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.906 -0.405 . . . . 107.13 109.906 -174.164 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 722' ' ' ILE . . . . . . . . . . . . . 11.8 mt -85.65 122.73 38.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 108.167 -1.049 . . . . 74.43 108.167 178.42 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 723' ' ' GLU . . . . . . . . . . . . . 58.3 mm-40 -80.83 -58.41 3.11 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 120.992 0.425 . . . . 79.42 110.645 175.413 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 724' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -129.16 166.21 19.79 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 107.968 -1.123 . . . . 77.33 107.968 176.927 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 725' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -169.25 149.17 4.08 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 109.352 -0.61 . . . . 72.06 109.352 176.463 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 726' ' ' GLU . . . . . . . . . . . . . 70.8 mt-10 -108.21 133.27 52.7 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.339 -0.846 . . . . 79.56 108.805 171.465 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 727' ' ' LEU . . . . . . . . . . . . . 62.3 mt -120.34 127.65 52.53 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 109.54 -0.541 . . . . 78.03 109.54 -178.56 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 728' ' ' THR . . . . . . . . . . . . . 24.3 m -100.73 114.81 28.9 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 106.789 -1.56 . . . . 90.11 106.789 169.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 729' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -129.06 133.41 47.68 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.929 -0.767 . . . . 93.64 108.929 -176.791 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 730' ' ' THR . . . . . . . . . . . . . 2.8 m -100.48 131.27 46.49 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 109.085 -0.709 . . . . 85.61 109.085 -179.685 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 731' ' ' ILE . . . . . . . . . . . . . 38.3 mt -115.23 134.64 57.73 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 N-CA-C 108.016 -1.105 . . . . 84.42 108.016 -175.853 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 732' ' ' LEU . . . . . . . . . . . . . . . -92.36 -173.78 3.51 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 121.567 0.699 . . . . 96.6 109.9 179.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 733' ' ' ARG . . . . . . . . . . . . . 10.7 tpp85 . . . . . 0 C--N 1.331 -0.236 0 O-C-N 121.913 -0.492 . . . . 120.5 110.868 -178.997 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 735' ' ' THR . . . . . . . . . . . . . 44.2 m . . . . . 0 C--O 1.233 0.224 0 CA-C-O 120.866 0.365 . . . . 121.16 111.606 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 736' ' ' GLY . . . . . . . . . . . . . . . 84.42 129.67 1.89 Allowed Glycine 0 N--CA 1.449 -0.446 0 CA-C-N 115.897 -0.592 . . . . 100.65 114.553 174.409 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 737' ' ' GLY . . . . . . . . . . . . . . . 76.0 150.21 2.94 Favored Glycine 0 C--N 1.332 0.314 0 N-CA-C 116.356 1.302 . . . . 88.08 116.356 171.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 738' ' ' LEU . . . . . . . . . . . . . . . -109.62 -27.8 9.19 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 113.263 0.838 . . . . 87.16 113.263 175.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 739' ' ' GLY . . . . . . . . . . . . . . . 96.49 26.95 10.27 Favored Glycine 0 N--CA 1.442 -0.965 0 N-CA-C 116.308 1.283 . . . . 97.97 116.308 172.908 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 740' ' ' ILE . . . . . . . . . . . . . 18.7 pt -139.46 168.58 18.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 CA-C-N 118.583 1.191 . . . . 97.72 109.119 -179.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 741' ' ' SER . . . . . . . . . . . . . 68.9 m -132.59 126.08 31.95 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 107.389 -1.337 . . . . 91.73 107.389 170.645 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 742' ' ' ILE . . . . . . . . . . . . . 23.4 pt -102.25 142.25 16.91 Favored 'Isoleucine or valine' 0 C--O 1.238 0.489 0 N-CA-C 109.065 -0.717 . . . . 86.18 109.065 -177.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 743' ' ' ALA . . . . . . . . . . . . . . . -132.17 172.36 12.5 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 123.479 0.712 . . . . 79.0 109.129 179.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 744' ' ' GLY . . . . . . . . . . . . . . . 84.63 -173.41 49.39 Favored Glycine 0 N--CA 1.443 -0.866 0 CA-C-O 122.433 1.018 . . . . 74.66 112.256 -176.722 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 745' ' ' GLY . . . . . . . . . . . . . . . 140.75 159.94 8.12 Favored Glycine 0 N--CA 1.45 -0.38 0 CA-C-O 122.198 0.888 . . . . 78.96 111.652 179.652 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 746' ' ' LYS . . . . . . . . . . . . . 8.7 tttp -76.44 122.89 25.16 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 109.354 -0.61 . . . . 85.33 109.354 -179.19 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 747' ' ' GLY . . . . . . . . . . . . . . . 80.74 13.03 82.11 Favored Glycine 0 N--CA 1.445 -0.741 0 CA-C-O 119.308 -0.718 . . . . 86.14 114.581 -173.681 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 748' ' ' SER . . . . . . . . . . . . . 5.0 m -111.4 175.69 5.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 118.047 0.924 . . . . 91.4 109.775 179.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 749' ' ' THR . . . . . . . . . . . . . 62.8 m -66.05 124.2 87.15 Favored Pre-proline 0 C--O 1.239 0.501 0 N-CA-C 108.61 -0.885 . . . . 132.73 108.61 172.668 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 750' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -65.1 138.97 58.89 Favored 'Trans proline' 0 C--O 1.233 0.272 0 CA-C-N 119.506 0.859 . . . . 117.95 111.979 -177.137 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 751' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -69.88 -46.77 64.77 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.424 -0.807 . . . . 110.02 110.587 173.979 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 752' ' ' LYS . . . . . . . . . . . . . 5.6 mtmm . . . . . 0 C--N 1.33 -0.243 0 N-CA-C 109.903 -0.406 . . . . 127.2 109.903 175.052 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 755' ' ' ASP . . . . . . . . . . . . . 9.8 t70 . . . . . 0 C--O 1.232 0.18 0 CA-C-O 120.891 0.376 . . . . 101.25 110.375 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 756' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -90.42 16.81 8.14 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.667 0.617 . . . . 92.32 112.667 179.749 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 757' ' ' GLY . . . . . . . . . . . . . . . -62.91 168.08 19.83 Favored Glycine 0 N--CA 1.448 -0.537 0 CA-C-O 122.832 1.24 . . . . 90.58 111.393 178.047 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 758' ' ' ILE . . . . . . . . . . . . . 5.6 mt -92.53 123.66 44.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 N-CA-C 107.977 -1.12 . . . . 73.88 107.977 177.272 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 759' ' ' PHE . . . . . . . . . . . . . 79.3 m-85 -119.53 164.04 16.4 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 121.375 0.607 . . . . 86.62 109.665 179.748 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 760' ' ' ILE . . . . . . . . . . . . . 18.3 mm -89.35 104.62 15.17 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 N-CA-C 106.26 -1.756 . . . . 84.02 106.26 173.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 761' ' ' SER . . . . . . . . . . . . . 89.5 p -75.54 -27.03 58.52 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 112.225 0.454 . . . . 86.3 112.225 -177.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 762' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -157.23 157.51 34.45 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 108.717 -0.845 . . . . 116.06 108.717 -179.85 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 763' ' ' VAL . . . . . . . . . . . . . 73.3 t -133.6 127.78 53.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.39 0 N-CA-C 108.382 -0.97 . . . . 95.93 108.382 176.481 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 7.4 m -58.47 139.87 54.88 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.164 0.507 . . . . 103.93 109.919 176.667 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 765' ' ' GLU . . . . . 0.408 ' OE1' ' N ' ' B' ' 765' ' ' GLU . 3.1 mp0 -52.61 -46.73 67.12 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.748 -0.66 . . . . 124.56 111.487 -171.216 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 766' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -135.08 83.18 2.0 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 107.336 -1.357 . . . . 127.8 107.336 179.419 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 767' ' ' GLY . . . . . . . . . . . . . . . -128.44 174.58 18.86 Favored Glycine 0 N--CA 1.443 -0.898 0 N-CA-C 111.065 -0.814 . . . . 112.74 111.065 175.611 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 768' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.41 -36.02 98.02 Favored 'Trans proline' 0 C--O 1.236 0.409 0 CA-C-N 117.017 0.409 . . . . 88.51 113.125 -179.07 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 769' ' ' ALA . . . . . . . . . . . . . . . -70.84 -32.48 69.53 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.26 -0.576 . . . . 83.69 111.532 178.542 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 770' ' ' ALA . . . . . . . . . . . . . . . -66.2 -35.28 80.04 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.109 -0.637 . . . . 94.83 111.082 173.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 771' ' ' ARG . . . . . . . . . . . . . . . -68.56 -33.83 74.77 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.653 -0.419 . . . . 90.26 111.461 177.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 772' ' ' ALA . . . . . . . . . . . . . . . -75.75 -22.29 56.63 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 112.495 0.554 . . . . 87.97 112.495 178.581 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 773' ' ' GLY . . . . . . . . . . . . . . . 110.46 19.06 8.12 Favored Glycine 0 N--CA 1.442 -0.966 0 N-CA-C 116.542 1.377 . . . . 89.49 116.542 177.594 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 774' ' ' VAL . . . . . . . . . . . . . 39.2 t -71.25 133.66 31.42 Favored 'Isoleucine or valine' 0 C--O 1.238 0.495 0 CA-C-N 118.854 1.327 . . . . 78.75 109.096 178.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 775' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -112.94 152.19 29.64 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 123.063 0.545 . . . . 97.94 109.873 -179.702 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 776' ' ' VAL . . . . . . . . . . . . . 73.8 t -67.46 129.08 31.74 Favored 'Isoleucine or valine' 0 C--O 1.239 0.534 0 N-CA-C 109.089 -0.708 . . . . 90.35 109.089 175.49 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 777' ' ' GLY . . . . . . . . . . . . . . . 103.18 -13.02 55.5 Favored Glycine 0 N--CA 1.446 -0.698 0 CA-C-O 119.196 -0.78 . . . . 80.4 114.494 -177.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 778' ' ' ASP . . . . . 0.463 ' HB3' ' HB ' ' B' ' 811' ' ' VAL . 84.8 m-20 -60.35 130.22 45.56 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 118.005 0.903 . . . . 79.01 109.928 177.707 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 779' ' ' LYS . . . . . 0.447 ' HB3' ' HB3' ' B' ' 812' ' ' TRP . 84.3 tttt -81.7 126.16 31.46 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.19 -0.671 . . . . 92.32 109.19 175.035 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 780' ' ' LEU . . . . . . . . . . . . . 12.7 tp -78.87 116.59 19.29 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 109.145 -0.687 . . . . 76.04 109.145 -179.566 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 781' ' ' LEU . . . . . . . . . . . . . 95.0 mt -98.37 -47.32 5.46 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 112.643 0.608 . . . . 82.63 112.643 -177.851 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 782' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -144.62 152.32 40.31 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.276 0.56 . . . . 68.78 109.794 -174.732 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 783' ' ' VAL . . . . . . . . . . . . . 49.3 t -136.61 119.01 20.49 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 N-CA-C 107.259 -1.386 . . . . 73.29 107.259 173.404 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 784' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 51.73 39.21 24.9 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 121.5 0.667 . . . . 69.63 111.414 179.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 785' ' ' GLY . . . . . . . . . . . . . . . 85.45 -6.48 79.92 Favored Glycine 0 N--CA 1.445 -0.747 0 N-CA-C 115.744 1.058 . . . . 58.03 115.744 177.441 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 786' ' ' VAL . . . . . . . . . . . . . 3.3 t -97.91 119.87 46.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 CA-C-N 118.762 1.281 . . . . 80.86 108.647 179.146 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 787' ' ' ALA . . . . . . . . . . . . . . . -72.6 136.85 45.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.304 0.574 . . . . 63.42 110.604 -179.394 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 788' ' ' LEU . . . . . . . . . . . . . 83.9 mt -113.86 18.01 17.62 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.657 -0.701 . . . . 71.37 111.762 178.416 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 789' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -66.62 -29.64 69.72 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.625 -0.43 . . . . 100.47 111.792 -173.341 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 790' ' ' GLY . . . . . . . . . . . . . . . -123.4 30.99 4.79 Favored Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 111.851 -0.5 . . . . 