data_4hw5_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 4hw5 _Structure_validation_residue.Date_analyzed 2016-10-12 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 ecloud orig full ' A' A ' 672' ' ' SER . . . . . 0.524 ' OG ' ' N ' ' A' ' 673' ' ' VAL . 40.0 t . . . . . 0 C--O 1.233 0.2 0 N-CA-C 112.124 0.416 . . . . 119.5 112.124 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 673' ' ' VAL . . . . . 0.524 ' N ' ' OG ' ' A' ' 672' ' ' SER . 47.8 t -63.05 -72.1 0.1 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 115.845 -0.616 . . . . 119.32 112.413 -174.706 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 674' ' ' GLN . . . . . . . . . . . . . 5.7 pm0 -86.77 -2.91 58.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.468 -0.333 . . . . 120.49 111.448 -179.251 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 675' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -73.83 -38.87 64.38 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.562 -0.29 . . . . 102.15 111.082 176.93 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 60.7 m -57.22 -32.47 66.54 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.546 -0.539 . . . . 124.84 109.546 175.663 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 677' ' ' GLU . . . . . . . . . . . . . 74.0 tt0 -65.75 -59.07 4.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.511 -0.768 . . . . 131.73 111.959 179.539 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 678' ' ' LYS . . . . . . . . . . . . . 15.9 mmmt -60.64 -21.45 62.76 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.334 0.494 . . . . 106.45 112.334 -179.871 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 679' ' ' ARG . . . . . . . . . . . . . 14.6 mtm180 -72.11 -45.33 61.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.651 0.262 . . . . 101.44 110.876 175.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 680' ' ' MET . . . . . . . . . . . . . 84.2 mmm -62.53 -44.13 97.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.188 -0.46 . . . . 110.89 110.049 179.022 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 681' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -58.42 -40.38 82.34 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.817 -0.629 . . . . 99.56 110.429 178.63 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 682' ' ' LYS . . . . . . . . . . . . . 19.2 tptt -70.42 -48.81 54.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.234 -0.439 . . . . 70.06 111.279 -178.268 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 683' ' ' VAL . . . . . . . . . . . . . 13.0 t -55.75 -40.21 59.81 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-N 116.308 -0.405 . . . . 78.49 111.142 176.976 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 684' ' ' GLY . . . . . . . . . . . . . . . -58.57 -31.8 67.76 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 121.555 -0.355 . . . . 99.04 113.553 177.261 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 2.1 mptm? -62.06 -8.4 5.33 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 115.264 1.579 . . . . 85.78 115.264 -176.962 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 686' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 -114.98 153.23 47.08 Favored Pre-proline 0 CA--C 1.509 -0.598 0 N-CA-C 112.961 0.726 . . . . 75.05 112.961 -170.2 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 687' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_exo -47.93 142.91 14.38 Favored 'Trans proline' 0 CA--C 1.517 -0.372 0 C-N-CA 122.935 2.424 . . . . 89.96 109.257 171.591 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 688' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -56.91 -24.99 56.31 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 114.584 1.327 . . . . 103.79 114.584 -165.08 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 689' ' ' GLU . . . . . . . . . . . . . 16.2 pm0 -98.6 8.86 44.4 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 113.063 0.764 . . . . 99.52 113.063 -176.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 50.5 mt -117.21 12.93 14.56 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.833 -0.432 . . . . 73.01 109.833 177.369 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 691' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -80.0 -32.28 39.67 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.755 0.65 . . . . 89.39 112.755 -177.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 692' ' ' LYS . . . . . . . . . . . . . 22.3 tttt -60.77 -41.43 95.48 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.879 0.371 . . . . 106.88 110.401 172.788 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 693' ' ' CYS . . . . . . . . . . . . . 81.3 m -62.15 -40.57 96.43 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-O 121.328 0.585 . . . . 99.89 111.231 179.452 -59.178 -106.766 -106.908 108.35 2.034 109.224 73.304 178.817 1 1 . 1 . 001 ecloud orig full ' A' A ' 694' ' ' CYS . . . . . . . . . . . . . 38.1 t -68.86 -52.64 27.56 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.57 -0.741 . . . . 61.71 109.91 -179.671 -172.177 60.197 -96.75 107.922 2.045 111.745 -148.458 -68.678 1 1 . 1 . 001 ecloud orig full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -47.1 -53.49 12.67 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.11 0.964 . . . . 91.12 113.185 174.728 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 696' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -66.93 -24.22 66.06 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.004 0.431 . . . . 87.98 111.964 -179.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . -70.44 -18.11 75.06 Favored Glycine 0 C--O 1.219 -0.801 0 N-CA-C 110.565 -1.014 . . . . 52.75 110.565 178.047 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 698' ' ' MET . . . . . . . . . . . . . 66.7 mtm -111.72 16.38 20.55 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 114.611 1.337 . . . . 48.6 114.611 -173.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 699' ' ' ARG . . . . . . . . . . . . . 47.1 mtp180 -76.92 161.37 28.45 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 119.744 -0.782 . . . . 122.23 109.359 178.927 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 700' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -53.32 157.81 1.86 Allowed 'General case' 0 C--O 1.219 -0.531 0 CA-C-N 116.712 -0.222 . . . . 119.11 111.368 179.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 701' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -127.96 68.3 75.37 Favored Pre-proline 0 CA--C 1.537 0.468 0 CA-C-O 120.643 0.259 . . . . 48.36 111.488 -173.004 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -67.73 -32.01 31.11 Favored 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 118.197 -0.735 . . . . 49.17 113.636 -174.353 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 703' ' ' MET . . . . . . . . . . . . . 96.2 mmm -75.37 2.54 11.04 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 112.896 0.702 . . . . 51.51 112.896 176.983 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 704' ' ' ARG . . . . . 0.59 ' NH1' ' O3 ' ' A' ' 801' ' ' SO4 . 32.6 mtp180 48.78 45.47 21.97 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 113.557 0.947 . . . . 79.0 113.557 179.636 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 705' ' ' PHE . . . . . . . . . . . . . 11.1 m-30 -87.71 144.8 26.45 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.222 -0.445 . . . . 56.53 110.842 177.796 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 706' ' ' SER . . . . . . . . . . . . . 83.9 p -61.06 159.69 11.27 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.685 -0.406 . . . . 47.05 110.016 171.166 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 707' ' ' CYS . . . . . . . . . . . . . 63.4 m -61.2 -38.94 88.37 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.194 0.521 . . . . 53.67 111.798 178.061 -73.378 -66.378 -83.705 103.567 2.055 102.869 -88.679 -174.338 1 1 . 1 . 001 ecloud orig full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 65.3 tp60 -67.08 -38.65 86.09 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.843 -0.617 . . . . 83.51 109.589 -179.858 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 61.1 ttt180 -64.76 -40.76 95.82 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.431 -0.508 . . . . 95.42 112.044 -178.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 710' ' ' ARG . . . . . 0.413 ' NH2' ' SG ' ' A' ' 728' ' ' CYS . 65.7 mtm180 -66.86 -15.1 63.4 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 114.507 1.299 . . . . 81.9 114.507 179.968 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 711' ' ' THR . . . . . . . . . . . . . 35.0 p -87.64 -20.42 26.36 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 113.162 0.801 . . . . 80.63 113.162 177.628 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 712' ' ' ARG . . . . . . . . . . . . . 34.8 mtt85 -58.82 -20.86 54.23 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 116.889 2.181 . . . . 102.54 116.889 -166.588 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 713' ' ' PHE . . . . . . . . . . . . . 78.8 m-85 -131.48 20.7 4.74 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 113.849 1.055 . . . . 98.07 113.849 -177.429 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 714' ' ' ILE . . . . . . . . . . . . . 11.7 mt -83.77 -27.73 7.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 C-N-CA 120.313 -0.555 . . . . 102.61 110.59 176.506 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 715' ' ' SER . . . . . . . . . . . . . 76.8 p 53.57 -115.46 0.95 Allowed 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.041 -0.726 . . . . 116.29 109.041 -167.765 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 13.3 tp 61.06 -3.95 0.15 Allowed 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 115.776 1.769 . . . . 114.3 115.776 167.73 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 717' ' ' GLY . . . . . . . . . . . . . . . 130.4 161.27 10.33 Favored Glycine 0 C--O 1.226 -0.367 0 N-CA-C 116.468 1.347 . . . . 95.41 116.468 171.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -81.22 -50.36 9.66 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 122.455 0.302 . . . . 137.65 111.242 176.932 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.93 -24.86 67.65 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 116.182 -0.463 . . . . 84.6 110.348 -179.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 720' ' ' CYS . . . . . . . . . . . . . 45.6 t -80.41 -29.33 37.69 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.701 -0.681 . . . . 93.6 111.886 178.245 178.817 73.304 -106.908 109.224 2.034 108.35 -106.766 -59.178 1 1 . 1 . 