85.23 111.851 176.824 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 791' ' ' ALA . . . . . . . . . . . . . . . -95.18 153.66 17.56 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.506 0.67 . . . . 76.66 110.909 -174.214 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 792' ' ' GLU . . . . . . . . . . . . . 88.4 mt-10 -74.41 165.29 25.44 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 122.06 0.933 . . . . 76.29 109.904 174.97 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 793' ' ' HIS . . . . . . . . . . . . . 22.8 t60 -62.66 -45.38 93.05 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 115.461 -0.79 . . . . 76.51 110.979 -175.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 794' ' ' HIS . . . . . . . . . . . . . 6.0 p80 -65.37 -22.45 66.8 Favored 'General case' 0 C--O 1.235 0.31 0 O-C-N 121.91 -0.494 . . . . 69.98 112.316 -179.646 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 795' ' ' GLU . . . . . . . . . . . . . 87.6 mt-10 -74.73 -33.85 62.44 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.374 -0.53 . . . . 72.58 111.384 178.231 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 796' ' ' ALA . . . . . . . . . . . . . . . -71.32 -38.76 71.7 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.159 -0.616 . . . . 74.27 110.856 174.189 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 797' ' ' VAL . . . . . . . . . . . . . 69.8 t -60.77 -49.84 82.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 C-N-CA 120.425 -0.51 . . . . 73.76 110.043 177.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 798' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -57.55 -23.89 53.05 Favored 'General case' 0 C--O 1.238 0.478 0 O-C-N 121.9 -0.5 . . . . 89.99 112.014 175.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 799' ' ' ALA . . . . . 0.474 ' HA ' ' CG2' ' A' ' 805' ' ' THR . . . -75.92 -46.65 28.85 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 120.547 -0.461 . . . . 79.71 111.057 178.045 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 800' ' ' LEU . . . . . . . . . . . . . 96.8 mt -83.51 -40.97 18.5 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 111.936 0.347 . . . . 82.14 111.936 -177.688 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 801' ' ' ARG . . . . . . . . . . . . . 26.2 ttp180 . . . . . 0 C--N 1.33 -0.261 0 O-C-N 121.794 -0.566 . . . . 117.86 109.649 174.088 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 804' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.365 0 N-CA-C 112.034 -0.427 . . . . 98.62 112.034 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 805' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.72 -35.59 57.74 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 119.611 -0.836 . . . . 91.7 112.118 -175.07 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 806' ' ' ALA . . . . . . . . . . . . . . . -143.26 155.37 44.47 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.869 0.843 . . . . 87.14 109.896 -178.128 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 807' ' ' VAL . . . . . . . . . . . . . . . -140.43 133.3 33.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 N-CA-C 107.144 -1.428 . . . . 76.46 107.144 173.789 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 808' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -114.05 129.98 56.58 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.488 -0.93 . . . . 76.89 108.488 176.063 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 809' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -117.55 152.26 35.46 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.001 -0.74 . . . . 79.92 109.001 -179.278 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 810' ' ' ARG . . . . . . . . . . . . . 58.0 mtt85 -103.96 125.5 50.39 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.873 -1.158 . . . . 98.91 107.873 165.707 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 811' ' ' VAL . . . . . 0.463 ' HB ' ' HB3' ' B' ' 778' ' ' ASP . 22.4 m -117.12 155.97 18.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 121.807 0.813 . . . . 69.25 108.98 179.999 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 812' ' ' TRP . . . . . 0.447 ' HB3' ' HB3' ' B' ' 779' ' ' LYS . 72.6 t-105 -118.37 123.19 44.67 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 107.508 -1.293 . . . . 85.08 107.508 179.681 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 813' ' ' ARG . . . . . . . . . . . . . 36.4 ttm180 -122.86 134.49 54.39 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.729 -0.841 . . . . 86.2 108.729 -174.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 814' ' ' GLU . . . . . 0.405 ' O ' ' C ' ' B' ' 815' ' ' ARG . 45.8 mt-10 -128.33 92.53 3.46 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 108.173 -1.047 . . . . 85.78 108.173 -179.874 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 815' ' ' ARG . . . . . 0.405 ' C ' ' O ' ' B' ' 814' ' ' GLU . 5.6 ptp180 . . . . . 0 C--O 1.231 0.118 0 N-CA-C 114.762 1.393 . . . . 109.09 114.762 179.003 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 823' ' ' HIS . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 -0.321 0 N-CA-C 109.36 -0.607 . . . . 119.05 109.36 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' D' D ' 824' ' ' THR . . . . . . . . . . . . . . . -145.55 60.24 1.27 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 122.143 0.973 . . . . 109.34 111.186 -175.484 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 825' ' ' ASN . . . . . . . . . . . . . 34.6 t-20 55.67 73.63 0.42 Allowed 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 122.095 0.95 . . . . 94.83 112.233 164.122 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 826' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -104.91 143.14 33.56 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 114.768 -1.106 . . . . 92.22 108.883 167.007 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 827' ' ' THR . . . . . 0.496 ' OG1' ' NE2' ' A' ' 793' ' ' HIS . 44.0 m -125.07 128.67 48.84 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 108.834 -0.802 . . . . 82.61 108.834 178.797 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' D' D ' 828' ' ' SER . . . . . . . . . . . . . 45.8 t -84.19 140.94 31.39 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.099 0.476 . . . . 87.25 110.937 -177.188 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' D' D ' 829' ' ' LEU . . . . . . . . . . . . . 6.2 mt . . . . . 0 C--N 1.331 -0.226 0 CA-C-N 115.874 -0.603 . . . . 82.09 112.274 -177.234 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 825' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.812 0.339 . . . . 102.28 110.398 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 826' ' ' GLU . . . . . . . . . . . . . 15.2 mp0 -61.44 147.99 43.29 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.686 0.755 . . . . 100.71 111.015 -174.23 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 827' ' ' THR . . . . . . . . . . . . . 17.1 m -124.89 125.54 44.12 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 108.294 -1.002 . . . . 89.27 108.294 174.885 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 828' ' ' SER . . . . . . . . . . . . . 63.7 m -99.58 151.38 21.23 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.44 0.638 . . . . 95.98 111.287 -173.134 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' E' E ' 829' ' ' LEU . . . . . . . . . . . . . 28.0 mt . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 115.25 -0.886 . . . . 95.82 110.689 178.551 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 901' ' ' PEG . . . . . 0.515 ' H22' ' HA ' ' A' ' 772' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 902' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 903' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 901' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' E' E ' 901' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1001 ' ' HOH . . . . . 0.765 ' O ' ' N ' ' A' ' 736' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A 1002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A 1005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1001 ' ' HOH . . . . . 0.653 ' O ' ' OD1' ' B' ' 713' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B 1002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B 1008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 80.2 mt . . . . . 0 C--O 1.233 0.21 0 N-CA-C 109.58 -0.526 . . . . 104.8 109.58 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 717' ' ' ILE . . . . . . . . . . . . . . . -151.2 156.11 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.164 0 CA-C-O 121.745 0.783 . . . . 90.67 109.587 -167.831 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 718' ' ' GLU . . . . . 0.637 ' OE2' ' NH1' ' A' ' 721' ' ' ARG . 56.8 mt-10 -65.29 143.2 98.71 Favored Pre-proline 0 N--CA 1.453 -0.3 0 CA-C-N 115.476 -0.784 . . . . 99.65 109.749 174.721 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_exo -72.94 -174.59 1.59 Allowed 'Trans proline' 0 CA--C 1.511 -0.655 0 O-C-N 121.855 0.397 . . . . 108.91 112.571 177.361 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 720' ' ' ALA . . . . . . . . . . . . . . . -78.33 126.6 31.02 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.072 -0.714 . . . . 78.64 109.072 170.946 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 721' ' ' ARG . . . . . 0.637 ' NH1' ' OE2' ' A' ' 718' ' ' GLU . 24.4 ptt-85 -134.29 150.71 51.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.475 0.655 . . . . 77.55 110.763 -174.185 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 722' ' ' ILE . . . . . . . . . . . . . 2.6 mp -85.89 116.89 29.68 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 N-CA-C 108.115 -1.069 . . . . 70.82 108.115 178.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 723' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -80.42 -41.27 24.84 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 116.401 -0.363 . . . . 70.79 111.35 176.821 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -158.55 164.4 36.14 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 108.336 -0.987 . . . . 73.29 108.336 179.149 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 725' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -166.8 165.37 16.3 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.53 -0.915 . . . . 60.55 108.53 -176.182 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -122.35 115.17 21.84 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 107.687 -1.227 . . . . 70.1 107.687 174.107 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 727' ' ' LEU . . . . . . . . . . . . . 23.4 mt -109.3 131.21 55.28 Favored 'General case' 0 C--O 1.235 0.301 0 O-C-N 123.336 0.397 . . . . 55.07 110.308 -174.697 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 728' ' ' THR . . . . . . . . . . . . . 63.7 m -95.98 116.29 28.71 Favored 'General case' 0 C--O 1.239 0.5 0 N-CA-C 107.574 -1.269 . . . . 54.93 107.574 166.898 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 40.8 mt -121.85 146.29 47.23 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 123.136 0.574 . . . . 48.09 110.338 -174.201 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 730' ' ' THR . . . . . . . . . . . . . 86.9 m -115.06 124.78 52.45 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 108.358 -0.978 . . . . 50.5 108.358 178.073 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 731' ' ' ILE . . . . . . . . . . . . . 58.4 mt -114.22 126.96 71.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.408 0 N-CA-C 108.171 -1.048 . . . . 58.12 108.171 178.762 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 732' ' ' LEU . . . . . . . . . . . . . . . -112.15 128.97 56.38 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 109.315 -0.624 . . . . 58.87 109.315 -179.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 733' ' ' ARG . . . . . 0.524 ' NH2' ' HB3' ' A' ' 803' ' ' ALA . 0.5 OUTLIER . . . . . 0 C--N 1.331 -0.233 0 CA-C-O 120.796 0.331 . . . . 72.21 111.03 177.348 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 736' ' ' GLY . . . . . 0.765 ' N ' ' O ' ' A' 1001 ' ' HOH . . . . . . . . 0 N--CA 1.451 -0.366 0 N-CA-C 113.573 0.189 . . . . 68.29 113.573 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 737' ' ' GLY . . . . . . . . . . . . . . . -104.14 173.0 21.12 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-O 122.129 0.85 . . . . 69.59 112.47 -177.865 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 738' ' ' LEU . . . . . 0.409 ' O ' ' HG2' ' A' ' 768' ' ' PRO . 81.2 mt -85.66 -30.04 23.52 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 114.83 -0.685 . . . . 73.35 112.71 179.566 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 739' ' ' GLY . . . . . . . . . . . . . . . 92.98 26.0 17.95 Favored Glycine 0 N--CA 1.447 -0.597 0 N-CA-C 114.782 0.673 . . . . 61.06 114.782 -179.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 740' ' ' ILE . . . . . . . . . . . . . 28.2 pt -131.18 155.21 41.71 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.216 0 CA-C-N 118.166 0.983 . . . . 58.9 109.28 179.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 741' ' ' SER . . . . . 0.437 ' HB2' ' HB3' ' A' ' 762' ' ' ARG . 71.6 m -125.64 115.64 20.44 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 107.449 -1.315 . . . . 65.95 107.449 167.724 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 742' ' ' ILE . . . . . . . . . . . . . 40.6 pt -91.15 148.64 4.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 N-CA-C 108.941 -0.763 . . . . 60.53 108.941 179.478 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 743' ' ' ALA . . . . . . . . . . . . . . . -139.5 152.6 47.09 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.324 -0.621 . . . . 57.31 109.324 -179.777 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 744' ' ' GLY . . . . . . . . . . . . . . . 95.88 -153.51 20.62 Favored Glycine 0 N--CA 1.446 -0.647 0 CA-C-N 115.582 -0.735 . . . . 58.38 113.545 177.006 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 745' ' ' GLY . . . . . . . . . . . . . . . 113.33 162.3 14.95 Favored Glycine 0 N--CA 1.446 -0.656 0 CA-C-O 122.225 0.903 . . . . 57.93 111.585 -173.881 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 746' ' ' LYS . . . . . . . . . . . . . 16.2 mmtp -70.65 121.3 17.65 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 114.971 -0.614 . . . . 70.71 109.575 175.803 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 747' ' ' GLY . . . . . . . . . . . . . . . 97.03 4.32 58.74 Favored Glycine 0 N--CA 1.444 -0.787 0 CA-C-O 119.128 -0.818 . . . . 82.7 114.636 -176.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 748' ' ' SER . . . . . . . . . . . . . 45.7 m -121.55 156.14 33.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 118.114 0.957 . . . . 67.73 109.287 178.764 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 4.1 p -57.93 122.59 58.73 Favored Pre-proline 0 C--O 1.242 0.674 0 CA-C-N 115.589 -0.732 . . . . 76.31 109.392 178.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 750' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -62.04 161.37 26.37 Favored 'Trans proline' 0 C--O 1.232 0.224 0 CA-C-O 122.202 0.834 . . . . 74.91 112.702 -170.501 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 751' ' ' TYR . . . . . . . . . . . . . 78.6 t80 -94.77 -39.91 10.03 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 114.875 -1.057 . . . . 71.03 112.779 178.302 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 752' ' ' LYS . . . . . . . . . . . . . 20.7 ttpt -136.19 121.24 18.87 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 108.596 -0.891 . . . . 106.35 108.596 -177.385 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 753' ' ' GLY . . . . . . . . . . . . . . . 58.44 -131.88 52.27 Favored Glycine 0 C--O 1.237 0.293 0 C-N-CA 120.562 -0.828 . . . . 91.71 111.39 176.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -105.44 -0.6 25.85 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 112.389 0.514 . . . . 97.95 112.389 174.253 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 755' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -67.18 115.85 7.32 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 118.267 0.485 . . . . 69.15 109.82 177.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 756' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -91.89 23.71 3.54 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 112.824 0.675 . . . . 71.8 112.824 -179.643 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 757' ' ' GLY . . . . . . . . . . . . . . . -73.0 173.67 47.83 Favored Glycine 0 N--CA 1.449 -0.464 0 CA-C-O 122.734 1.186 . . . . 57.07 112.298 176.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 758' ' ' ILE . . . . . 0.506 HD13 ' HB2' ' A' ' 796' ' ' ALA . 4.3 mt -91.18 124.7 43.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 108.06 -1.089 . . . . 55.01 108.06 176.694 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 759' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -120.89 159.08 26.26 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 121.529 0.681 . . . . 54.85 110.52 -175.698 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 760' ' ' ILE . . . . . . . . . . . . . 43.3 mm -85.53 115.07 26.47 Favored 'Isoleucine or valine' 0 C--O 1.24 0.553 0 N-CA-C 107.687 -1.227 . . . . 56.07 107.687 172.287 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 761' ' ' SER . . . . . . . . . . . . . 14.9 p -101.8 -18.68 15.66 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 113.442 0.904 . . . . 57.2 113.442 -177.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 762' ' ' ARG . . . . . 0.437 ' HB3' ' HB2' ' A' ' 741' ' ' SER . 29.7 tpt180 -154.1 139.09 17.27 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.775 -0.824 . . . . 99.13 108.775 179.103 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 83.9 t -123.79 122.3 64.4 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 N-CA-C 107.784 -1.191 . . . . 64.06 107.784 175.917 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 2.5 m -58.03 142.67 45.99 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.14 0.495 . . . . 64.23 110.439 178.336 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 765' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -63.47 119.18 9.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.76 -0.655 . . . . 76.07 109.872 -178.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 766' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 54.52 24.83 5.64 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 116.104 -0.498 . . . . 71.33 112.216 178.301 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 767' ' ' GLY . . . . . . . . . . . . . . . -75.28 176.55 49.85 Favored Glycine 0 N--CA 1.425 -2.042 0 O-C-N 121.918 -0.489 . . . . 59.14 112.022 174.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 768' ' ' PRO . . . . . 0.409 ' HG2' ' O ' ' A' ' 738' ' ' LEU . 19.1 Cg_endo -57.87 -31.75 93.32 Favored 'Trans proline' 0 C--O 1.237 0.472 0 O-C-N 122.786 0.887 . . . . 55.88 113.647 -179.415 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 769' ' ' ALA . . . . . . . . . . . . . . . -76.1 -35.7 59.21 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 118.769 0.713 . . . . 54.25 111.414 178.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 770' ' ' ALA . . . . . . . . . . . . . . . -66.27 -33.99 77.0 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.49 -0.484 . . . . 57.72 111.376 176.308 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 771' ' ' ARG . . . . . . . . . . . . . 3.4 mpp_? -69.0 -29.87 68.16 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.277 -0.569 . . . . 64.63 111.294 173.974 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 772' ' ' ALA . . . . . 0.514 ' HA ' ' H22' ' A' ' 901' ' ' PEG . . . -72.3 -16.72 61.9 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 112.379 0.511 . . . . 53.49 112.379 178.963 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 101.69 6.0 50.43 Favored Glycine 0 N--CA 1.444 -0.772 0 CA-C-O 119.029 -0.873 . . . . 51.57 114.854 -174.965 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 774' ' ' VAL . . . . . . . . . . . . . 98.7 t -63.41 131.96 29.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 CA-C-N 118.25 1.025 . . . . 52.46 109.328 179.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 775' ' ' ARG . . . . . . . . . . . . . . . -116.65 150.24 38.44 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 109.669 -0.493 . . . . 51.84 109.669 -178.306 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 776' ' ' VAL . . . . . . . . . . . . . 10.4 t -70.54 128.25 33.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 CA-C-N 115.565 -0.743 . . . . 61.62 109.088 -178.525 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 777' ' ' GLY . . . . . . . . . . . . . . . 102.24 -3.07 50.9 Favored Glycine 0 N--CA 1.443 -0.847 0 CA-C-O 119.03 -0.872 . . . . 54.91 114.771 -174.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 778' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -67.19 139.59 57.42 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 118.458 1.129 . . . . 58.39 109.895 177.911 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 779' ' ' LYS . . . . . . . . . . . . . 21.3 tttt -94.14 130.67 40.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.88 -0.6 . . . . 53.89 109.409 178.377 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 780' ' ' LEU . . . . . . . . . . . . . 10.6 mt -78.21 112.86 15.62 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 109.372 -0.603 . . . . 50.35 109.372 178.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 781' ' ' LEU . . . . . . . . . . . . . 83.4 mt -95.94 -26.33 15.62 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.955 0.724 . . . . 55.21 112.955 172.314 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 782' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -163.54 144.21 8.94 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 109.572 -0.529 . . . . 71.78 109.572 -170.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 783' ' ' VAL . . . . . . . . . . . . . 8.8 t -141.81 120.2 9.18 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 N-CA-C 107.879 -1.156 . . . . 57.4 107.879 176.655 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 784' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 50.11 35.44 10.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.351 0.596 . . . . 65.77 111.871 175.734 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 785' ' ' GLY . . . . . . . . . . . . . . . 88.64 -9.34 76.37 Favored Glycine 0 N--CA 1.447 -0.58 0 N-CA-C 115.396 0.918 . . . . 61.8 115.396 -178.43 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 786' ' ' VAL . . . . . . . . . . . . . 80.6 t -87.1 116.89 30.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 118.723 1.261 . . . . 66.75 108.374 177.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . -71.96 117.49 13.63 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 109.672 -0.492 . . . . 60.09 109.672 176.18 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 788' ' ' LEU . . . . . . . . . . . . . 95.4 mt -102.51 23.98 11.1 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 112.425 0.528 . . . . 58.87 112.425 -179.475 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 789' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -82.89 124.33 30.24 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 108.817 -0.809 . . . . 70.07 108.817 177.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 790' ' ' GLY . . . . . . . . . . . . . . . 64.89 39.63 96.66 Favored Glycine 0 C--O 1.237 0.325 0 C-N-CA 120.005 -1.093 . . . . 51.58 112.398 -175.892 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 791' ' ' ALA . . . . . . . . . . . . . . . -110.95 166.1 11.32 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.99 0.9 . . . . 57.58 109.93 -178.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 792' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -86.93 163.73 16.96 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.988 -1.005 . . . . 64.1 110.19 178.931 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 793' ' ' HIS . . . . . . . . . . . . . 47.2 t60 -62.3 -48.04 81.62 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 115.255 -0.884 . . . . 65.54 111.005 -175.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 794' ' ' HIS . . . . . . . . . . . . . 6.6 p-80 -64.62 -18.36 64.84 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 119.968 -0.693 . . . . 68.58 111.607 179.899 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 795' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -70.32 -37.77 74.8 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.856 -0.338 . . . . 93.23 110.922 178.242 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 796' ' ' ALA . . . . . 0.506 ' HB2' HD13 ' A' ' 758' ' ' ILE . . . -80.49 -31.83 37.14 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 112.009 0.374 . . . . 65.12 112.009 178.243 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 797' ' ' VAL . . . . . . . . . . . . . 54.3 t -65.33 -45.71 92.57 Favored 'Isoleucine or valine' 0 C--O 1.236 0.361 0 CA-C-O 121.082 0.468 . . . . 80.72 110.386 179.565 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 798' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -68.1 -26.44 65.82 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 119.75 -0.78 . . . . 79.13 111.202 179.101 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 799' ' ' ALA . . . . . . . . . . . . . . . -76.9 -15.71 59.61 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 112.501 0.556 . . . . 65.66 112.501 175.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 74.0 mt -113.77 -10.03 13.07 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 113.407 0.892 . . . . 67.46 113.407 -179.168 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 801' ' ' ARG . . . . . . . . . . . . . 34.7 ptt180 -81.43 -29.94 33.67 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 119.703 -0.799 . . . . 77.97 112.003 -177.273 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 802' ' ' GLY . . . . . . . . . . . . . . . -59.23 -75.65 0.26 Allowed Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.032 -1.08 . . . . 80.3 111.181 175.618 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 803' ' ' ALA . . . . . 0.524 ' HB3' ' NH2' ' A' ' 733' ' ' ARG . . . 40.32 55.9 2.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 122.306 1.05 . . . . 74.72 111.44 171.011 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 804' ' ' GLY . . . . . . . . . . . . . . . -47.85 -51.99 17.14 Favored Glycine 0 C--N 1.333 0.401 0 CA-C-N 114.721 -1.127 . . . . 94.93 112.414 -179.695 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 805' ' ' THR . . . . . 0.638 HG22 ' HA ' ' B' ' 799' ' ' ALA . 14.3 t -141.33 -31.2 0.59 Allowed 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 114.358 1.244 . . . . 76.22 114.358 176.844 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 806' ' ' ALA . . . . . 0.406 ' HB2' HG21 ' B' ' 786' ' ' VAL . . . -144.16 150.09 37.5 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 119.795 1.18 . . . . 66.82 110.136 -179.991 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 807' ' ' VAL . . . . . . . . . . . . . . . -128.56 137.69 56.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 106.681 -1.6 . . . . 63.82 106.681 172.552 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 808' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -117.04 121.99 42.9 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 107.178 -1.415 . . . . 52.9 107.178 174.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 809' ' ' MET . . . . . . . . . . . . . 2.4 ptm -129.63 134.91 47.95 Favored 'General case' 0 C--O 1.235 0.299 0 O-C-N 123.353 0.408 . . . . 62.2 110.009 -176.194 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 810' ' ' ARG . . . . . . . . . . . . . 38.1 mtp85 -88.67 133.32 34.24 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 108.222 -1.029 . . . . 74.55 108.222 167.358 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 811' ' ' VAL . . . . . . . . . . . . . 31.9 m -128.08 157.98 40.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-O 121.757 0.789 . . . . 50.16 109.39 -176.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 812' ' ' TRP . . . . . . . . . . . . . 62.4 t-105 -112.95 113.04 24.92 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 107.795 -1.187 . . . . 64.47 107.795 175.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 813' ' ' ARG . . . . . . . . . . . . . 35.8 ttm180 -106.83 135.81 47.74 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.448 -0.945 . . . . 