001 ecloud orig full ' A' A ' 721' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -70.93 -45.65 63.85 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 110.329 -0.249 . . . . 85.18 110.329 176.094 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 722' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -54.76 -41.24 70.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 89.47 111.408 176.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 723' ' ' VAL . . . . . . . . . . . . . 34.9 t -65.97 -58.38 6.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.103 -0.499 . . . . 58.83 110.192 179.011 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 724' ' ' PHE . . . . . . . . . . . . . 31.6 t80 -44.09 -53.22 6.58 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 123.382 0.673 . . . . 47.05 111.207 175.959 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 12.7 tp -62.84 -42.34 99.7 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.487 -0.778 . . . . 61.13 111.038 -174.62 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 726' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -66.25 -40.46 90.2 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 115.97 -0.559 . . . . 98.6 112.5 -179.485 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 727' ' ' CYS . . . . . . . . . . . . . 93.8 m -76.06 -38.95 56.48 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.826 0.346 . . . . 48.58 110.162 -178.341 -68.678 -148.458 -96.75 111.745 2.045 107.922 60.197 -172.177 1 1 . 1 . 001 ecloud orig full ' A' A ' 728' ' ' CYS . . . . . 0.413 ' SG ' ' NH2' ' A' ' 710' ' ' ARG . 48.7 t -57.18 -52.42 65.37 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-N 115.731 -0.668 . . . . 43.37 111.79 173.079 -174.338 -88.679 -83.705 102.869 2.055 103.567 -66.378 -73.378 2 2 . 1 . 001 ecloud orig full ' A' A ' 729' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -60.31 -37.32 80.22 Favored 'General case' 0 CA--C 1.504 -0.805 0 N-CA-C 111.606 0.225 . . . . 47.91 111.606 177.247 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 730' ' ' TYR . . . . . . . . . . . . . 68.2 t80 -62.64 -53.5 53.55 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.284 -0.417 . . . . 69.86 110.943 177.98 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 731' ' ' ILE . . . . . . . . . . . . . 7.9 tp -72.22 -29.07 30.83 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.241 0 N-CA-C 112.805 0.669 . . . . 49.62 112.805 -176.414 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 732' ' ' THR . . . . . . . . . . . . . 28.9 m -62.35 -47.48 84.02 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 119.709 -0.797 . . . . 48.39 109.223 177.801 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 76.0 tt0 -59.59 -42.04 91.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.326 -0.397 . . . . 96.46 111.786 178.018 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 734' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -66.31 -37.91 86.5 Favored 'General case' 0 N--CA 1.468 0.43 0 O-C-N 123.158 0.286 . . . . 62.2 111.391 179.281 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 735' ' ' ARG . . . . . . . . . . . . . 63.9 mtt180 -65.25 -43.29 91.8 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 118.599 -1.241 . . . . 62.02 110.78 177.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 84.8 mtt180 -61.56 -45.18 95.26 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.616 -0.433 . . . . 61.22 111.259 179.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 737' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -61.01 -41.9 97.41 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 119.957 -0.697 . . . . 50.77 110.405 177.981 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 738' ' ' HIS . . . . . . . . . . . . . 65.6 t-80 -62.68 -43.43 98.82 Favored 'General case' 0 C--O 1.165 -3.346 0 CA-C-O 118.145 -0.931 . . . . 90.92 112.861 175.782 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 739' ' ' ALA . . . . . . . . . . . . . . . -60.8 -40.66 93.49 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 119.168 0.895 . . . . 38.85 111.369 176.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 80.8 mtt180 -65.59 -42.08 92.09 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.726 0.639 . . . . 40.81 112.726 178.509 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -64.28 -42.78 96.26 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 108.788 -0.819 . . . . 30.43 108.788 179.135 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 742' ' ' SER . . . . . . . . . . . . . 33.2 t -62.81 -47.69 82.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.086 -0.506 . . . . 55.85 111.395 178.859 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 743' ' ' HIS . . . . . . . . . . . . . 47.4 t-80 -56.81 -35.79 69.17 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 113.155 0.798 . . . . 34.52 113.155 173.867 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 744' ' ' LEU . . . . . . . . . . . . . 62.6 mt -88.22 1.82 53.62 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 120.152 -0.619 . . . . 34.71 112.018 -176.737 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 745' ' ' GLY . . . . . . . . . . . . . . . 71.6 19.24 77.75 Favored Glycine 0 C--O 1.222 -0.601 0 C-N-CA 120.556 -0.83 . . . . 36.33 112.612 178.113 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 746' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.05 -18.39 26.02 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 108.297 -1.001 . . . . 62.6 108.297 176.523 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 747' ' ' ALA . . . . . . . . . . . . . . . -6.33 114.39 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 116.735 2.124 . . . . 117.02 116.735 179.08 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 748' ' ' ARG . . . . . . . . . . . . . 14.6 mmt85 . . . . . 0 N--CA 1.464 0.232 0 CA-C-O 121.085 0.469 . . . . 103.1 112.17 -176.315 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 672' ' ' SER . . . . . 0.541 ' OG ' ' N ' ' B' ' 673' ' ' VAL . 40.5 t . . . . . 0 C--O 1.233 0.185 0 CA-C-O 120.902 0.382 . . . . 123.37 112.009 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 673' ' ' VAL . . . . . 0.541 ' N ' ' OG ' ' B' ' 672' ' ' SER . 44.0 t -66.58 -70.16 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.857 -0.61 . . . . 121.68 111.807 -176.133 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 674' ' ' GLN . . . . . . . . . . . . . 27.6 mp0 -84.66 -1.36 56.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.176 -0.465 . . . . 130.0 111.389 -179.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 675' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -81.63 -38.83 25.36 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.556 -0.293 . . . . 102.34 111.304 179.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 61.0 m -57.0 -32.59 66.27 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.233 0.539 . . . . 123.6 109.629 175.614 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 677' ' ' GLU . . . . . . . . . . . . . 74.7 tt0 -65.15 -59.29 4.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.434 -0.803 . . . . 131.7 112.199 178.988 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 678' ' ' LYS . . . . . . . . . . . . . 15.7 mmmt -60.91 -21.45 63.37 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.282 0.475 . . . . 106.48 112.282 -179.549 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 679' ' ' ARG . . . . . . . . . . . . . 14.5 mtm180 -71.52 -45.5 62.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.679 -0.237 . . . . 101.43 110.978 175.273 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 680' ' ' MET . . . . . . . . . . . . . 83.4 mmm -63.01 -43.76 97.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.192 -0.458 . . . . 111.85 109.78 179.625 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 681' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -58.4 -40.46 82.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.938 -0.574 . . . . 99.81 110.493 178.482 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 682' ' ' LYS . . . . . . . . . . . . . 19.5 tptt -70.73 -48.65 53.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.2 -0.455 . . . . 71.14 111.19 -178.158 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 683' ' ' VAL . . . . . . . . . . . . . 12.6 t -56.01 -40.38 63.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.357 -0.383 . . . . 77.43 111.151 176.985 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 684' ' ' GLY . . . . . . . . . . . . . . . -57.89 -31.97 65.49 Favored Glycine 0 CA--C 1.521 0.441 0 CA-C-N 116.475 -0.329 . . . . 99.51 113.768 176.904 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 685' ' ' LYS . . . . . . . . . . . . . 2.1 mptm? -62.33 -8.52 6.04 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 115.171 1.545 . . . . 86.47 115.171 -176.835 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 686' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -114.62 153.39 46.76 Favored Pre-proline 0 CA--C 1.51 -0.573 0 N-CA-C 112.974 0.731 . . . . 75.57 112.974 -170.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 687' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -48.14 142.44 16.09 Favored 'Trans proline' 0 CA--C 1.516 -0.417 0 C-N-CA 122.986 2.458 . . . . 90.17 109.293 171.548 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 688' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -56.37 -25.13 48.43 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 114.589 1.329 . . . . 103.43 114.589 -165.13 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 689' ' ' GLU . . . . . . . . . . . . . 16.3 pm0 -98.73 9.05 44.2 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 112.994 0.739 . . . . 99.34 112.994 -176.124 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 690' ' ' LEU . . . . . . . . . . . . . 52.3 mt -117.18 13.1 14.62 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.772 -0.455 . . . . 73.84 109.772 177.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 691' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -80.11 -31.99 39.13 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.495 0.554 . . . . 88.91 112.495 -177.282 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 692' ' ' LYS . . . . . . . . . . . . . 22.0 tttt -61.41 -40.85 95.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.863 0.363 . . . . 106.69 110.249 173.489 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 693' ' ' CYS . . . . . . . . . . . . . 85.8 m -62.65 -40.22 96.35 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 116.107 -0.497 . . . . 100.22 111.17 179.583 -59.591 -106.92 -106.745 108.209 2.032 109.201 73.84 178.584 1 1 . 1 . 001 ecloud orig full ' B' B ' 694' ' ' CYS . . . . . . . . . . . . . 