62.39 108.448 -179.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 814' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -128.92 108.2 10.23 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 108.477 -0.934 . . . . 71.33 108.477 -177.258 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 815' ' ' ARG . . . . . . . . . . . . . 3.0 mtp85 . . . . . 0 C--N 1.331 -0.21 0 O-C-N 123.36 0.413 . . . . 103.9 110.62 -173.713 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 712' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 -0.151 0 N-CA-C 110.158 -0.312 . . . . 107.1 110.158 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 713' ' ' ASN . . . . . 0.653 ' OD1' ' O ' ' B' 1001 ' ' HOH . 0.7 OUTLIER -96.09 -33.79 11.96 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 113.468 0.914 . . . . 100.02 113.468 -173.333 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 714' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -116.43 47.65 1.39 Allowed 'General case' 0 C--O 1.234 0.272 0 C-N-CA 119.136 -1.026 . . . . 86.51 112.464 -175.08 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 715' ' ' LEU . . . . . . . . . . . . . 7.9 tp -99.92 120.84 40.42 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 106.951 -1.499 . . . . 73.42 106.951 164.566 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 716' ' ' LEU . . . . . . . . . . . . . 31.2 mt -113.71 159.66 19.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.436 0.636 . . . . 73.45 109.914 -176.028 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 717' ' ' ILE . . . . . . . . . . . . . 11.8 pt -130.11 163.99 34.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-O 121.788 0.804 . . . . 50.51 109.605 -177.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 718' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -86.6 132.18 43.37 Favored Pre-proline 0 C--O 1.237 0.426 0 CA-C-N 115.163 -0.926 . . . . 70.08 109.578 173.619 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 719' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_exo -64.03 160.4 37.98 Favored 'Trans proline' 0 C--O 1.233 0.236 0 CA-C-O 121.981 0.742 . . . . 54.1 112.139 -173.879 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 720' ' ' ALA . . . . . . . . . . . . . . . -65.63 122.2 16.71 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 114.962 -1.017 . . . . 56.2 108.918 170.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 721' ' ' ARG . . . . . . . . . . . . . 28.5 ptt85 -127.32 133.54 50.1 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.906 -0.405 . . . . 88.85 109.906 -174.164 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 722' ' ' ILE . . . . . . . . . . . . . 11.8 mt -85.65 122.73 38.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 108.167 -1.049 . . . . 61.18 108.167 178.42 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 723' ' ' GLU . . . . . . . . . . . . . 58.3 mm-40 -80.83 -58.41 3.11 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 120.992 0.425 . . . . 77.73 110.645 175.413 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 724' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -129.16 166.21 19.79 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 107.968 -1.123 . . . . 77.33 107.968 176.927 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 725' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -169.25 149.17 4.08 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 109.352 -0.61 . . . . 71.39 109.352 176.463 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 726' ' ' GLU . . . . . . . . . . . . . 70.8 mt-10 -108.21 133.27 52.7 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.339 -0.846 . . . . 69.35 108.805 171.465 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 727' ' ' LEU . . . . . . . . . . . . . 62.3 mt -120.34 127.65 52.53 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 109.54 -0.541 . . . . 64.18 109.54 -178.56 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 728' ' ' THR . . . . . . . . . . . . . 24.3 m -100.73 114.81 28.9 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 106.789 -1.56 . . . . 74.24 106.789 169.007 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 729' ' ' LEU . . . . . 0.634 ' O ' HD12 ' B' ' 729' ' ' LEU . 1.0 OUTLIER -129.06 133.41 47.68 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.929 -0.767 . . . . 77.18 108.929 -176.791 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 730' ' ' THR . . . . . . . . . . . . . 2.8 m -100.48 131.27 46.49 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 109.085 -0.709 . . . . 70.49 109.085 -179.685 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 731' ' ' ILE . . . . . . . . . . . . . 38.3 mt -115.23 134.64 57.73 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 N-CA-C 108.016 -1.105 . . . . 69.5 108.016 -175.853 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 732' ' ' LEU . . . . . . . . . . . . . . . -92.36 -173.78 3.51 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 121.567 0.699 . . . . 83.34 109.9 179.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 733' ' ' ARG . . . . . . . . . . . . . 10.7 tpp85 . . . . . 0 C--N 1.331 -0.236 0 O-C-N 121.913 -0.492 . . . . 99.56 110.868 -178.997 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 735' ' ' THR . . . . . . . . . . . . . 44.2 m . . . . . 0 C--O 1.233 0.224 0 CA-C-O 120.866 0.365 . . . . 100.12 111.606 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 736' ' ' GLY . . . . . . . . . . . . . . . 84.42 129.67 1.89 Allowed Glycine 0 N--CA 1.449 -0.446 0 CA-C-N 115.897 -0.592 . . . . 83.36 114.553 174.409 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 737' ' ' GLY . . . . . . . . . . . . . . . 76.0 150.21 2.94 Favored Glycine 0 C--N 1.332 0.314 0 N-CA-C 116.356 1.302 . . . . 82.85 116.356 171.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 738' ' ' LEU . . . . . . . . . . . . . . . -109.62 -27.8 9.19 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 113.263 0.838 . . . . 75.23 113.263 175.57 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 739' ' ' GLY . . . . . . . . . . . . . . . 96.49 26.95 10.27 Favored Glycine 0 N--CA 1.442 -0.965 0 N-CA-C 116.308 1.283 . . . . 80.79 116.308 172.908 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 740' ' ' ILE . . . . . 0.516 HG22 HG22 ' B' ' 763' ' ' VAL . 18.7 pt -139.46 168.58 18.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 CA-C-N 118.583 1.191 . . . . 80.58 109.119 -179.662 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 741' ' ' SER . . . . . . . . . . . . . 68.9 m -132.59 126.08 31.95 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 107.389 -1.337 . . . . 75.59 107.389 170.645 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 742' ' ' ILE . . . . . . . . . . . . . 23.4 pt -102.25 142.25 16.91 Favored 'Isoleucine or valine' 0 C--O 1.238 0.489 0 N-CA-C 109.065 -0.717 . . . . 70.96 109.065 -177.535 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 743' ' ' ALA . . . . . . . . . . . . . . . -132.17 172.36 12.5 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 123.479 0.712 . . . . 64.98 109.129 179.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 744' ' ' GLY . . . . . . . . . . . . . . . 84.63 -173.41 49.39 Favored Glycine 0 N--CA 1.443 -0.866 0 CA-C-O 122.433 1.018 . . . . 61.37 112.256 -176.722 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 745' ' ' GLY . . . . . . . . . . . . . . . 140.75 159.94 8.12 Favored Glycine 0 N--CA 1.45 -0.38 0 CA-C-O 122.198 0.888 . . . . 64.95 111.652 179.652 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 746' ' ' LYS . . . . . . . . . . . . . 8.7 tttp -76.44 122.89 25.16 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 109.354 -0.61 . . . . 70.26 109.354 -179.19 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 747' ' ' GLY . . . . . . . . . . . . . . . 80.74 13.03 82.11 Favored Glycine 0 N--CA 1.445 -0.741 0 CA-C-O 119.308 -0.718 . . . . 71.49 114.581 -173.681 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 748' ' ' SER . . . . . . . . . . . . . 5.0 m -111.4 175.69 5.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 118.047 0.924 . . . . 75.31 109.775 179.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 749' ' ' THR . . . . . . . . . . . . . 62.8 m -66.05 124.2 87.15 Favored Pre-proline 0 C--O 1.239 0.501 0 N-CA-C 108.61 -0.885 . . . . 109.76 108.61 172.668 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 750' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -65.1 138.97 58.89 Favored 'Trans proline' 0 C--O 1.233 0.272 0 CA-C-N 119.506 0.859 . . . . 97.44 111.979 -177.137 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 751' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -69.88 -46.77 64.77 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.424 -0.807 . . . . 90.83 110.587 173.979 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 752' ' ' LYS . . . . . . . . . . . . . 5.6 mtmm . . . . . 0 C--N 1.33 -0.243 0 N-CA-C 109.903 -0.406 . . . . 105.15 109.903 175.052 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 755' ' ' ASP . . . . . . . . . . . . . 9.8 t70 . . . . . 0 C--O 1.232 0.18 0 CA-C-O 120.891 0.376 . . . . 85.78 110.375 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 756' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -90.42 16.81 8.14 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.667 0.617 . . . . 90.14 112.667 179.749 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 757' ' ' GLY . . . . . . . . . . . . . . . -62.91 168.08 19.83 Favored Glycine 0 N--CA 1.448 -0.537 0 CA-C-O 122.832 1.24 . . . . 74.63 111.393 178.047 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 758' ' ' ILE . . . . . 0.526 HD13 ' HB2' ' B' ' 796' ' ' ALA . 5.6 mt -92.53 123.66 44.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 N-CA-C 107.977 -1.12 . . . . 61.74 107.977 177.272 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 759' ' ' PHE . . . . . . . . . . . . . 79.3 m-85 -119.53 164.04 16.4 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 121.375 0.607 . . . . 71.33 109.665 179.748 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 760' ' ' ILE . . . . . . . . . . . . . 18.3 mm -89.35 104.62 15.17 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 N-CA-C 106.26 -1.756 . . . . 69.16 106.26 173.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 761' ' ' SER . . . . . . . . . . . . . 89.5 p -75.54 -27.03 58.52 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 112.225 0.454 . . . . 71.06 112.225 -177.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 762' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -157.23 157.51 34.45 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 108.717 -0.845 . . . . 95.86 108.717 -179.85 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 763' ' ' VAL . . . . . 0.516 HG22 HG22 ' B' ' 740' ' ' ILE . 73.3 t -133.6 127.78 53.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.39 0 N-CA-C 108.382 -0.97 . . . . 83.4 108.382 176.481 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 7.4 m -58.47 139.87 54.88 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.164 0.507 . . . . 85.75 109.919 176.667 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 765' ' ' GLU . . . . . 0.408 ' OE1' ' N ' ' B' ' 765' ' ' GLU . 3.1 mp0 -52.61 -46.73 67.12 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.748 -0.66 . . . . 102.95 111.487 -171.216 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 766' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -135.08 83.18 2.0 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 107.336 -1.357 . . . . 118.28 107.336 179.419 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 767' ' ' GLY . . . . . . . . . . . . . . . -128.44 174.58 18.86 Favored Glycine 0 N--CA 1.443 -0.898 0 N-CA-C 111.065 -0.814 . . . . 93.1 111.065 175.611 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 768' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.41 -36.02 98.02 Favored 'Trans proline' 0 C--O 1.236 0.409 0 CA-C-N 117.017 0.409 . . . . 75.14 113.125 -179.07 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 769' ' ' ALA . . . . . . . . . . . . . . . -70.84 -32.48 69.53 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.26 -0.576 . . . . 68.89 111.532 178.542 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 770' ' ' ALA . . . . . . . . . . . . . . . -66.2 -35.28 80.04 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.109 -0.637 . . . . 78.17 111.082 173.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 771' ' ' ARG . . . . . . . . . . . . . . . -68.56 -33.83 74.77 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.653 -0.419 . . . . 89.07 111.461 177.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 772' ' ' ALA . . . . . . . . . . . . . . . -75.75 -22.29 56.63 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 112.495 0.554 . . . . 72.46 112.495 178.581 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 773' ' ' GLY . . . . . . . . . . . . . . . 110.46 19.06 8.12 Favored Glycine 0 N--CA 1.442 -0.966 0 N-CA-C 116.542 1.377 . . . . 73.72 116.542 177.594 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 774' ' ' VAL . . . . . . . . . . . . . 39.2 t -71.25 133.66 31.42 Favored 'Isoleucine or valine' 0 C--O 1.238 0.495 0 CA-C-N 118.854 1.327 . . . . 66.84 109.096 178.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 775' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -112.94 152.19 29.64 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 123.063 0.545 . . . . 80.76 109.873 -179.702 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 776' ' ' VAL . . . . . . . . . . . . . 73.8 t -67.46 129.08 31.74 Favored 'Isoleucine or valine' 0 C--O 1.239 0.534 0 N-CA-C 109.089 -0.708 . . . . 74.44 109.089 175.49 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 777' ' ' GLY . . . . . . . . . . . . . . . 103.18 -13.02 55.5 Favored Glycine 0 N--CA 1.446 -0.698 0 CA-C-O 119.196 -0.78 . . . . 66.15 114.494 -177.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 778' ' ' ASP . . . . . 0.452 ' HB3' ' HB ' ' B' ' 811' ' ' VAL . 84.8 m-20 -60.35 130.22 45.56 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 118.005 0.903 . . . . 64.99 109.928 177.707 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 779' ' ' LYS . . . . . 0.447 ' HB3' ' HB3' ' B' ' 812' ' ' TRP . 84.3 tttt -81.7 126.16 31.46 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.19 -0.671 . . . . 76.08 109.19 175.035 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 780' ' ' LEU . . . . . 0.404 HD13 ' HE1' ' B' ' 809' ' ' MET . 12.7 tp -78.87 116.59 19.29 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 109.145 -0.687 . . . . 62.51 109.145 -179.566 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 781' ' ' LEU . . . . . 0.448 HD11 ' HB2' ' B' ' 812' ' ' TRP . 95.0 mt -98.37 -47.32 5.46 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 112.643 0.608 . . . . 68.0 112.643 -177.851 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 782' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -144.62 152.32 40.31 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.276 0.56 . . . . 67.7 109.794 -174.732 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 783' ' ' VAL . . . . . . . . . . . . . 49.3 t -136.61 119.01 20.49 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 N-CA-C 107.259 -1.386 . . . . 60.22 107.259 173.404 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 784' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 51.73 39.21 24.9 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 121.5 0.667 . . . . 57.17 111.414 179.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 785' ' ' GLY . . . . . . . . . . . . . . . 85.45 -6.48 79.92 Favored Glycine 0 N--CA 1.445 -0.747 0 N-CA-C 115.744 1.058 . . . . 47.5 115.744 177.441 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 786' ' ' VAL . . . . . 0.406 HG21 ' HB2' ' A' ' 806' ' ' ALA . 3.3 t -97.91 119.87 46.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 CA-C-N 118.762 1.281 . . . . 66.53 108.647 179.146 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 787' ' ' ALA . . . . . . . . . . . . . . . -72.6 136.85 45.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.304 0.574 . . . . 53.51 110.604 -179.394 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 788' ' ' LEU . . . . . . . . . . . . . 83.9 mt -113.86 18.01 17.62 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.657 -0.701 . . . . 58.62 111.762 178.416 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 789' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -66.62 -29.64 69.72 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.625 -0.43 . . . . 82.88 111.792 -173.341 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 790' ' ' GLY . . . . . . . . . . . . . . . -123.4 30.99 4.79 Favored Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 111.851 -0.5 . . . . 71.1 111.851 176.824 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 791' ' ' ALA . . . . . . . . . . . . . . . -95.18 153.66 17.56 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.506 0.67 . . . . 63.03 110.909 -174.214 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 792' ' ' GLU . . . . . . . . . . . . . 88.4 mt-10 -74.41 165.29 25.44 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 122.06 0.933 . . . . 62.72 109.904 174.97 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 793' ' ' HIS . . . . . . . . . . . . . 22.8 t60 -62.66 -45.38 93.05 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 115.461 -0.79 . . . . 62.9 110.979 -175.299 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 794' ' ' HIS . . . . . . . . . . . . . 6.0 p80 -65.37 -22.45 66.8 Favored 'General case' 0 C--O 1.235 0.31 0 O-C-N 121.91 -0.494 . . . . 57.47 112.316 -179.646 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 795' ' ' GLU . . . . . . . . . . . . . 87.6 mt-10 -74.73 -33.85 62.44 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.374 -0.53 . . . . 72.58 111.384 178.231 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 796' ' ' ALA . . . . . 0.526 ' HB2' HD13 ' B' ' 758' ' ' ILE . . . -71.32 -38.76 71.7 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.159 -0.616 . . . . 61.04 110.856 174.189 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 797' ' ' VAL . . . . . . . . . . . . . 69.8 t -60.77 -49.84 82.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 C-N-CA 120.425 -0.51 . . . . 61.62 110.043 177.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 798' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -57.55 -23.89 53.05 Favored 'General case' 0 C--O 1.238 0.478 0 O-C-N 121.9 -0.5 . . . . 74.14 112.014 175.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 799' ' ' ALA . . . . . 0.638 ' HA ' HG22 ' A' ' 805' ' ' THR . . . -75.92 -46.65 28.85 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 120.547 -0.461 . . . . 65.57 111.057 178.045 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 800' ' ' LEU . . . . . . . . . . . . . 96.8 mt -83.51 -40.97 18.5 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 111.936 0.347 . . . . 67.6 111.936 -177.688 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 801' ' ' ARG . . . . . . . . . . . . . 26.2 ttp180 . . . . . 0 C--N 1.33 -0.261 0 O-C-N 121.794 -0.566 . . . . 97.37 109.649 174.088 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 804' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.365 0 N-CA-C 112.034 -0.427 . . . . 89.78 112.034 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 805' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.72 -35.59 57.74 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 119.611 -0.836 . . . . 75.57 112.118 -175.07 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 806' ' ' ALA . . . . . . . . . . . . . . . -143.26 155.37 44.47 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.869 0.843 . . . . 71.76 109.896 -178.128 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 807' ' ' VAL . . . . . . . . . . . . . . . -140.43 133.3 33.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 N-CA-C 107.144 -1.428 . . . . 62.86 107.144 173.789 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 808' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -114.05 129.98 56.58 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.488 -0.93 . . . . 63.22 108.488 176.063 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 809' ' ' MET . . . . . 0.404 ' HE1' HD13 ' B' ' 780' ' ' LEU . 0.1 OUTLIER -117.55 152.26 35.46 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.001 -0.74 . . . . 65.75 109.001 -179.278 . . . . . . . . 3 3 . 1 . 001 ecloud build full ' B' B ' 810' ' ' ARG . . . . . . . . . . . . . 58.0 mtt85 -103.96 125.5 50.39 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.873 -1.158 . . . . 81.57 107.873 165.707 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 811' ' ' VAL . . . . . 0.452 ' HB ' ' HB3' ' B' ' 778' ' ' ASP . 22.4 m -117.12 155.97 18.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 121.807 0.813 . . . . 56.85 108.98 179.999 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 812' ' ' TRP . . . . . 0.448 ' HB2' HD11 ' B' ' 781' ' ' LEU . 72.6 t-105 -118.37 123.19 44.67 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 107.508 -1.293 . . . . 70.05 107.508 179.681 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 813' ' ' ARG . . . . . . . . . . . . . 36.4 ttm180 -122.86 134.49 54.39 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.729 -0.841 . . . . 70.98 108.729 -174.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 814' ' ' GLU . . . . . 0.405 ' O ' ' C ' ' B' ' 815' ' ' ARG . 45.8 mt-10 -128.33 92.53 3.46 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 108.173 -1.047 . . . . 80.75 108.173 -179.874 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 815' ' ' ARG . . . . . 0.405 ' C ' ' O ' ' B' ' 814' ' ' GLU . 5.6 ptp180 . . . . . 0 C--O 1.231 0.118 0 N-CA-C 114.762 1.393 . . . . 90.05 114.762 179.003 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 823' ' ' HIS . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 -0.321 0 N-CA-C 109.36 -0.607 . . . . 98.36 109.36 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' D' D ' 824' ' ' THR . . . . . . . . . . . . . . . -145.55 60.24 1.27 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 122.143 0.973 . . . . 92.13 111.186 -175.484 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 825' ' ' ASN . . . . . . . . . . . . . 34.6 t-20 55.67 73.63 0.42 Allowed 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 122.095 0.95 . . . . 78.17 112.233 164.122 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 826' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -104.91 143.14 33.56 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 114.768 -1.106 . . . . 78.08 108.883 167.007 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 827' ' ' THR . . . . . . . . . . . . . 44.0 m -125.07 128.67 48.84 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 108.834 -0.802 . . . . 67.99 108.834 178.797 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 828' ' ' SER . . . . . . . . . . . . . 45.8 t -84.19 140.94 31.39 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.099 0.476 . . . . 71.85 110.937 -177.188 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' D' D ' 829' ' ' LEU . . . . . . . . . . . . . 6.2 mt . . . . . 0 C--N 1.331 -0.226 0 CA-C-N 115.874 -0.603 . . . . 67.55 112.274 -177.234 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 825' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.812 0.339 . . . . 98.66 110.398 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 826' ' ' GLU . . . . . . . . . . . . . 15.2 mp0 -61.44 147.99 43.29 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.686 0.755 . . . . 89.99 111.015 -174.23 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 827' ' ' THR . . . . . . . . . . . . . 17.1 m -124.89 125.54 44.12 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 108.294 -1.002 . . . . 73.54 108.294 174.885 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 828' ' ' SER . . . . . . . . . . . . . 63.7 m -99.58 151.38 21.23 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.44 0.638 . . . . 79.13 111.287 -173.134 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' E' E ' 829' ' ' LEU . . . . . . . . . . . . . 28.0 mt . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 115.25 -0.886 . . . . 79.0 110.689 178.551 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 901' ' ' PEG . . . . . 0.514 ' H22' ' HA ' ' A' ' 772' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 902' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 903' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 901' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' E' E ' 901' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1001 ' ' HOH . . . . . 0.765 ' O ' ' N ' ' A' ' 736' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A 1002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A 1005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1001 ' ' HOH . . . . . 0.653 ' O ' ' OD1' ' B' ' 713' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B 1002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B 1008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 80.2 mt . . . . . 0 C--O 1.233 0.21 0 N-CA-C 109.58 -0.526 . . . . 104.8 109.58 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 717' ' ' ILE . . . . . . . . . . . . . . . -151.2 156.11 6.53 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.164 0 CA-C-O 121.745 0.783 . . . . 90.67 109.587 -167.831 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 718' ' ' GLU . . . . . 0.637 ' OE2' ' NH1' ' A' ' 721' ' ' ARG . 56.8 mt-10 -65.29 143.2 98.71 Favored Pre-proline 0 N--CA 1.453 -0.3 0 CA-C-N 115.476 -0.784 . . . . 99.65 109.749 174.721 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 719' ' ' PRO . . . . . . . . . . . . . 12.3 Cg_exo -72.94 -174.59 1.59 Allowed 'Trans proline' 0 CA--C 1.511 -0.655 0 O-C-N 121.855 0.397 . . . . 108.91 112.571 177.361 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 720' ' ' ALA . . . . . . . . . . . . . . . -78.33 126.6 31.02 Favored 'General case' 0 C--N 1.325 -0.458 0 N-CA-C 109.072 -0.714 . . . . 78.64 109.072 170.946 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 721' ' ' ARG . . . . . 0.637 ' NH1' ' OE2' ' A' ' 718' ' ' GLU . 24.4 ptt-85 -134.29 150.71 51.01 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 121.475 0.655 . . . . 77.55 110.763 -174.185 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 722' ' ' ILE . . . . . . . . . . . . . 2.6 mp -85.89 116.89 29.68 Favored 'Isoleucine or valine' 0 C--O 1.236 0.363 0 N-CA-C 108.115 -1.069 . . . . 70.82 108.115 178.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 723' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -80.42 -41.27 24.84 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 116.401 -0.363 . . . . 70.79 111.35 176.821 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 724' ' ' GLU . . . . . . . . . . . . . 3.3 pt-20 -158.55 164.4 36.14 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 108.336 -0.987 . . . . 73.29 108.336 179.149 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 725' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -166.8 165.37 16.3 Favored 'General case' 0 C--N 1.328 -0.346 0 N-CA-C 108.53 -0.915 . . . . 60.55 108.53 -176.182 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 726' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -122.35 115.17 21.84 Favored 'General case' 0 C--O 1.236 0.353 0 N-CA-C 107.687 -1.227 . . . . 70.1 107.687 174.107 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 727' ' ' LEU . . . . . . . . . . . . . 23.4 mt -109.3 131.21 55.28 Favored 'General case' 0 C--O 1.235 0.301 0 O-C-N 123.336 0.397 . . . . 55.07 110.308 -174.697 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 728' ' ' THR . . . . . . . . . . . . . 63.7 m -95.98 116.29 28.71 Favored 'General case' 0 C--O 1.239 0.5 0 N-CA-C 107.574 -1.269 . . . . 54.93 107.574 166.898 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 729' ' ' LEU . . . . . . . . . . . . . 40.8 mt -121.85 146.29 47.23 Favored 'General case' 0 C--O 1.234 0.241 0 C-N-CA 123.136 0.574 . . . . 48.09 110.338 -174.201 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 730' ' ' THR . . . . . . . . . . . . . 86.9 m -115.06 124.78 52.45 Favored 'General case' 0 C--O 1.235 0.301 0 N-CA-C 108.358 -0.978 . . . . 50.5 108.358 178.073 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 731' ' ' ILE . . . . . . . . . . . . . 58.4 mt -114.22 126.96 71.85 Favored 'Isoleucine or valine' 0 C--O 1.237 0.408 0 N-CA-C 108.171 -1.048 . . . . 