37.4 t -69.01 -52.92 23.69 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.51 -0.768 . . . . 63.34 109.84 -179.755 -171.949 58.861 -97.153 107.117 2.045 112.899 -147.324 -68.681 1 1 . 1 . 001 ecloud orig full ' B' B ' 695' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -47.15 -53.48 12.89 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.055 0.942 . . . . 91.51 113.197 174.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 696' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -66.77 -23.66 66.1 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 120.973 0.416 . . . . 87.88 111.903 -179.312 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 697' ' ' GLY . . . . . . . . . . . . . . . -71.16 -18.94 76.97 Favored Glycine 0 C--O 1.217 -0.914 0 N-CA-C 109.891 -1.284 . . . . 53.5 109.891 179.215 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 698' ' ' MET . . . . . . . . . . . . . 65.6 mtm -110.75 16.42 21.37 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 114.768 1.396 . . . . 49.75 114.768 -173.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 699' ' ' ARG . . . . . . . . . . . . . 47.1 mtp180 -77.36 160.86 28.48 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 119.758 -0.777 . . . . 122.4 109.107 179.082 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 700' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -52.08 158.07 1.18 Allowed 'General case' 0 C--O 1.224 -0.274 0 CA-C-N 116.6 -0.273 . . . . 119.18 111.629 179.335 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 701' ' ' ASN . . . . . . . . . . . . . 57.1 t30 -128.21 67.69 75.4 Favored Pre-proline 0 CA--C 1.537 0.462 0 CA-C-N 116.475 -0.329 . . . . 48.35 111.795 -173.021 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 702' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -67.52 -31.19 34.37 Favored 'Trans proline' 0 CA--C 1.536 0.623 0 C-N-CA 118.132 -0.779 . . . . 49.71 113.693 -174.238 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 703' ' ' MET . . . . . . . . . . . . . 96.3 mmm -76.32 2.24 13.93 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 112.671 0.619 . . . . 50.76 112.671 177.564 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 704' ' ' ARG . . . . . 0.49 ' NH1' ' O1 ' ' B' ' 801' ' ' SO4 . 31.4 mtp180 48.93 45.72 22.43 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.286 0.847 . . . . 78.48 113.286 179.766 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 705' ' ' PHE . . . . . . . . . . . . . 10.6 m-30 -88.06 145.08 26.15 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.198 -0.455 . . . . 56.58 110.71 177.68 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 706' ' ' SER . . . . . . . . . . . . . 81.5 p -61.54 160.67 10.83 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 109.775 -0.454 . . . . 48.06 109.775 171.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 707' ' ' CYS . . . . . . . . . . . . . 63.2 m -62.52 -38.43 89.91 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.229 0.538 . . . . 53.44 111.647 178.707 -73.442 -66.778 -83.202 103.513 2.062 103.012 -88.392 -175.179 1 1 . 1 . 001 ecloud orig full ' B' B ' 708' ' ' GLN . . . . . . . . . . . . . 65.0 tp60 -66.4 -39.8 89.22 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.733 -0.667 . . . . 83.25 109.682 179.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 -64.35 -41.45 96.75 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.798 -0.361 . . . . 95.59 111.862 -177.476 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 710' ' ' ARG . . . . . 0.415 ' NH2' ' SG ' ' B' ' 728' ' ' CYS . 66.3 mtm180 -65.92 -15.31 62.85 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 114.707 1.373 . . . . 82.12 114.707 179.344 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 711' ' ' THR . . . . . . . . . . . . . 32.4 p -87.01 -20.34 27.37 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 113.335 0.865 . . . . 80.37 113.335 177.1 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 712' ' ' ARG . . . . . . . . . . . . . 35.5 mtt85 -59.57 -20.24 54.26 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 116.764 2.135 . . . . 102.09 116.764 -165.731 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 713' ' ' PHE . . . . . . . . . . . . . 78.9 m-85 -131.88 20.61 4.57 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 113.685 0.994 . . . . 97.95 113.685 -177.099 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 714' ' ' ILE . . . . . . . . . . . . . 11.3 mt -83.98 -27.4 7.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 C-N-CA 120.43 -0.508 . . . . 102.19 110.551 176.526 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 715' ' ' SER . . . . . . . . . . . . . 76.7 p 53.39 -115.45 0.95 Allowed 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 109.027 -0.731 . . . . 116.45 109.027 -167.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 716' ' ' LEU . . . . . . . . . . . . . 13.4 tp 61.11 -4.18 0.15 Allowed 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 115.786 1.772 . . . . 114.2 115.786 167.716 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 717' ' ' GLY . . . . . . . . . . . . . . . 130.39 161.12 10.28 Favored Glycine 0 C--O 1.225 -0.407 0 N-CA-C 116.584 1.394 . . . . 95.91 116.584 171.906 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 718' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -80.88 -50.64 9.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.614 -0.293 . . . . 137.7 111.209 177.047 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.66 -25.07 67.79 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 116.184 -0.462 . . . . 84.05 110.432 -179.736 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 720' ' ' CYS . . . . . . . . . . . . . 44.1 t -80.26 -29.53 38.36 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.749 -0.659 . . . . 92.82 111.768 178.224 178.584 73.84 -106.745 109.201 2.032 108.209 -106.92 -59.591 1 1 . 1 . 001 ecloud orig full ' B' B ' 721' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -70.72 -45.08 65.57 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 110.332 -0.247 . . . . 85.43 110.332 176.285 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 722' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -55.68 -41.03 73.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.973 0.416 . . . . 89.49 111.364 176.94 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 723' ' ' VAL . . . . . . . . . . . . . 36.2 t -65.73 -58.17 7.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.045 -0.525 . . . . 59.61 110.161 178.802 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 724' ' ' PHE . . . . . . . . . . . . . 33.0 t80 -44.66 -52.37 8.28 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 123.499 0.72 . . . . 48.34 111.189 176.318 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 725' ' ' LEU . . . . . . . . . . . . . 13.1 tp -64.03 -41.41 97.44 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.349 -0.842 . . . . 60.81 110.666 -174.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 726' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -67.41 -39.45 85.5 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 116.026 -0.534 . . . . 98.92 112.322 -179.021 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 727' ' ' CYS . . . . . . . . . . . . . 93.8 m -76.99 -38.2 53.61 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 109.787 -0.449 . . . . 47.36 109.787 -177.918 -68.681 -147.324 -97.153 112.899 2.045 107.117 58.861 -171.949 1 1 . 1 . 001 ecloud orig full ' B' B ' 728' ' ' CYS . . . . . 0.415 ' SG ' ' NH2' ' B' ' 710' ' ' ARG . 44.6 t -58.46 -51.9 67.92 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 115.621 -0.718 . . . . 41.9 111.451 173.878 -175.179 -88.392 -83.202 103.012 2.062 103.513 -66.778 -73.442 2 2 . 1 . 001 ecloud orig full ' B' B ' 729' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -60.08 -38.24 82.3 Favored 'General case' 0 CA--C 1.503 -0.862 0 N-CA-C 111.677 0.251 . . . . 47.8 111.677 176.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 730' ' ' TYR . . . . . . . . . . . . . 70.8 t80 -61.69 -53.44 56.09 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 116.376 -0.375 . . . . 69.6 111.631 177.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 731' ' ' ILE . . . . . . . . . . . . . 7.9 tp -72.48 -28.65 28.8 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 N-CA-C 112.57 0.582 . . . . 49.86 112.57 -176.472 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 732' ' ' THR . . . . . . . . . . . . . 30.7 m -63.27 -46.87 84.81 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 119.789 -0.764 . . . . 47.03 109.189 178.237 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 733' ' ' GLU . . . . . . . . . . . . . 75.9 tt0 -59.83 -41.27 90.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.107 -0.497 . . . . 96.24 111.856 177.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 734' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -67.76 -37.62 82.34 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 123.121 0.263 . . . . 62.01 110.662 -179.428 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 735' ' ' ARG . . . . . . . . . . . . . 64.0 mtt180 -65.35 -43.26 91.41 Favored 'General case' 0 C--O 1.224 -0.287 0 C-N-CA 118.898 -1.121 . . . . 61.46 110.808 177.167 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 736' ' ' ARG . . . . . 0.446 ' NH1' ' O ' ' B' ' 914' ' ' HOH . 85.6 mtt180 -61.75 -44.32 97.13 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.595 -0.442 . . . . 61.22 111.466 179.449 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 737' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -61.79 -41.39 97.68 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 119.83 -0.748 . . . . 50.85 110.276 178.034 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 738' ' ' HIS . . . . . . . . . . . . . 66.1 t-80 -63.19 -43.47 98.12 Favored 'General case' 0 C--O 1.166 -3.327 0 CA-C-O 118.941 -0.552 . . . . 90.82 112.287 176.064 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 739' ' ' ALA . . . . . . . . . . . . . . . -60.92 -40.57 93.68 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 118.936 0.789 . . . . 37.58 111.332 177.259 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 80.6 mtt180 -65.59 -41.65 92.6 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.664 0.616 . . . . 40.03 112.664 178.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 741' ' ' ALA . . . . . . . . . . . . . . . -64.29 -43.72 93.89 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 108.601 -0.889 . . . . 30.47 108.601 179.168 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 742' ' ' SER . . . . . . . . . . . . . 32.6 t -62.2 -47.05 86.2 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.81 -0.632 . . . . 