58.12 108.171 178.762 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 732' ' ' LEU . . . . . . . . . . . . . . . -112.15 128.97 56.38 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 109.315 -0.624 . . . . 58.87 109.315 -179.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 733' ' ' ARG . . . . . 0.524 ' NH2' ' HB3' ' A' ' 803' ' ' ALA . 0.5 OUTLIER . . . . . 0 C--N 1.331 -0.233 0 CA-C-O 120.796 0.331 . . . . 72.21 111.03 177.348 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 736' ' ' GLY . . . . . 0.765 ' N ' ' O ' ' A' 1001 ' ' HOH . . . . . . . . 0 N--CA 1.451 -0.366 0 N-CA-C 113.573 0.189 . . . . 68.29 113.573 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 737' ' ' GLY . . . . . . . . . . . . . . . -104.14 173.0 21.12 Favored Glycine 0 N--CA 1.446 -0.694 0 CA-C-O 122.129 0.85 . . . . 69.59 112.47 -177.865 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 738' ' ' LEU . . . . . 0.409 ' O ' ' HG2' ' A' ' 768' ' ' PRO . 81.2 mt -85.66 -30.04 23.52 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 114.83 -0.685 . . . . 73.35 112.71 179.566 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 739' ' ' GLY . . . . . . . . . . . . . . . 92.98 26.0 17.95 Favored Glycine 0 N--CA 1.447 -0.597 0 N-CA-C 114.782 0.673 . . . . 61.06 114.782 -179.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 740' ' ' ILE . . . . . . . . . . . . . 28.2 pt -131.18 155.21 41.71 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.216 0 CA-C-N 118.166 0.983 . . . . 58.9 109.28 179.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 741' ' ' SER . . . . . 0.437 ' HB2' ' HB3' ' A' ' 762' ' ' ARG . 71.6 m -125.64 115.64 20.44 Favored 'General case' 0 C--O 1.236 0.377 0 N-CA-C 107.449 -1.315 . . . . 65.95 107.449 167.724 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 742' ' ' ILE . . . . . . . . . . . . . 40.6 pt -91.15 148.64 4.45 Favored 'Isoleucine or valine' 0 C--N 1.318 -0.781 0 N-CA-C 108.941 -0.763 . . . . 60.53 108.941 179.478 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 743' ' ' ALA . . . . . . . . . . . . . . . -139.5 152.6 47.09 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.324 -0.621 . . . . 57.31 109.324 -179.777 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 744' ' ' GLY . . . . . . . . . . . . . . . 95.88 -153.51 20.62 Favored Glycine 0 N--CA 1.446 -0.647 0 CA-C-N 115.582 -0.735 . . . . 58.38 113.545 177.006 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 745' ' ' GLY . . . . . . . . . . . . . . . 113.33 162.3 14.95 Favored Glycine 0 N--CA 1.446 -0.656 0 CA-C-O 122.225 0.903 . . . . 57.93 111.585 -173.881 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 746' ' ' LYS . . . . . . . . . . . . . 16.2 mmtp -70.65 121.3 17.65 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 114.971 -0.614 . . . . 70.71 109.575 175.803 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 747' ' ' GLY . . . . . . . . . . . . . . . 97.03 4.32 58.74 Favored Glycine 0 N--CA 1.444 -0.787 0 CA-C-O 119.128 -0.818 . . . . 82.7 114.636 -176.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 748' ' ' SER . . . . . . . . . . . . . 45.7 m -121.55 156.14 33.51 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 118.114 0.957 . . . . 67.73 109.287 178.764 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 749' ' ' THR . . . . . . . . . . . . . 4.1 p -57.93 122.59 58.73 Favored Pre-proline 0 C--O 1.242 0.674 0 CA-C-N 115.589 -0.732 . . . . 76.31 109.392 178.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 750' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_exo -62.04 161.37 26.37 Favored 'Trans proline' 0 C--O 1.232 0.224 0 CA-C-O 122.202 0.834 . . . . 74.91 112.702 -170.501 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 751' ' ' TYR . . . . . . . . . . . . . 78.6 t80 -94.77 -39.91 10.03 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 114.875 -1.057 . . . . 71.03 112.779 178.302 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 752' ' ' LYS . . . . . . . . . . . . . 20.7 ttpt -136.19 121.24 18.87 Favored 'General case' 0 C--O 1.236 0.358 0 N-CA-C 108.596 -0.891 . . . . 106.35 108.596 -177.385 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 753' ' ' GLY . . . . . . . . . . . . . . . 58.44 -131.88 52.27 Favored Glycine 0 C--O 1.237 0.293 0 C-N-CA 120.562 -0.828 . . . . 91.71 111.39 176.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 754' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -105.44 -0.6 25.85 Favored 'General case' 0 C--O 1.236 0.36 0 N-CA-C 112.389 0.514 . . . . 97.95 112.389 174.253 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 755' ' ' ASP . . . . . . . . . . . . . 64.7 t0 -67.18 115.85 7.32 Favored 'General case' 0 C--O 1.236 0.379 0 CA-C-N 118.267 0.485 . . . . 69.15 109.82 177.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 756' ' ' GLU . . . . . . . . . . . . . 37.2 mt-10 -91.89 23.71 3.54 Favored 'General case' 0 N--CA 1.453 -0.304 0 N-CA-C 112.824 0.675 . . . . 71.8 112.824 -179.643 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 757' ' ' GLY . . . . . . . . . . . . . . . -73.0 173.67 47.83 Favored Glycine 0 N--CA 1.449 -0.464 0 CA-C-O 122.734 1.186 . . . . 57.07 112.298 176.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 758' ' ' ILE . . . . . 0.506 HD13 ' HB2' ' A' ' 796' ' ' ALA . 4.3 mt -91.18 124.7 43.83 Favored 'Isoleucine or valine' 0 C--O 1.236 0.388 0 N-CA-C 108.06 -1.089 . . . . 55.01 108.06 176.694 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 759' ' ' PHE . . . . . . . . . . . . . 83.4 m-85 -120.89 159.08 26.26 Favored 'General case' 0 N--CA 1.453 -0.299 0 CA-C-O 121.529 0.681 . . . . 54.85 110.52 -175.698 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 760' ' ' ILE . . . . . . . . . . . . . 43.3 mm -85.53 115.07 26.47 Favored 'Isoleucine or valine' 0 C--O 1.24 0.553 0 N-CA-C 107.687 -1.227 . . . . 56.07 107.687 172.287 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 761' ' ' SER . . . . . . . . . . . . . 14.9 p -101.8 -18.68 15.66 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 113.442 0.904 . . . . 57.2 113.442 -177.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 762' ' ' ARG . . . . . 0.437 ' HB3' ' HB2' ' A' ' 741' ' ' SER . 29.7 tpt180 -154.1 139.09 17.27 Favored 'General case' 0 C--N 1.329 -0.283 0 N-CA-C 108.775 -0.824 . . . . 99.13 108.775 179.103 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 763' ' ' VAL . . . . . . . . . . . . . 83.9 t -123.79 122.3 64.4 Favored 'Isoleucine or valine' 0 C--O 1.238 0.486 0 N-CA-C 107.784 -1.191 . . . . 64.06 107.784 175.917 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 764' ' ' SER . . . . . . . . . . . . . 2.5 m -58.03 142.67 45.99 Favored 'General case' 0 C--O 1.235 0.299 0 CA-C-O 121.14 0.495 . . . . 64.23 110.439 178.336 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 765' ' ' GLU . . . . . . . . . . . . . 57.0 mt-10 -63.47 119.18 9.28 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 115.76 -0.655 . . . . 76.07 109.872 -178.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 766' ' ' GLU . . . . . . . . . . . . . 74.6 mm-40 54.52 24.83 5.64 Favored 'General case' 0 C--O 1.236 0.371 0 CA-C-N 116.104 -0.498 . . . . 71.33 112.216 178.301 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 767' ' ' GLY . . . . . . . . . . . . . . . -75.28 176.55 49.85 Favored Glycine 0 N--CA 1.425 -2.042 0 O-C-N 121.918 -0.489 . . . . 59.14 112.022 174.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 768' ' ' PRO . . . . . 0.409 ' HG2' ' O ' ' A' ' 738' ' ' LEU . 19.1 Cg_endo -57.87 -31.75 93.32 Favored 'Trans proline' 0 C--O 1.237 0.472 0 O-C-N 122.786 0.887 . . . . 55.88 113.647 -179.415 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 769' ' ' ALA . . . . . . . . . . . . . . . -76.1 -35.7 59.21 Favored 'General case' 0 C--O 1.236 0.346 0 CA-C-N 118.769 0.713 . . . . 54.25 111.414 178.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 770' ' ' ALA . . . . . . . . . . . . . . . -66.27 -33.99 77.0 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.49 -0.484 . . . . 57.72 111.376 176.308 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 771' ' ' ARG . . . . . . . . . . . . . 3.4 mpp_? -69.0 -29.87 68.16 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.277 -0.569 . . . . 64.63 111.294 173.974 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 772' ' ' ALA . . . . . 0.514 ' HA ' ' H22' ' A' ' 901' ' ' PEG . . . -72.3 -16.72 61.9 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 112.379 0.511 . . . . 53.49 112.379 178.963 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 773' ' ' GLY . . . . . . . . . . . . . . . 101.69 6.0 50.43 Favored Glycine 0 N--CA 1.444 -0.772 0 CA-C-O 119.029 -0.873 . . . . 51.57 114.854 -174.965 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 774' ' ' VAL . . . . . . . . . . . . . 98.7 t -63.41 131.96 29.11 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 CA-C-N 118.25 1.025 . . . . 52.46 109.328 179.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 775' ' ' ARG . . . . . . . . . . . . . . . -116.65 150.24 38.44 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 109.669 -0.493 . . . . 51.84 109.669 -178.306 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 776' ' ' VAL . . . . . . . . . . . . . 10.4 t -70.54 128.25 33.55 Favored 'Isoleucine or valine' 0 C--O 1.237 0.44 0 CA-C-N 115.565 -0.743 . . . . 61.62 109.088 -178.525 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 777' ' ' GLY . . . . . . . . . . . . . . . 102.24 -3.07 50.9 Favored Glycine 0 N--CA 1.443 -0.847 0 CA-C-O 119.03 -0.872 . . . . 54.91 114.771 -174.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 778' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -67.19 139.59 57.42 Favored 'General case' 0 C--O 1.234 0.273 0 CA-C-N 118.458 1.129 . . . . 58.39 109.895 177.911 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 779' ' ' LYS . . . . . . . . . . . . . 21.3 tttt -94.14 130.67 40.25 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 115.88 -0.6 . . . . 53.89 109.409 178.377 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 780' ' ' LEU . . . . . . . . . . . . . 10.6 mt -78.21 112.86 15.62 Favored 'General case' 0 C--O 1.238 0.454 0 N-CA-C 109.372 -0.603 . . . . 50.35 109.372 178.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 781' ' ' LEU . . . . . . . . . . . . . 83.4 mt -95.94 -26.33 15.62 Favored 'General case' 0 C--N 1.33 -0.256 0 N-CA-C 112.955 0.724 . . . . 55.21 112.955 172.314 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 782' ' ' GLU . . . . . . . . . . . . . 11.2 tt0 -163.54 144.21 8.94 Favored 'General case' 0 C--O 1.236 0.392 0 N-CA-C 109.572 -0.529 . . . . 71.78 109.572 -170.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 783' ' ' VAL . . . . . . . . . . . . . 8.8 t -141.81 120.2 9.18 Favored 'Isoleucine or valine' 0 C--O 1.236 0.346 0 N-CA-C 107.879 -1.156 . . . . 57.4 107.879 176.655 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 784' ' ' ASN . . . . . . . . . . . . . 90.2 m-20 50.11 35.44 10.09 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 121.351 0.596 . . . . 65.77 111.871 175.734 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 785' ' ' GLY . . . . . . . . . . . . . . . 88.64 -9.34 76.37 Favored Glycine 0 N--CA 1.447 -0.58 0 N-CA-C 115.396 0.918 . . . . 61.8 115.396 -178.43 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 786' ' ' VAL . . . . . . . . . . . . . 80.6 t -87.1 116.89 30.24 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.38 0 CA-C-N 118.723 1.261 . . . . 66.75 108.374 177.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 787' ' ' ALA . . . . . . . . . . . . . . . -71.96 117.49 13.63 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 109.672 -0.492 . . . . 60.09 109.672 176.18 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 788' ' ' LEU . . . . . . . . . . . . . 95.4 mt -102.51 23.98 11.1 Favored 'General case' 0 C--O 1.236 0.393 0 N-CA-C 112.425 0.528 . . . . 58.87 112.425 -179.475 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 789' ' ' GLN . . . . . . . . . . . . . 5.0 mt-30 -82.89 124.33 30.24 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 108.817 -0.809 . . . . 70.07 108.817 177.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 790' ' ' GLY . . . . . . . . . . . . . . . 64.89 39.63 96.66 Favored Glycine 0 C--O 1.237 0.325 0 C-N-CA 120.005 -1.093 . . . . 51.58 112.398 -175.892 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 791' ' ' ALA . . . . . . . . . . . . . . . -110.95 166.1 11.32 Favored 'General case' 0 C--N 1.326 -0.418 0 CA-C-O 121.99 0.9 . . . . 57.58 109.93 -178.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 792' ' ' GLU . . . . . . . . . . . . . 92.0 mt-10 -86.93 163.73 16.96 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 114.988 -1.005 . . . . 64.1 110.19 178.931 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 793' ' ' HIS . . . . . . . . . . . . . 47.2 t60 -62.3 -48.04 81.62 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 115.255 -0.884 . . . . 65.54 111.005 -175.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 794' ' ' HIS . . . . . . . . . . . . . 6.6 p-80 -64.62 -18.36 64.84 Favored 'General case' 0 C--O 1.235 0.321 0 C-N-CA 119.968 -0.693 . . . . 68.58 111.607 179.899 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 795' ' ' GLU . . . . . . . . . . . . . 3.4 tt0 -70.32 -37.77 74.8 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.856 -0.338 . . . . 93.23 110.922 178.242 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 796' ' ' ALA . . . . . 0.506 ' HB2' HD13 ' A' ' 758' ' ' ILE . . . -80.49 -31.83 37.14 Favored 'General case' 0 C--O 1.237 0.397 0 N-CA-C 112.009 0.374 . . . . 65.12 112.009 178.243 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 797' ' ' VAL . . . . . . . . . . . . . 54.3 t -65.33 -45.71 92.57 Favored 'Isoleucine or valine' 0 C--O 1.236 0.361 0 CA-C-O 121.082 0.468 . . . . 80.72 110.386 179.565 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 798' ' ' GLU . . . . . . . . . . . . . 21.1 pt-20 -68.1 -26.44 65.82 Favored 'General case' 0 C--O 1.236 0.363 0 C-N-CA 119.75 -0.78 . . . . 79.13 111.202 179.101 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 799' ' ' ALA . . . . . . . . . . . . . . . -76.9 -15.71 59.61 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 112.501 0.556 . . . . 65.66 112.501 175.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 800' ' ' LEU . . . . . . . . . . . . . 74.0 mt -113.77 -10.03 13.07 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 113.407 0.892 . . . . 67.46 113.407 -179.168 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 801' ' ' ARG . . . . . . . . . . . . . 34.7 ptt180 -81.43 -29.94 33.67 Favored 'General case' 0 C--O 1.236 0.386 0 C-N-CA 119.703 -0.799 . . . . 77.97 112.003 -177.273 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 802' ' ' GLY . . . . . . . . . . . . . . . -59.23 -75.65 0.26 Allowed Glycine 0 N--CA 1.449 -0.458 0 C-N-CA 120.032 -1.08 . . . . 80.3 111.181 175.618 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 803' ' ' ALA . . . . . 0.524 ' HB3' ' NH2' ' A' ' 733' ' ' ARG . . . 40.32 55.9 2.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 122.306 1.05 . . . . 74.72 111.44 171.011 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 804' ' ' GLY . . . . . . . . . . . . . . . -47.85 -51.99 17.14 Favored Glycine 0 C--N 1.333 0.401 0 CA-C-N 114.721 -1.127 . . . . 94.93 112.414 -179.695 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 805' ' ' THR . . . . . 0.638 HG22 ' HA ' ' B' ' 799' ' ' ALA . 14.3 t -141.33 -31.2 0.59 Allowed 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 114.358 1.244 . . . . 76.22 114.358 176.844 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 806' ' ' ALA . . . . . 0.406 ' HB2' HG21 ' B' ' 786' ' ' VAL . . . -144.16 150.09 37.5 Favored 'General case' 0 N--CA 1.45 -0.472 0 CA-C-N 119.795 1.18 . . . . 66.82 110.136 -179.991 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 807' ' ' VAL . . . . . . . . . . . . . . . -128.56 137.69 56.64 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.432 0 N-CA-C 106.681 -1.6 . . . . 63.82 106.681 172.552 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 808' ' ' GLN . . . . . . . . . . . . . 34.2 tt0 -117.04 121.99 42.9 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 107.178 -1.415 . . . . 52.9 107.178 174.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 809' ' ' MET . . . . . . . . . . . . . 2.4 ptm -129.63 134.91 47.95 Favored 'General case' 0 C--O 1.235 0.299 0 O-C-N 123.353 0.408 . . . . 62.2 110.009 -176.194 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 810' ' ' ARG . . . . . . . . . . . . . 38.1 mtp85 -88.67 133.32 34.24 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 108.222 -1.029 . . . . 74.55 108.222 167.358 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 811' ' ' VAL . . . . . . . . . . . . . 31.9 m -128.08 157.98 40.09 Favored 'Isoleucine or valine' 0 C--O 1.233 0.208 0 CA-C-O 121.757 0.789 . . . . 50.16 109.39 -176.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 812' ' ' TRP . . . . . . . . . . . . . 62.4 t-105 -112.95 113.04 24.92 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 107.795 -1.187 . . . . 64.47 107.795 175.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 813' ' ' ARG . . . . . . . . . . . . . 35.8 ttm180 -106.83 135.81 47.74 Favored 'General case' 0 C--N 1.327 -0.404 0 N-CA-C 108.448 -0.945 . . . . 62.39 108.448 -179.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 814' ' ' GLU . . . . . . . . . . . . . 3.4 mt-10 -128.92 108.2 10.23 Favored 'General case' 0 C--O 1.235 0.312 0 N-CA-C 108.477 -0.934 . . . . 71.33 108.477 -177.258 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 815' ' ' ARG . . . . . . . . . . . . . 3.0 mtp85 . . . . . 0 C--N 1.331 -0.21 0 O-C-N 123.36 0.413 . . . . 103.9 110.62 -173.713 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 712' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.521 -0.151 0 N-CA-C 110.158 -0.312 . . . . 107.1 110.158 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 713' ' ' ASN . . . . . 0.653 ' OD1' ' O ' ' B' 1001 ' ' HOH . 0.7 OUTLIER -96.09 -33.79 11.96 Favored 'General case' 0 C--N 1.329 -0.31 0 N-CA-C 113.468 0.914 . . . . 100.02 113.468 -173.333 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 714' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -116.43 47.65 1.39 Allowed 'General case' 0 C--O 1.234 0.272 0 C-N-CA 119.136 -1.026 . . . . 86.51 112.464 -175.08 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 715' ' ' LEU . . . . . . . . . . . . . 7.9 tp -99.92 120.84 40.42 Favored 'General case' 0 C--O 1.237 0.429 0 N-CA-C 106.951 -1.499 . . . . 73.42 106.951 164.566 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 716' ' ' LEU . . . . . . . . . . . . . 31.2 mt -113.71 159.66 19.48 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-O 121.436 0.636 . . . . 73.45 109.914 -176.028 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 717' ' ' ILE . . . . . . . . . . . . . 11.8 pt -130.11 163.99 34.12 Favored 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-O 121.788 0.804 . . . . 50.51 109.605 -177.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 718' ' ' GLU . . . . . . . . . . . . . 5.0 tt0 -86.6 132.18 43.37 Favored Pre-proline 0 C--O 1.237 0.426 0 CA-C-N 115.163 -0.926 . . . . 70.08 109.578 173.619 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 719' ' ' PRO . . . . . . . . . . . . . 17.8 Cg_exo -64.03 160.4 37.98 Favored 'Trans proline' 0 C--O 1.233 0.236 0 CA-C-O 121.981 0.742 . . . . 54.1 112.139 -173.879 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 720' ' ' ALA . . . . . . . . . . . . . . . -65.63 122.2 16.71 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 114.962 -1.017 . . . . 56.2 108.918 170.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 721' ' ' ARG . . . . . . . . . . . . . 28.5 ptt85 -127.32 133.54 50.1 Favored 'General case' 0 C--N 1.328 -0.33 0 N-CA-C 109.906 -0.405 . . . . 88.85 109.906 -174.164 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 722' ' ' ILE . . . . . . . . . . . . . 11.8 mt -85.65 122.73 38.78 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 108.167 -1.049 . . . . 61.18 108.167 178.42 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 723' ' ' GLU . . . . . . . . . . . . . 58.3 mm-40 -80.83 -58.41 3.11 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-O 120.992 0.425 . . . . 77.73 110.645 175.413 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 724' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -129.16 166.21 19.79 Favored 'General case' 0 C--O 1.234 0.256 0 N-CA-C 107.968 -1.123 . . . . 77.33 107.968 176.927 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 725' ' ' GLU . . . . . . . . . . . . . 17.1 pt-20 -169.25 149.17 4.08 Favored 'General case' 0 C--O 1.235 0.31 0 N-CA-C 109.352 -0.61 . . . . 71.39 109.352 176.463 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 726' ' ' GLU . . . . . . . . . . . . . 70.8 mt-10 -108.21 133.27 52.7 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.339 -0.846 . . . . 69.35 108.805 171.465 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 727' ' ' LEU . . . . . . . . . . . . . 62.3 mt -120.34 127.65 52.53 Favored 'General case' 0 C--O 1.235 0.302 0 N-CA-C 109.54 -0.541 . . . . 64.18 109.54 -178.56 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 728' ' ' THR . . . . . . . . . . . . . 24.3 m -100.73 114.81 28.9 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 106.789 -1.56 . . . . 74.24 106.789 169.007 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 729' ' ' LEU . . . . . 0.634 ' O ' HD12 ' B' ' 729' ' ' LEU . 1.0 OUTLIER -129.06 133.41 47.68 Favored 'General case' 0 C--N 1.327 -0.377 0 N-CA-C 108.929 -0.767 . . . . 77.18 108.929 -176.791 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 730' ' ' THR . . . . . . . . . . . . . 2.8 m -100.48 131.27 46.49 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 109.085 -0.709 . . . . 70.49 109.085 -179.685 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 731' ' ' ILE . . . . . . . . . . . . . 38.3 mt -115.23 134.64 57.73 Favored 'Isoleucine or valine' 0 C--O 1.237 0.438 0 N-CA-C 108.016 -1.105 . . . . 69.5 108.016 -175.853 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 732' ' ' LEU . . . . . . . . . . . . . . . -92.36 -173.78 3.51 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-O 121.567 0.699 . . . . 83.34 109.9 179.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 733' ' ' ARG . . . . . . . . . . . . . 10.7 tpp85 . . . . . 0 C--N 1.331 -0.236 0 O-C-N 121.913 -0.492 . . . . 99.56 110.868 -178.997 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 735' ' ' THR . . . . . . . . . . . . . 44.2 m . . . . . 0 C--O 1.233 0.224 0 CA-C-O 120.866 0.365 . . . . 100.12 111.606 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 736' ' ' GLY . . . . . . . . . . . . . . . 84.42 129.67 1.89 Allowed Glycine 0 N--CA 1.449 -0.446 0 CA-C-N 115.897 -0.592 . . . . 83.36 114.553 174.409 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 737' ' ' GLY . . . . . . . . . . . . . . . 76.0 150.21 2.94 Favored Glycine 0 C--N 1.332 0.314 0 N-CA-C 116.356 1.302 . . . . 82.85 116.356 171.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 738' ' ' LEU . . . . . . . . . . . . . . . -109.62 -27.8 9.19 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 113.263 0.838 . . . . 75.23 113.263 175.57 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 739' ' ' GLY . . . . . . . . . . . . . . . 96.49 26.95 10.27 Favored Glycine 0 N--CA 1.442 -0.965 0 N-CA-C 116.308 1.283 . . . . 80.79 116.308 172.908 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 740' ' ' ILE . . . . . 0.516 HG22 HG22 ' B' ' 763' ' ' VAL . 18.7 pt -139.46 168.58 18.17 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 CA-C-N 118.583 1.191 . . . . 80.58 109.119 -179.662 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 741' ' ' SER . . . . . . . . . . . . . 68.9 m -132.59 126.08 31.95 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 107.389 -1.337 . . . . 75.59 107.389 170.645 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 742' ' ' ILE . . . . . . . . . . . . . 23.4 pt -102.25 142.25 16.91 Favored 'Isoleucine or valine' 0 C--O 1.238 0.489 0 N-CA-C 109.065 -0.717 . . . . 70.96 109.065 -177.535 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 743' ' ' ALA . . . . . . . . . . . . . . . -132.17 172.36 12.5 Favored 'General case' 0 N--CA 1.453 -0.282 0 C-N-CA 123.479 0.712 . . . . 64.98 109.129 179.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 744' ' ' GLY . . . . . . . . . . . . . . . 84.63 -173.41 49.39 Favored Glycine 0 N--CA 1.443 -0.866 0 CA-C-O 122.433 1.018 . . . . 61.37 112.256 -176.722 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 745' ' ' GLY . . . . . . . . . . . . . . . 140.75 159.94 8.12 Favored Glycine 0 N--CA 1.45 -0.38 0 CA-C-O 122.198 0.888 . . . . 64.95 111.652 179.652 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 746' ' ' LYS . . . . . . . . . . . . . 8.7 tttp -76.44 122.89 25.16 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 109.354 -0.61 . . . . 70.26 109.354 -179.19 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 747' ' ' GLY . . . . . . . . . . . . . . . 80.74 13.03 82.11 Favored Glycine 0 N--CA 1.445 -0.741 0 CA-C-O 119.308 -0.718 . . . . 71.49 114.581 -173.681 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 748' ' ' SER . . . . . . . . . . . . . 5.0 m -111.4 175.69 5.32 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 118.047 0.924 . . . . 75.31 109.775 179.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 749' ' ' THR . . . . . . . . . . . . . 62.8 m -66.05 124.2 87.15 Favored Pre-proline 0 C--O 1.239 0.501 0 N-CA-C 108.61 -0.885 . . . . 109.76 108.61 172.668 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 750' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_exo -65.1 138.97 58.89 Favored 'Trans proline' 0 C--O 1.233 0.272 0 CA-C-N 119.506 0.859 . . . . 97.44 111.979 -177.137 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 751' ' ' TYR . . . . . . . . . . . . . 78.1 t80 -69.88 -46.77 64.77 Favored 'General case' 0 C--O 1.236 0.378 0 CA-C-N 115.424 -0.807 . . . . 90.83 110.587 173.979 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 752' ' ' LYS . . . . . . . . . . . . . 5.6 mtmm . . . . . 0 C--N 1.33 -0.243 0 N-CA-C 109.903 -0.406 . . . . 105.15 109.903 175.052 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 755' ' ' ASP . . . . . . . . . . . . . 9.8 t70 . . . . . 0 C--O 1.232 0.18 0 CA-C-O 120.891 0.376 . . . . 85.78 110.375 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 756' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -90.42 16.81 8.14 Favored 'General case' 0 C--O 1.236 0.384 0 N-CA-C 112.667 0.617 . . . . 90.14 112.667 179.749 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 757' ' ' GLY . . . . . . . . . . . . . . . -62.91 168.08 19.83 Favored Glycine 0 N--CA 1.448 -0.537 0 CA-C-O 122.832 1.24 . . . . 74.63 111.393 178.047 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 758' ' ' ILE . . . . . 0.526 HD13 ' HB2' ' B' ' 796' ' ' ALA . 5.6 mt -92.53 123.66 44.71 Favored 'Isoleucine or valine' 0 C--O 1.237 0.418 0 N-CA-C 107.977 -1.12 . . . . 61.74 107.977 177.272 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 759' ' ' PHE . . . . . . . . . . . . . 79.3 m-85 -119.53 164.04 16.4 Favored 'General case' 0 N--CA 1.451 -0.379 0 CA-C-O 121.375 0.607 . . . . 71.33 109.665 179.748 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 760' ' ' ILE . . . . . . . . . . . . . 18.3 mm -89.35 104.62 15.17 Favored 'Isoleucine or valine' 0 C--O 1.234 0.271 0 N-CA-C 106.26 -1.756 . . . . 69.16 106.26 173.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 761' ' ' SER . . . . . . . . . . . . . 89.5 p -75.54 -27.03 58.52 Favored 'General case' 0 C--O 1.237 0.421 0 N-CA-C 112.225 0.454 . . . . 71.06 112.225 -177.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 762' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -157.23 157.51 34.45 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 108.717 -0.845 . . . . 95.86 108.717 -179.85 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 763' ' ' VAL . . . . . 0.516 HG22 HG22 ' B' ' 740' ' ' ILE . 73.3 t -133.6 127.78 53.55 Favored 'Isoleucine or valine' 0 C--O 1.236 0.39 0 N-CA-C 108.382 -0.97 . . . . 83.4 108.382 176.481 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 764' ' ' SER . . . . . . . . . . . . . 7.4 m -58.47 139.87 54.88 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-O 121.164 0.507 . . . . 85.75 109.919 176.667 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 765' ' ' GLU . . . . . 