55.35 111.505 178.823 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 743' ' ' HIS . . . . . . . . . . . . . 47.1 t-80 -58.17 -35.31 71.39 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 113.09 0.774 . . . . 34.76 113.09 174.502 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 744' ' ' LEU . . . . . . . . . . . . . 70.8 mt -88.09 0.37 56.08 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 120.101 -0.64 . . . . 35.86 111.874 -177.248 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 745' ' ' GLY . . . . . . . . . . . . . . . 73.38 20.71 79.94 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.538 -0.839 . . . . 35.54 112.845 177.926 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 746' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -89.4 -22.28 22.64 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 109.741 -0.466 . . . . 57.51 109.741 176.259 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 747' ' ' ALA . . . . . . . . . . . . . . . -5.36 115.5 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 117.139 2.274 . . . . 116.77 117.139 -178.056 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 748' ' ' ARG . . . . . 0.521 ' NH1' ' CG ' ' B' ' 748' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.285 2.93 0 C-N-CA 119.199 -1.0 . . . . 108.9 112.157 -171.041 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' A' A ' 801' ' ' SO4 . . . . . 0.59 ' O3 ' ' NH1' ' A' ' 704' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 801' ' ' SO4 . . . . . 0.49 ' O1 ' ' NH1' ' B' ' 704' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 901' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 902' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 903' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 904' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 905' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 906' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 907' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 908' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 909' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 910' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 911' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 912' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 913' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 914' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 915' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 916' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' A' A ' 917' ' ' HOH . . . . . 0.517 ' O ' ' N ' ' A' ' 672' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' A' A ' 918' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 901' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 902' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 903' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 904' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 905' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 906' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 907' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 908' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 909' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 910' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 911' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 912' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 913' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 914' ' ' HOH . . . . . 0.446 ' O ' ' NH1' ' B' ' 736' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 915' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 916' ' ' HOH . . . . . 0.481 ' O ' ' N ' ' B' ' 672' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 672' ' ' SER . . . . . 0.517 ' N ' ' O ' ' A' ' 917' ' ' HOH . 40.0 t . . . . . 0 C--O 1.233 0.2 0 N-CA-C 112.124 0.416 . . . . 119.5 112.124 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 673' ' ' VAL . . . . . 0.513 ' N ' ' OG ' ' A' ' 672' ' ' SER . 47.8 t -63.05 -72.1 0.1 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 115.845 -0.616 . . . . 119.32 112.413 -174.706 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 674' ' ' GLN . . . . . . . . . . . . . 5.7 pm0 -86.77 -2.91 58.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.468 -0.333 . . . . 120.49 111.448 -179.251 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 675' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -73.83 -38.87 64.38 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.562 -0.29 . . . . 102.15 111.082 176.93 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 60.7 m -57.22 -32.47 66.54 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.546 -0.539 . . . . 124.84 109.546 175.663 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 677' ' ' GLU . . . . . . . . . . . . . 74.0 tt0 -65.75 -59.07 4.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.511 -0.768 . . . . 131.73 111.959 179.539 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 678' ' ' LYS . . . . . . . . . . . . . 15.9 mmmt -60.64 -21.45 62.76 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.334 0.494 . . . . 106.45 112.334 -179.871 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 679' ' ' ARG . . . . . . . . . . . . . 14.6 mtm180 -72.11 -45.33 61.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.651 0.262 . . . . 101.44 110.876 175.545 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 680' ' ' MET . . . . . . . . . . . . . 84.2 mmm -62.53 -44.13 97.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.188 -0.46 . . . . 110.89 110.049 179.022 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 681' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -58.42 -40.38 82.34 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.817 -0.629 . . . . 99.56 110.429 178.63 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 682' ' ' LYS . . . . . . . . . . . . . 19.2 tptt -70.42 -48.81 54.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.234 -0.439 . . . . 70.06 111.279 -178.268 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 683' ' ' VAL . . . . . . . . . . . . . 13.0 t -55.75 -40.21 59.81 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-N 116.308 -0.405 . . . . 78.49 111.142 176.976 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 684' ' ' GLY . . . . . . . . . . . . . . . -58.57 -31.8 67.76 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 121.555 -0.355 . . . . 99.04 113.553 177.261 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 2.1 mptm? -62.06 -8.4 5.33 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 115.264 1.579 . . . . 85.78 115.264 -176.962 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 686' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 -114.98 153.23 47.08 Favored Pre-proline 0 CA--C 1.509 -0.598 0 N-CA-C 112.961 0.726 . . . . 75.05 112.961 -170.2 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 687' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_exo -47.93 142.91 14.38 Favored 'Trans proline' 0 CA--C 1.517 -0.372 0 C-N-CA 122.935 2.424 . . . . 89.96 109.257 171.591 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 688' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -56.91 -24.99 56.31 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 114.584 1.327 . . . . 103.79 114.584 -165.08 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 689' ' ' GLU . . . . . . . . . . . . . 16.2 pm0 -98.6 8.86 44.4 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 113.063 0.764 . . . . 99.52 113.063 -176.205 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 50.5 mt -117.21 12.93 14.56 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.833 -0.432 . . . . 73.01 109.833 177.369 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 691' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -80.0 -32.28 39.67 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.755 0.65 . . . . 89.39 112.755 -177.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 692' ' ' LYS . . . . . . . . . . . . . 22.3 tttt -60.77 -41.43 95.48 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.879 0.371 . . . . 106.88 110.401 172.788 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 693' ' ' CYS . . . . . . . . . . . . . 81.3 m -62.15 -40.57 96.43 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-O 121.328 0.585 . . . . 99.89 111.231 179.452 -59.178 -106.766 -106.908 108.35 2.034 109.224 73.304 178.817 1 1 . 1 . 001 ecloud build full ' A' A ' 694' ' ' CYS . . . . . . . . . . . . . 38.1 t -68.86 -52.64 27.56 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.57 -0.741 . . . . 61.71 109.91 -179.671 -172.177 60.197 -96.75 107.922 2.045 111.745 -148.458 -68.678 1 1 . 1 . 001 ecloud build full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -47.1 -53.49 12.67 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.11 0.964 . . . . 91.12 113.185 174.728 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 696' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -66.93 -24.22 66.06 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.004 0.431 . . . . 87.98 111.964 -179.414 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . -70.44 -18.11 75.06 Favored Glycine 0 C--O 1.219 -0.801 0 N-CA-C 110.565 -1.014 . . . . 52.75 110.565 178.047 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 698' ' ' MET . . . . . . . . . . . . . 66.7 mtm -111.72 16.38 20.55 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 114.611 1.337 . . . . 48.6 114.611 -173.815 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 699' ' ' ARG . . . . . . . . . . . . . 47.1 mtp180 -76.92 161.37 28.45 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 119.744 -0.782 . . . . 122.23 109.359 178.927 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 700' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -53.32 157.81 1.86 Allowed 'General case' 0 C--O 1.219 -0.531 0 CA-C-N 116.712 -0.222 . . . . 119.11 111.368 179.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 701' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -127.96 68.3 75.37 Favored Pre-proline 0 CA--C 1.537 0.468 0 CA-C-O 120.643 0.259 . . . . 48.36 111.488 -173.004 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -67.73 -32.01 31.11 Favored 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 118.197 -0.735 . . . . 49.17 113.636 -174.353 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 703' ' ' MET . . . . . . . . . . . . . 96.2 mmm -75.37 2.54 11.04 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 112.896 0.702 . . . . 51.51 112.896 176.983 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 704' ' ' ARG . . . . . 0.513 ' NH1' ' O3 ' ' A' ' 801' ' ' SO4 . 32.6 mtp180 48.78 45.47 21.97 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 113.557 0.947 . . . . 79.0 113.557 179.636 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 705' ' ' PHE . . . . . . . . . . . . . 11.1 m-30 -87.71 144.8 26.45 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.222 -0.445 . . . . 56.53 110.842 177.796 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 706' ' ' SER . . . . . . . . . . . . . 83.9 p -61.06 159.69 11.27 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.685 -0.406 . . . . 47.05 110.016 171.166 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 707' ' ' CYS . . . . . . . . . . . . . 63.4 m -61.2 -38.94 88.37 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.194 0.521 . . . . 53.67 111.798 178.061 -73.378 -66.378 -83.705 103.567 2.055 102.869 -88.679 -174.338 1 1 . 1 . 001 ecloud build full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 65.3 tp60 -67.08 -38.65 86.09 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.843 -0.617 . . . . 83.51 109.589 -179.858 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 61.1 ttt180 -64.76 -40.76 95.82 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.431 -0.508 . . . . 95.42 112.044 -178.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 710' ' ' ARG . . . . . 0.413 ' NH2' ' SG ' ' A' ' 728' ' ' CYS . 65.7 mtm180 -66.86 -15.1 63.4 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 114.507 1.299 . . . . 81.9 114.507 179.968 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 711' ' ' THR . . . . . 0.457 HG22 ' CD1' ' A' ' 724' ' ' PHE . 35.0 p -87.64 -20.42 26.36 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 113.162 0.801 . . . . 80.63 113.162 177.628 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 712' ' ' ARG . . . . . . . . . . . . . 34.8 mtt85 -58.82 -20.86 54.23 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 116.889 2.181 . . . . 102.54 116.889 -166.588 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 713' ' ' PHE . . . . . . . . . . . . . 78.8 m-85 -131.48 20.7 4.74 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 113.849 1.055 . . . . 98.07 113.849 -177.429 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 714' ' ' ILE . . . . . . . . . . . . . 11.7 mt -83.77 -27.73 7.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 C-N-CA 120.313 -0.555 . . . . 102.61 110.59 176.506 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 715' ' ' SER . . . . . . . . . . . . . 76.8 p 53.57 -115.46 0.95 Allowed 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.041 -0.726 . . . . 116.29 109.041 -167.765 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 13.3 tp 61.06 -3.95 0.15 Allowed 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 115.776 1.769 . . . . 114.3 115.776 167.73 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 717' ' ' GLY . . . . . . . . . . . . . . . 130.4 161.27 10.33 Favored Glycine 0 C--O 1.226 -0.367 0 N-CA-C 116.468 1.347 . . . . 95.41 116.468 171.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -81.22 -50.36 9.66 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 122.455 0.302 . . . . 137.65 111.242 176.932 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.93 -24.86 67.65 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 116.182 -0.463 . . . . 84.6 110.348 -179.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 720' ' ' CYS . . . . . . . . . . . . . 45.6 t -80.41 -29.33 37.69 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.701 -0.681 . . . . 93.6 111.886 178.245 178.817 73.304 -106.908 109.224 2.034 108.35 -106.766 -59.178 1 1 . 1 . 001 ecloud build full ' A' A ' 721' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -70.93 -45.65 63.85 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 110.329 -0.249 . . . . 85.18 110.329 176.094 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 722' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -54.76 -41.24 70.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 89.47 111.408 176.573 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 723' ' ' VAL . . . . . . . . . . . . . 34.9 t -65.97 -58.38 6.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.103 -0.499 . . . . 58.83 110.192 179.011 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 724' ' ' PHE . . . . . 0.457 ' CD1' HG22 ' A' ' 711' ' ' THR . 31.6 t80 -44.09 -53.22 6.58 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 123.382 0.673 . . . . 47.05 111.207 175.959 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 12.7 tp -62.84 -42.34 99.7 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.487 -0.778 . . . . 61.13 111.038 -174.62 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 726' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -66.25 -40.46 90.2 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 115.97 -0.559 . . . . 98.6 112.5 -179.485 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 727' ' ' CYS . . . . . . . . . . . . . 93.8 m -76.06 -38.95 56.48 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.826 0.346 . . . . 48.58 110.162 -178.341 -68.678 -148.458 -96.75 111.745 2.045 107.922 60.197 -172.177 1 1 . 1 . 001 ecloud build full ' A' A ' 728' ' ' CYS . . . . . 0.413 ' SG ' ' NH2' ' A' ' 710' ' ' ARG . 48.7 t -57.18 -52.42 65.37 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-N 115.731 -0.668 . . . . 43.37 111.79 173.079 -174.338 -88.679 -83.705 102.869 2.055 103.567 -66.378 -73.378 2 2 . 1 . 001 ecloud build full ' A' A ' 729' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -60.31 -37.32 80.22 Favored 'General case' 0 CA--C 1.504 -0.805 0 N-CA-C 111.606 0.225 . . . . 47.91 111.606 177.247 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 730' ' ' TYR . . . . . 0.454 ' O ' HD23 ' A' ' 734' ' ' LEU . 68.2 t80 -62.64 -53.5 53.55 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.284 -0.417 . . . . 69.86 110.943 177.98 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 731' ' ' ILE . . . . . . . . . . . . . 7.9 tp -72.22 -29.07 30.83 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.241 0 N-CA-C 112.805 0.669 . . . . 49.62 112.805 -176.414 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 732' ' ' THR . . . . . . . . . . . . . 28.9 m -62.35 -47.48 84.02 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 119.709 -0.797 . . . . 48.39 109.223 177.801 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 76.0 tt0 -59.59 -42.04 91.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.326 -0.397 . . . . 96.46 111.786 178.018 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 734' ' ' LEU . . . . . 0.454 HD23 ' O ' ' A' ' 730' ' ' TYR . 3.1 mm? -66.31 -37.91 86.5 Favored 'General case' 0 N--CA 1.468 0.43 0 O-C-N 123.158 0.286 . . . . 62.2 111.391 179.281 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 735' ' ' ARG . . . . . . . . . . . . . 63.9 mtt180 -65.25 -43.29 91.8 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 118.599 -1.241 . . . . 62.02 110.78 177.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 84.8 mtt180 -61.56 -45.18 95.26 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.616 -0.433 . . . . 61.22 111.259 179.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 737' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -61.01 -41.9 97.41 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 119.957 -0.697 . . . . 50.77 110.405 177.981 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 738' ' ' HIS . . . . . . . . . . . . . 13.1 t60 -62.68 -43.43 98.82 Favored 'General case' 0 C--O 1.165 -3.346 0 CA-C-O 118.145 -0.931 . . . . 90.92 112.861 175.782 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 739' ' ' ALA . . . . . . . . . . . . . . . -60.8 -40.66 93.49 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 119.168 0.895 . . . . 38.85 111.369 176.53 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 80.8 mtt180 -65.59 -42.08 92.09 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.726 0.639 . . . . 40.81 112.726 178.509 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -64.28 -42.78 96.26 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 108.788 -0.819 . . . . 30.43 108.788 179.135 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 742' ' ' SER . . . . . . . . . . . . . 33.2 t -62.81 -47.69 82.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.086 -0.506 . . . . 55.85 111.395 178.859 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 743' ' ' HIS . . . . . . . . . . . . . 47.4 t-80 -56.81 -35.79 69.17 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 113.155 0.798 . . . . 34.52 113.155 173.867 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 744' ' ' LEU . . . . . . . . . . . . . 62.6 mt -88.22 1.82 53.62 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 120.152 -0.619 . . . . 34.71 112.018 -176.737 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 745' ' ' GLY . . . . . . . . . . . . . . . 71.6 19.24 77.75 Favored Glycine 0 C--O 1.222 -0.601 0 C-N-CA 120.556 -0.83 . . . . 36.33 112.612 178.113 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 746' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.05 -18.39 26.02 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 108.297 -1.001 . . . . 62.6 108.297 176.523 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 747' ' ' ALA . . . . . . . . . . . . . . . -6.33 114.39 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 116.735 2.124 . . . . 117.02 116.735 179.08 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 748' ' ' ARG . . . . . . . . . . . . . 14.6 mmt85 . . . . . 0 N--CA 1.464 0.232 0 CA-C-O 121.085 0.469 . . . . 103.1 112.17 -176.315 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 672' ' ' SER . . . . . 0.535 ' OG ' ' N ' ' B' ' 673' ' ' VAL . 40.5 t . . . . . 0 C--O 1.233 0.185 0 CA-C-O 120.902 0.382 . . . . 123.37 112.009 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 673' ' ' VAL . . . . . 0.535 ' N ' ' OG ' ' B' ' 672' ' ' SER . 44.0 t -66.58 -70.16 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.857 -0.61 . . . . 121.68 111.807 -176.133 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 674' ' ' GLN . . . . . . . . . . . . . 27.6 mp0 -84.66 -1.36 56.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.176 -0.465 . . . . 130.0 111.389 -179.472 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 675' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -81.63 -38.83 25.36 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.556 -0.293 . . . . 102.34 111.304 179.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 61.0 m -57.0 -32.59 66.27 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.233 0.539 . . . . 123.6 109.629 175.614 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 677' ' ' GLU . . . . . . . . . . . . . 74.7 tt0 -65.15 -59.29 4.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.434 -0.803 . . . . 131.7 112.199 178.988 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 678' ' ' LYS . . . . . . . . . . . . . 