0.408 ' OE1' ' N ' ' B' ' 765' ' ' GLU . 3.1 mp0 -52.61 -46.73 67.12 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-N 115.748 -0.66 . . . . 102.95 111.487 -171.216 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 766' ' ' GLU . . . . . . . . . . . . . 12.7 tt0 -135.08 83.18 2.0 Favored 'General case' 0 N--CA 1.466 0.361 0 N-CA-C 107.336 -1.357 . . . . 118.28 107.336 179.419 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 767' ' ' GLY . . . . . . . . . . . . . . . -128.44 174.58 18.86 Favored Glycine 0 N--CA 1.443 -0.898 0 N-CA-C 111.065 -0.814 . . . . 93.1 111.065 175.611 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 768' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_exo -58.41 -36.02 98.02 Favored 'Trans proline' 0 C--O 1.236 0.409 0 CA-C-N 117.017 0.409 . . . . 75.14 113.125 -179.07 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 769' ' ' ALA . . . . . . . . . . . . . . . -70.84 -32.48 69.53 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.26 -0.576 . . . . 68.89 111.532 178.542 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 770' ' ' ALA . . . . . . . . . . . . . . . -66.2 -35.28 80.04 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.109 -0.637 . . . . 78.17 111.082 173.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 771' ' ' ARG . . . . . . . . . . . . . . . -68.56 -33.83 74.77 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.653 -0.419 . . . . 89.07 111.461 177.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 772' ' ' ALA . . . . . . . . . . . . . . . -75.75 -22.29 56.63 Favored 'General case' 0 C--O 1.236 0.357 0 N-CA-C 112.495 0.554 . . . . 72.46 112.495 178.581 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 773' ' ' GLY . . . . . . . . . . . . . . . 110.46 19.06 8.12 Favored Glycine 0 N--CA 1.442 -0.966 0 N-CA-C 116.542 1.377 . . . . 73.72 116.542 177.594 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 774' ' ' VAL . . . . . . . . . . . . . 39.2 t -71.25 133.66 31.42 Favored 'Isoleucine or valine' 0 C--O 1.238 0.495 0 CA-C-N 118.854 1.327 . . . . 66.84 109.096 178.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 775' ' ' ARG . . . . . . . . . . . . . 5.8 mpt_? -112.94 152.19 29.64 Favored 'General case' 0 C--O 1.234 0.275 0 C-N-CA 123.063 0.545 . . . . 80.76 109.873 -179.702 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 776' ' ' VAL . . . . . . . . . . . . . 73.8 t -67.46 129.08 31.74 Favored 'Isoleucine or valine' 0 C--O 1.239 0.534 0 N-CA-C 109.089 -0.708 . . . . 74.44 109.089 175.49 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 777' ' ' GLY . . . . . . . . . . . . . . . 103.18 -13.02 55.5 Favored Glycine 0 N--CA 1.446 -0.698 0 CA-C-O 119.196 -0.78 . . . . 66.15 114.494 -177.798 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 778' ' ' ASP . . . . . 0.452 ' HB3' ' HB ' ' B' ' 811' ' ' VAL . 84.8 m-20 -60.35 130.22 45.56 Favored 'General case' 0 N--CA 1.454 -0.253 0 CA-C-N 118.005 0.903 . . . . 64.99 109.928 177.707 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 779' ' ' LYS . . . . . 0.447 ' HB3' ' HB3' ' B' ' 812' ' ' TRP . 84.3 tttt -81.7 126.16 31.46 Favored 'General case' 0 N--CA 1.452 -0.341 0 N-CA-C 109.19 -0.671 . . . . 76.08 109.19 175.035 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 780' ' ' LEU . . . . . 0.404 HD13 ' HE1' ' B' ' 809' ' ' MET . 12.7 tp -78.87 116.59 19.29 Favored 'General case' 0 C--O 1.234 0.252 0 N-CA-C 109.145 -0.687 . . . . 62.51 109.145 -179.566 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 781' ' ' LEU . . . . . 0.448 HD11 ' HB2' ' B' ' 812' ' ' TRP . 95.0 mt -98.37 -47.32 5.46 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 112.643 0.608 . . . . 68.0 112.643 -177.851 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 782' ' ' GLU . . . . . . . . . . . . . 21.6 mt-10 -144.62 152.32 40.31 Favored 'General case' 0 C--O 1.234 0.245 0 CA-C-O 121.276 0.56 . . . . 67.7 109.794 -174.732 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 783' ' ' VAL . . . . . . . . . . . . . 49.3 t -136.61 119.01 20.49 Favored 'Isoleucine or valine' 0 C--O 1.235 0.322 0 N-CA-C 107.259 -1.386 . . . . 60.22 107.259 173.404 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 784' ' ' ASN . . . . . . . . . . . . . 92.7 m-20 51.73 39.21 24.9 Favored 'General case' 0 C--O 1.233 0.209 0 CA-C-O 121.5 0.667 . . . . 57.17 111.414 179.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 785' ' ' GLY . . . . . . . . . . . . . . . 85.45 -6.48 79.92 Favored Glycine 0 N--CA 1.445 -0.747 0 N-CA-C 115.744 1.058 . . . . 47.5 115.744 177.441 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 786' ' ' VAL . . . . . 0.406 HG21 ' HB2' ' A' ' 806' ' ' ALA . 3.3 t -97.91 119.87 46.5 Favored 'Isoleucine or valine' 0 C--O 1.236 0.376 0 CA-C-N 118.762 1.281 . . . . 66.53 108.647 179.146 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 787' ' ' ALA . . . . . . . . . . . . . . . -72.6 136.85 45.83 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 121.304 0.574 . . . . 53.51 110.604 -179.394 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 788' ' ' LEU . . . . . . . . . . . . . 83.9 mt -113.86 18.01 17.62 Favored 'General case' 0 C--O 1.236 0.356 0 CA-C-N 115.657 -0.701 . . . . 58.62 111.762 178.416 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 789' ' ' GLN . . . . . . . . . . . . . 24.3 mt-30 -66.62 -29.64 69.72 Favored 'General case' 0 C--O 1.237 0.407 0 C-N-CA 120.625 -0.43 . . . . 82.88 111.792 -173.341 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 790' ' ' GLY . . . . . . . . . . . . . . . -123.4 30.99 4.79 Favored Glycine 0 N--CA 1.448 -0.52 0 N-CA-C 111.851 -0.5 . . . . 71.1 111.851 176.824 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 791' ' ' ALA . . . . . . . . . . . . . . . -95.18 153.66 17.56 Favored 'General case' 0 C--N 1.326 -0.434 0 CA-C-O 121.506 0.67 . . . . 63.03 110.909 -174.214 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 792' ' ' GLU . . . . . . . . . . . . . 88.4 mt-10 -74.41 165.29 25.44 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 122.06 0.933 . . . . 62.72 109.904 174.97 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 793' ' ' HIS . . . . . . . . . . . . . 22.8 t60 -62.66 -45.38 93.05 Favored 'General case' 0 C--O 1.236 0.368 0 CA-C-N 115.461 -0.79 . . . . 62.9 110.979 -175.299 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 794' ' ' HIS . . . . . . . . . . . . . 6.0 p80 -65.37 -22.45 66.8 Favored 'General case' 0 C--O 1.235 0.31 0 O-C-N 121.91 -0.494 . . . . 57.47 112.316 -179.646 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 795' ' ' GLU . . . . . . . . . . . . . 87.6 mt-10 -74.73 -33.85 62.44 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.374 -0.53 . . . . 72.58 111.384 178.231 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 796' ' ' ALA . . . . . 0.526 ' HB2' HD13 ' B' ' 758' ' ' ILE . . . -71.32 -38.76 71.7 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.159 -0.616 . . . . 61.04 110.856 174.189 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 797' ' ' VAL . . . . . . . . . . . . . 69.8 t -60.77 -49.84 82.91 Favored 'Isoleucine or valine' 0 C--O 1.237 0.428 0 C-N-CA 120.425 -0.51 . . . . 61.62 110.043 177.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 798' ' ' GLU . . . . . . . . . . . . . 15.1 mt-10 -57.55 -23.89 53.05 Favored 'General case' 0 C--O 1.238 0.478 0 O-C-N 121.9 -0.5 . . . . 74.14 112.014 175.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 799' ' ' ALA . . . . . 0.638 ' HA ' HG22 ' A' ' 805' ' ' THR . . . -75.92 -46.65 28.85 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 120.547 -0.461 . . . . 65.57 111.057 178.045 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 800' ' ' LEU . . . . . . . . . . . . . 96.8 mt -83.51 -40.97 18.5 Favored 'General case' 0 C--O 1.235 0.291 0 N-CA-C 111.936 0.347 . . . . 67.6 111.936 -177.688 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 801' ' ' ARG . . . . . . . . . . . . . 26.2 ttp180 . . . . . 0 C--N 1.33 -0.261 0 O-C-N 121.794 -0.566 . . . . 97.37 109.649 174.088 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 804' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.365 0 N-CA-C 112.034 -0.427 . . . . 89.78 112.034 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 805' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -76.72 -35.59 57.74 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 119.611 -0.836 . . . . 75.57 112.118 -175.07 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 806' ' ' ALA . . . . . . . . . . . . . . . -143.26 155.37 44.47 Favored 'General case' 0 C--N 1.332 -0.18 0 CA-C-O 121.869 0.843 . . . . 71.76 109.896 -178.128 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 807' ' ' VAL . . . . . . . . . . . . . . . -140.43 133.3 33.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.411 0 N-CA-C 107.144 -1.428 . . . . 62.86 107.144 173.789 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 808' ' ' GLN . . . . . . . . . . . . . 5.6 pt20 -114.05 129.98 56.58 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.488 -0.93 . . . . 63.22 108.488 176.063 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 809' ' ' MET . . . . . 0.404 ' HE1' HD13 ' B' ' 780' ' ' LEU . 0.1 OUTLIER -117.55 152.26 35.46 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 109.001 -0.74 . . . . 65.75 109.001 -179.278 . . . . . . . . 3 3 . 1 . 001 ecloud nobuild full ' B' B ' 810' ' ' ARG . . . . . . . . . . . . . 58.0 mtt85 -103.96 125.5 50.39 Favored 'General case' 0 C--N 1.327 -0.412 0 N-CA-C 107.873 -1.158 . . . . 81.57 107.873 165.707 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 811' ' ' VAL . . . . . 0.452 ' HB ' ' HB3' ' B' ' 778' ' ' ASP . 22.4 m -117.12 155.97 18.57 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.223 0 CA-C-O 121.807 0.813 . . . . 56.85 108.98 179.999 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 812' ' ' TRP . . . . . 0.448 ' HB2' HD11 ' B' ' 781' ' ' LEU . 72.6 t-105 -118.37 123.19 44.67 Favored 'General case' 0 C--O 1.235 0.315 0 N-CA-C 107.508 -1.293 . . . . 70.05 107.508 179.681 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 813' ' ' ARG . . . . . . . . . . . . . 36.4 ttm180 -122.86 134.49 54.39 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 108.729 -0.841 . . . . 70.98 108.729 -174.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 814' ' ' GLU . . . . . 0.405 ' O ' ' C ' ' B' ' 815' ' ' ARG . 45.8 mt-10 -128.33 92.53 3.46 Favored 'General case' 0 C--O 1.234 0.264 0 N-CA-C 108.173 -1.047 . . . . 80.75 108.173 -179.874 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 815' ' ' ARG . . . . . 0.405 ' C ' ' O ' ' B' ' 814' ' ' GLU . 5.6 ptp180 . . . . . 0 C--O 1.231 0.118 0 N-CA-C 114.762 1.393 . . . . 90.05 114.762 179.003 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 823' ' ' HIS . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.517 -0.321 0 N-CA-C 109.36 -0.607 . . . . 98.36 109.36 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' D' D ' 824' ' ' THR . . . . . . . . . . . . . . . -145.55 60.24 1.27 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-O 122.143 0.973 . . . . 92.13 111.186 -175.484 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 825' ' ' ASN . . . . . . . . . . . . . 34.6 t-20 55.67 73.63 0.42 Allowed 'General case' 0 CA--C 1.534 0.344 0 CA-C-O 122.095 0.95 . . . . 78.17 112.233 164.122 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 826' ' ' GLU . . . . . . . . . . . . . 8.6 mt-10 -104.91 143.14 33.56 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 114.768 -1.106 . . . . 78.08 108.883 167.007 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 827' ' ' THR . . . . . . . . . . . . . 44.0 m -125.07 128.67 48.84 Favored 'General case' 0 C--O 1.234 0.275 0 N-CA-C 108.834 -0.802 . . . . 67.99 108.834 178.797 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 828' ' ' SER . . . . . . . . . . . . . 45.8 t -84.19 140.94 31.39 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-O 121.099 0.476 . . . . 71.85 110.937 -177.188 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' D' D ' 829' ' ' LEU . . . . . . . . . . . . . 6.2 mt . . . . . 0 C--N 1.331 -0.226 0 CA-C-N 115.874 -0.603 . . . . 67.55 112.274 -177.234 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 825' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.232 0.153 0 CA-C-O 120.812 0.339 . . . . 98.66 110.398 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 826' ' ' GLU . . . . . . . . . . . . . 15.2 mp0 -61.44 147.99 43.29 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.686 0.755 . . . . 89.99 111.015 -174.23 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 827' ' ' THR . . . . . . . . . . . . . 17.1 m -124.89 125.54 44.12 Favored 'General case' 0 C--O 1.235 0.322 0 N-CA-C 108.294 -1.002 . . . . 73.54 108.294 174.885 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 828' ' ' SER . . . . . . . . . . . . . 63.7 m -99.58 151.38 21.23 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 121.44 0.638 . . . . 79.13 111.287 -173.134 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' E' E ' 829' ' ' LEU . . . . . . . . . . . . . 28.0 mt . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 115.25 -0.886 . . . . 79.0 110.689 178.551 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 901' ' ' PEG . . . . . 0.514 ' H22' ' HA ' ' A' ' 772' ' ' ALA . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 902' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 903' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 901' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' E' E ' 901' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1001 ' ' HOH . . . . . 0.765 ' O ' ' N ' ' A' ' 736' ' ' GLY . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A 1002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A 1005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1001 ' ' HOH . . . . . 0.653 ' O ' ' OD1' ' B' ' 713' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B 1002 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1003 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1004 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1005 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1006 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1007 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B 1008 ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_