15.7 mmmt -60.91 -21.45 63.37 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.282 0.475 . . . . 106.48 112.282 -179.549 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 679' ' ' ARG . . . . . . . . . . . . . 14.5 mtm180 -71.52 -45.5 62.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.679 -0.237 . . . . 101.43 110.978 175.273 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 680' ' ' MET . . . . . . . . . . . . . 83.4 mmm -63.01 -43.76 97.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.192 -0.458 . . . . 111.85 109.78 179.625 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 681' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -58.4 -40.46 82.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.938 -0.574 . . . . 99.81 110.493 178.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 682' ' ' LYS . . . . . . . . . . . . . 19.5 tptt -70.73 -48.65 53.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.2 -0.455 . . . . 71.14 111.19 -178.158 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 683' ' ' VAL . . . . . . . . . . . . . 12.6 t -56.01 -40.38 63.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.357 -0.383 . . . . 77.43 111.151 176.985 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 684' ' ' GLY . . . . . . . . . . . . . . . -57.89 -31.97 65.49 Favored Glycine 0 CA--C 1.521 0.441 0 CA-C-N 116.475 -0.329 . . . . 99.51 113.768 176.904 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 685' ' ' LYS . . . . . . . . . . . . . 2.1 mptm? -62.33 -8.52 6.04 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 115.171 1.545 . . . . 86.47 115.171 -176.835 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 686' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -114.62 153.39 46.76 Favored Pre-proline 0 CA--C 1.51 -0.573 0 N-CA-C 112.974 0.731 . . . . 75.57 112.974 -170.428 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 687' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -48.14 142.44 16.09 Favored 'Trans proline' 0 CA--C 1.516 -0.417 0 C-N-CA 122.986 2.458 . . . . 90.17 109.293 171.548 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 688' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -56.37 -25.13 48.43 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 114.589 1.329 . . . . 103.43 114.589 -165.13 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 689' ' ' GLU . . . . . . . . . . . . . 16.3 pm0 -98.73 9.05 44.2 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 112.994 0.739 . . . . 99.34 112.994 -176.124 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 690' ' ' LEU . . . . . . . . . . . . . 52.3 mt -117.18 13.1 14.62 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.772 -0.455 . . . . 73.84 109.772 177.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 691' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -80.11 -31.99 39.13 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.495 0.554 . . . . 88.91 112.495 -177.282 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 692' ' ' LYS . . . . . . . . . . . . . 22.0 tttt -61.41 -40.85 95.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.863 0.363 . . . . 106.69 110.249 173.489 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 693' ' ' CYS . . . . . . . . . . . . . 85.8 m -62.65 -40.22 96.35 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 116.107 -0.497 . . . . 100.22 111.17 179.583 -59.591 -106.92 -106.745 108.209 2.032 109.201 73.84 178.584 1 1 . 1 . 001 ecloud build full ' B' B ' 694' ' ' CYS . . . . . . . . . . . . . 37.4 t -69.01 -52.92 23.69 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.51 -0.768 . . . . 63.34 109.84 -179.755 -171.949 58.861 -97.153 107.117 2.045 112.899 -147.324 -68.681 1 1 . 1 . 001 ecloud build full ' B' B ' 695' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -47.15 -53.48 12.89 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.055 0.942 . . . . 91.51 113.197 174.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 696' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -66.77 -23.66 66.1 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 120.973 0.416 . . . . 87.88 111.903 -179.312 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 697' ' ' GLY . . . . . . . . . . . . . . . -71.16 -18.94 76.97 Favored Glycine 0 C--O 1.217 -0.914 0 N-CA-C 109.891 -1.284 . . . . 53.5 109.891 179.215 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 698' ' ' MET . . . . . . . . . . . . . 65.6 mtm -110.75 16.42 21.37 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 114.768 1.396 . . . . 49.75 114.768 -173.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 699' ' ' ARG . . . . . . . . . . . . . 47.1 mtp180 -77.36 160.86 28.48 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 119.758 -0.777 . . . . 122.4 109.107 179.082 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 700' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -52.08 158.07 1.18 Allowed 'General case' 0 C--O 1.224 -0.274 0 CA-C-N 116.6 -0.273 . . . . 119.18 111.629 179.335 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 701' ' ' ASN . . . . . . . . . . . . . 57.1 t30 -128.21 67.69 75.4 Favored Pre-proline 0 CA--C 1.537 0.462 0 CA-C-N 116.475 -0.329 . . . . 48.35 111.795 -173.021 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 702' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -67.52 -31.19 34.37 Favored 'Trans proline' 0 CA--C 1.536 0.623 0 C-N-CA 118.132 -0.779 . . . . 49.71 113.693 -174.238 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 703' ' ' MET . . . . . . . . . . . . . 96.3 mmm -76.32 2.24 13.93 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 112.671 0.619 . . . . 50.76 112.671 177.564 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 704' ' ' ARG . . . . . 0.452 ' NH1' ' O1 ' ' B' ' 801' ' ' SO4 . 31.4 mtp180 48.93 45.72 22.43 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.286 0.847 . . . . 78.48 113.286 179.766 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 705' ' ' PHE . . . . . . . . . . . . . 10.6 m-30 -88.06 145.08 26.15 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.198 -0.455 . . . . 56.58 110.71 177.68 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 706' ' ' SER . . . . . . . . . . . . . 81.5 p -61.54 160.67 10.83 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 109.775 -0.454 . . . . 48.06 109.775 171.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 707' ' ' CYS . . . . . . . . . . . . . 63.2 m -62.52 -38.43 89.91 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.229 0.538 . . . . 53.44 111.647 178.707 -73.442 -66.778 -83.202 103.513 2.062 103.012 -88.392 -175.179 1 1 . 1 . 001 ecloud build full ' B' B ' 708' ' ' GLN . . . . . . . . . . . . . 65.0 tp60 -66.4 -39.8 89.22 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.733 -0.667 . . . . 83.25 109.682 179.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 -64.35 -41.45 96.75 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.798 -0.361 . . . . 95.59 111.862 -177.476 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 710' ' ' ARG . . . . . 0.415 ' NH2' ' SG ' ' B' ' 728' ' ' CYS . 66.3 mtm180 -65.92 -15.31 62.85 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 114.707 1.373 . . . . 82.12 114.707 179.344 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 711' ' ' THR . . . . . 0.459 HG22 ' CD1' ' B' ' 724' ' ' PHE . 32.4 p -87.01 -20.34 27.37 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 113.335 0.865 . . . . 80.37 113.335 177.1 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 712' ' ' ARG . . . . . . . . . . . . . 35.5 mtt85 -59.57 -20.24 54.26 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 116.764 2.135 . . . . 102.09 116.764 -165.731 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 713' ' ' PHE . . . . . . . . . . . . . 78.9 m-85 -131.88 20.61 4.57 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 113.685 0.994 . . . . 97.95 113.685 -177.099 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 714' ' ' ILE . . . . . . . . . . . . . 11.3 mt -83.98 -27.4 7.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 C-N-CA 120.43 -0.508 . . . . 102.19 110.551 176.526 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 715' ' ' SER . . . . . . . . . . . . . 76.7 p 53.39 -115.45 0.95 Allowed 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 109.027 -0.731 . . . . 116.45 109.027 -167.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 716' ' ' LEU . . . . . . . . . . . . . 13.4 tp 61.11 -4.18 0.15 Allowed 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 115.786 1.772 . . . . 114.2 115.786 167.716 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 717' ' ' GLY . . . . . . . . . . . . . . . 130.39 161.12 10.28 Favored Glycine 0 C--O 1.225 -0.407 0 N-CA-C 116.584 1.394 . . . . 95.91 116.584 171.906 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 718' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -80.88 -50.64 9.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.614 -0.293 . . . . 137.7 111.209 177.047 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.66 -25.07 67.79 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 116.184 -0.462 . . . . 84.05 110.432 -179.736 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 720' ' ' CYS . . . . . . . . . . . . . 44.1 t -80.26 -29.53 38.36 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.749 -0.659 . . . . 92.82 111.768 178.224 178.584 73.84 -106.745 109.201 2.032 108.209 -106.92 -59.591 1 1 . 1 . 001 ecloud build full ' B' B ' 721' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -70.72 -45.08 65.57 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 110.332 -0.247 . . . . 85.43 110.332 176.285 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 722' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -55.68 -41.03 73.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.973 0.416 . . . . 89.49 111.364 176.94 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 723' ' ' VAL . . . . . . . . . . . . . 36.2 t -65.73 -58.17 7.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.045 -0.525 . . . . 59.61 110.161 178.802 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 724' ' ' PHE . . . . . 0.459 ' CD1' HG22 ' B' ' 711' ' ' THR . 33.0 t80 -44.66 -52.37 8.28 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 123.499 0.72 . . . . 48.34 111.189 176.318 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 725' ' ' LEU . . . . . . . . . . . . . 13.1 tp -64.03 -41.41 97.44 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.349 -0.842 . . . . 60.81 110.666 -174.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 726' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -67.41 -39.45 85.5 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 116.026 -0.534 . . . . 98.92 112.322 -179.021 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 727' ' ' CYS . . . . . . . . . . . . . 93.8 m -76.99 -38.2 53.61 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 109.787 -0.449 . . . . 47.36 109.787 -177.918 -68.681 -147.324 -97.153 112.899 2.045 107.117 58.861 -171.949 1 1 . 1 . 001 ecloud build full ' B' B ' 728' ' ' CYS . . . . . 0.415 ' SG ' ' NH2' ' B' ' 710' ' ' ARG . 44.6 t -58.46 -51.9 67.92 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 115.621 -0.718 . . . . 41.9 111.451 173.878 -175.179 -88.392 -83.202 103.012 2.062 103.513 -66.778 -73.442 2 2 . 1 . 001 ecloud build full ' B' B ' 729' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -60.08 -38.24 82.3 Favored 'General case' 0 CA--C 1.503 -0.862 0 N-CA-C 111.677 0.251 . . . . 47.8 111.677 176.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 730' ' ' TYR . . . . . 0.472 ' O ' HD23 ' B' ' 734' ' ' LEU . 70.8 t80 -61.69 -53.44 56.09 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 116.376 -0.375 . . . . 69.6 111.631 177.515 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 731' ' ' ILE . . . . . . . . . . . . . 7.9 tp -72.48 -28.65 28.8 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 N-CA-C 112.57 0.582 . . . . 49.86 112.57 -176.472 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 732' ' ' THR . . . . . . . . . . . . . 30.7 m -63.27 -46.87 84.81 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 119.789 -0.764 . . . . 47.03 109.189 178.237 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 733' ' ' GLU . . . . . . . . . . . . . 75.9 tt0 -59.83 -41.27 90.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.107 -0.497 . . . . 96.24 111.856 177.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 734' ' ' LEU . . . . . 0.472 HD23 ' O ' ' B' ' 730' ' ' TYR . 3.3 mm? -67.76 -37.62 82.34 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 123.121 0.263 . . . . 62.01 110.662 -179.428 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 735' ' ' ARG . . . . . . . . . . . . . 64.0 mtt180 -65.35 -43.26 91.41 Favored 'General case' 0 C--O 1.224 -0.287 0 C-N-CA 118.898 -1.121 . . . . 61.46 110.808 177.167 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 736' ' ' ARG . . . . . . . . . . . . . 85.6 mtt180 -61.75 -44.32 97.13 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.595 -0.442 . . . . 61.22 111.466 179.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 737' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -61.79 -41.39 97.68 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 119.83 -0.748 . . . . 50.85 110.276 178.034 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 738' ' ' HIS . . . . . . . . . . . . . 66.1 t-80 -63.19 -43.47 98.12 Favored 'General case' 0 C--O 1.166 -3.327 0 CA-C-O 118.941 -0.552 . . . . 90.82 112.287 176.064 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 739' ' ' ALA . . . . . . . . . . . . . . . -60.92 -40.57 93.68 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 118.936 0.789 . . . . 37.58 111.332 177.259 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 80.6 mtt180 -65.59 -41.65 92.6 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.664 0.616 . . . . 40.03 112.664 178.365 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 741' ' ' ALA . . . . . . . . . . . . . . . -64.29 -43.72 93.89 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 108.601 -0.889 . . . . 30.47 108.601 179.168 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 742' ' ' SER . . . . . . . . . . . . . 32.6 t -62.2 -47.05 86.2 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.81 -0.632 . . . . 55.35 111.505 178.823 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 743' ' ' HIS . . . . . 0.419 ' HE1' ' O ' ' B' ' 904' ' ' HOH . 47.1 t-80 -58.17 -35.31 71.39 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 113.09 0.774 . . . . 34.76 113.09 174.502 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 744' ' ' LEU . . . . . . . . . . . . . 70.8 mt -88.09 0.37 56.08 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 120.101 -0.64 . . . . 35.86 111.874 -177.248 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 745' ' ' GLY . . . . . . . . . . . . . . . 73.38 20.71 79.94 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.538 -0.839 . . . . 35.54 112.845 177.926 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 746' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -89.4 -22.28 22.64 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 109.741 -0.466 . . . . 57.51 109.741 176.259 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 747' ' ' ALA . . . . . . . . . . . . . . . -5.36 115.5 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 117.139 2.274 . . . . 116.77 117.139 -178.056 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 748' ' ' ARG . . . . . 0.857 ' HG2' HH11 ' B' ' 748' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.285 2.93 0 C-N-CA 119.199 -1.0 . . . . 108.9 112.157 -171.041 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' A' A ' 801' ' ' SO4 . . . . . 0.513 ' O3 ' ' NH1' ' A' ' 704' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 801' ' ' SO4 . . . . . 0.452 ' O1 ' ' NH1' ' B' ' 704' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 901' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 902' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 903' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 904' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 905' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 906' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 907' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 908' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 909' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 910' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 911' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 912' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 913' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 914' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 915' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 916' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' A' A ' 917' ' ' HOH . . . . . 0.517 ' O ' ' N ' ' A' ' 672' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' A' A ' 918' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 901' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 902' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 903' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 904' ' ' HOH . . . . . 0.419 ' O ' ' HE1' ' B' ' 743' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 905' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 906' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 907' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 908' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 909' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 910' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 911' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 912' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 913' ' ' HOH . . . . . 0.438 ' O ' ' HD2' ' B' ' 748' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 914' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 915' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 916' ' ' HOH . . . . . 0.481 ' O ' ' N ' ' B' ' 672' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 672' ' ' SER . . . . . 0.517 ' N ' ' O ' ' A' ' 917' ' ' HOH . 40.0 t . . . . . 0 C--O 1.233 0.2 0 N-CA-C 112.124 0.416 . . . . 119.5 112.124 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 673' ' ' VAL . . . . . 0.513 ' N ' ' OG ' ' A' ' 672' ' ' SER . 47.8 t -63.05 -72.1 0.1 Allowed 'Isoleucine or valine' 0 C--O 1.234 0.244 0 CA-C-N 115.845 -0.616 . . . . 119.32 112.413 -174.706 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 674' ' ' GLN . . . . . 0.504 HE22 ' HD2' ' A' ' 738' ' ' HIS . 5.7 pm0 -86.77 -2.91 58.93 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.468 -0.333 . . . . 120.49 111.448 -179.251 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 675' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -73.83 -38.87 64.38 Favored 'General case' 0 N--CA 1.464 0.25 0 CA-C-N 116.562 -0.29 . . . . 102.15 111.082 176.93 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 676' ' ' THR . . . . . . . . . . . . . 60.7 m -57.22 -32.47 66.54 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 109.546 -0.539 . . . . 124.84 109.546 175.663 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 677' ' ' GLU . . . . . . . . . . . . . 74.0 tt0 -65.75 -59.07 4.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 115.511 -0.768 . . . . 131.73 111.959 179.539 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 678' ' ' LYS . . . . . . . . . . . . . 15.9 mmmt -60.64 -21.45 62.76 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 112.334 0.494 . . . . 106.45 112.334 -179.871 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 679' ' ' ARG . . . . . . . . . . . . . 14.6 mtm180 -72.11 -45.33 61.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.651 0.262 . . . . 101.44 110.876 175.545 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 680' ' ' MET . . . . . . . . . . . . . 84.2 mmm -62.53 -44.13 97.12 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.188 -0.46 . . . . 110.89 110.049 179.022 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 681' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -58.42 -40.38 82.34 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 115.817 -0.629 . . . . 99.56 110.429 178.63 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 682' ' ' LYS . . . . . . . . . . . . . 19.2 tptt -70.42 -48.81 54.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.234 -0.439 . . . . 70.06 111.279 -178.268 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 683' ' ' VAL . . . . . . . . . . . . . 13.0 t -55.75 -40.21 59.81 Favored 'Isoleucine or valine' 0 C--O 1.235 0.306 0 CA-C-N 116.308 -0.405 . . . . 78.49 111.142 176.976 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 684' ' ' GLY . . . . . . . . . . . . . . . -58.57 -31.8 67.76 Favored Glycine 0 CA--C 1.52 0.369 0 C-N-CA 121.555 -0.355 . . . . 99.04 113.553 177.261 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 685' ' ' LYS . . . . . . . . . . . . . 2.1 mptm? -62.06 -8.4 5.33 Favored 'General case' 0 CA--C 1.532 0.281 0 N-CA-C 115.264 1.579 . . . . 85.78 115.264 -176.962 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 686' ' ' TYR . . . . . . . . . . . . . 91.8 m-85 -114.98 153.23 47.08 Favored Pre-proline 0 CA--C 1.509 -0.598 0 N-CA-C 112.961 0.726 . . . . 75.05 112.961 -170.2 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 687' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_exo -47.93 142.91 14.38 Favored 'Trans proline' 0 CA--C 1.517 -0.372 0 C-N-CA 122.935 2.424 . . . . 89.96 109.257 171.591 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 688' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -56.91 -24.99 56.31 Favored 'General case' 0 C--N 1.325 -0.492 0 N-CA-C 114.584 1.327 . . . . 103.79 114.584 -165.08 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 689' ' ' GLU . . . . . . . . . . . . . 16.2 pm0 -98.6 8.86 44.4 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 113.063 0.764 . . . . 99.52 113.063 -176.205 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 690' ' ' LEU . . . . . . . . . . . . . 50.5 mt -117.21 12.93 14.56 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 109.833 -0.432 . . . . 73.01 109.833 177.369 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 691' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -80.0 -32.28 39.67 Favored 'General case' 0 C--N 1.328 -0.365 0 N-CA-C 112.755 0.65 . . . . 89.39 112.755 -177.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 692' ' ' LYS . . . . . . . . . . . . . 22.3 tttt -60.77 -41.43 95.48 Favored 'General case' 0 C--N 1.33 -0.245 0 CA-C-O 120.879 0.371 . . . . 106.88 110.401 172.788 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 693' ' ' CYS . . . . . . . . . . . . . 81.3 m -62.15 -40.57 96.43 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-O 121.328 0.585 . . . . 99.89 111.231 179.452 -59.178 -106.766 -106.908 108.35 2.034 109.224 73.304 178.817 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 694' ' ' CYS . . . . . . . . . . . . . 38.1 t -68.86 -52.64 27.56 Favored 'General case' 0 N--CA 1.451 -0.4 0 CA-C-N 115.57 -0.741 . . . . 61.71 109.91 -179.671 -172.177 60.197 -96.75 107.922 2.045 111.745 -148.458 -68.678 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 695' ' ' GLU . . . . . . . . . . . . . 29.0 tt0 -47.1 -53.49 12.67 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.11 0.964 . . . . 91.12 113.185 174.728 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 696' ' ' ASP . . . . . . . . . . . . . 79.7 m-20 -66.93 -24.22 66.06 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-O 121.004 0.431 . . . . 87.98 111.964 -179.414 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 697' ' ' GLY . . . . . . . . . . . . . . . -70.44 -18.11 75.06 Favored Glycine 0 C--O 1.219 -0.801 0 N-CA-C 110.565 -1.014 . . . . 52.75 110.565 178.047 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 698' ' ' MET . . . . . . . . . . . . . 66.7 mtm -111.72 16.38 20.55 Favored 'General case' 0 C--N 1.325 -0.491 0 N-CA-C 114.611 1.337 . . . . 48.6 114.611 -173.815 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 699' ' ' ARG . . . . . . . . . . . . . 47.1 mtp180 -76.92 161.37 28.45 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 119.744 -0.782 . . . . 122.23 109.359 178.927 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 700' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -53.32 157.81 1.86 Allowed 'General case' 0 C--O 1.219 -0.531 0 CA-C-N 116.712 -0.222 . . . . 119.11 111.368 179.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 701' ' ' ASN . . . . . . . . . . . . . 56.5 t30 -127.96 68.3 75.37 Favored Pre-proline 0 CA--C 1.537 0.468 0 CA-C-O 120.643 0.259 . . . . 48.36 111.488 -173.004 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 702' ' ' PRO . . . . . . . . . . . . . 29.6 Cg_endo -67.73 -32.01 31.11 Favored 'Trans proline' 0 CA--C 1.54 0.795 0 C-N-CA 118.197 -0.735 . . . . 49.17 113.636 -174.353 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 703' ' ' MET . . . . . . . . . . . . . 96.2 mmm -75.37 2.54 11.04 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 112.896 0.702 . . . . 51.51 112.896 176.983 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 704' ' ' ARG . . . . . 0.513 ' NH1' ' O3 ' ' A' ' 801' ' ' SO4 . 32.6 mtp180 48.78 45.47 21.97 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 113.557 0.947 . . . . 79.0 113.557 179.636 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 705' ' ' PHE . . . . . . . . . . . . . 11.1 m-30 -87.71 144.8 26.45 Favored 'General case' 0 C--N 1.323 -0.554 0 CA-C-N 116.222 -0.445 . . . . 56.53 110.842 177.796 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 706' ' ' SER . . . . . . . . . . . . . 83.9 p -61.06 159.69 11.27 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.685 -0.406 . . . . 47.05 110.016 171.166 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 707' ' ' CYS . . . . . . . . . . . . . 63.4 m -61.2 -38.94 88.37 Favored 'General case' 0 C--O 1.234 0.264 0 CA-C-O 121.194 0.521 . . . . 53.67 111.798 178.061 -73.378 -66.378 -83.705 103.567 2.055 102.869 -88.679 -174.338 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 708' ' ' GLN . . . . . . . . . . . . . 65.3 tp60 -67.08 -38.65 86.09 Favored 'General case' 0 C--N 1.326 -0.429 0 CA-C-N 115.843 -0.617 . . . . 83.51 109.589 -179.858 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 709' ' ' ARG . . . . . . . . . . . . . 61.1 ttt180 -64.76 -40.76 95.82 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.431 -0.508 . . . . 95.42 112.044 -178.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 710' ' ' ARG . . . . . 0.413 ' NH2' ' SG ' ' A' ' 728' ' ' CYS . 65.7 mtm180 -66.86 -15.1 63.4 Favored 'General case' 0 CA--C 1.538 0.507 0 N-CA-C 114.507 1.299 . . . . 81.9 114.507 179.968 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 711' ' ' THR . . . . . 0.457 HG22 ' CD1' ' A' ' 724' ' ' PHE . 35.0 p -87.64 -20.42 26.36 Favored 'General case' 0 C--N 1.328 -0.357 0 N-CA-C 113.162 0.801 . . . . 80.63 113.162 177.628 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 712' ' ' ARG . . . . . . . . . . . . . 34.8 mtt85 -58.82 -20.86 54.23 Favored 'General case' 0 N--CA 1.465 0.319 0 N-CA-C 116.889 2.181 . . . . 102.54 116.889 -166.588 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 713' ' ' PHE . . . . . . . . . . . . . 78.8 m-85 -131.48 20.7 4.74 Favored 'General case' 0 C--N 1.326 -0.445 0 N-CA-C 113.849 1.055 . . . . 98.07 113.849 -177.429 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 714' ' ' ILE . . . . . . . . . . . . . 11.7 mt -83.77 -27.73 7.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 C-N-CA 120.313 -0.555 . . . . 102.61 110.59 176.506 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 715' ' ' SER . . . . . . . . . . . . . 76.8 p 53.57 -115.46 0.95 Allowed 'General case' 0 C--N 1.332 -0.185 0 N-CA-C 109.041 -0.726 . . . . 116.29 109.041 -167.765 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 716' ' ' LEU . . . . . . . . . . . . . 13.3 tp 61.06 -3.95 0.15 Allowed 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 115.776 1.769 . . . . 114.3 115.776 167.73 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 717' ' ' GLY . . . . . . . . . . . . . . . 130.4 161.27 10.33 Favored Glycine 0 C--O 1.226 -0.367 0 N-CA-C 116.468 1.347 . . . . 95.41 116.468 171.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 718' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -81.22 -50.36 9.66 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 122.455 0.302 . . . . 137.65 111.242 176.932 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.93 -24.86 67.65 Favored 'General case' 0 CA--C 1.521 -0.16 0 CA-C-N 116.182 -0.463 . . . . 84.6 110.348 -179.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 720' ' ' CYS . . . . . . . . . . . . . 45.6 t -80.41 -29.33 37.69 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 115.701 -0.681 . . . . 93.6 111.886 178.245 178.817 73.304 -106.908 109.224 2.034 108.35 -106.766 -59.178 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 721' ' ' LYS . . . . . . . . . . . . . 86.2 mttt -70.93 -45.65 63.85 Favored 'General case' 0 C--N 1.329 -0.292 0 N-CA-C 110.329 -0.249 . . . . 85.18 110.329 176.094 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 722' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -54.76 -41.24 70.22 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.26 -0.427 . . . . 89.47 111.408 176.573 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 723' ' ' VAL . . . . . . . . . . . . . 34.9 t -65.97 -58.38 6.96 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-N 116.103 -0.499 . . . . 58.83 110.192 179.011 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 724' ' ' PHE . . . . . 0.457 ' CD1' HG22 ' A' ' 711' ' ' THR . 31.6 t80 -44.09 -53.22 6.58 Favored 'General case' 0 C--N 1.331 -0.214 0 C-N-CA 123.382 0.673 . . . . 47.05 111.207 175.959 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 725' ' ' LEU . . . . . . . . . . . . . 12.7 tp -62.84 -42.34 99.7 Favored 'General case' 0 C--N 1.325 -0.494 0 CA-C-N 115.487 -0.778 . . . . 61.13 111.038 -174.62 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 726' ' ' ASP . . . . . . . . . . . . . 28.1 t0 -66.25 -40.46 90.2 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 115.97 -0.559 . . . . 98.6 112.5 -179.485 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 727' ' ' CYS . . . . . . . . . . . . . 93.8 m -76.06 -38.95 56.48 Favored 'General case' 0 C--O 1.233 0.231 0 CA-C-O 120.826 0.346 . . . . 48.58 110.162 -178.341 -68.678 -148.458 -96.75 111.745 2.045 107.922 60.197 -172.177 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 728' ' ' CYS . . . . . 0.413 ' SG ' ' NH2' ' A' ' 710' ' ' ARG . 48.7 t -57.18 -52.42 65.37 Favored 'General case' 0 C--O 1.221 -0.411 0 CA-C-N 115.731 -0.668 . . . . 43.37 111.79 173.079 -174.338 -88.679 -83.705 102.869 2.055 103.567 -66.378 -73.378 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 729' ' ' ASN . . . . . . . . . . . . . 88.1 m-20 -60.31 -37.32 80.22 Favored 'General case' 0 CA--C 1.504 -0.805 0 N-CA-C 111.606 0.225 . . . . 47.91 111.606 177.247 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 730' ' ' TYR . . . . . 0.454 ' O ' HD23 ' A' ' 734' ' ' LEU . 68.2 t80 -62.64 -53.5 53.55 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 116.284 -0.417 . . . . 69.86 110.943 177.98 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 731' ' ' ILE . . . . . . . . . . . . . 7.9 tp -72.22 -29.07 30.83 Favored 'Isoleucine or valine' 0 C--O 1.224 -0.241 0 N-CA-C 112.805 0.669 . . . . 49.62 112.805 -176.414 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 732' ' ' THR . . . . . . . . . . . . . 28.9 m -62.35 -47.48 84.02 Favored 'General case' 0 C--O 1.221 -0.405 0 C-N-CA 119.709 -0.797 . . . . 48.39 109.223 177.801 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 733' ' ' GLU . . . . . . . . . . . . . 76.0 tt0 -59.59 -42.04 91.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.326 -0.397 . . . . 96.46 111.786 178.018 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 734' ' ' LEU . . . . . 0.454 HD23 ' O ' ' A' ' 730' ' ' TYR . 3.1 mm? -66.31 -37.91 86.5 Favored 'General case' 0 N--CA 1.468 0.43 0 O-C-N 123.158 0.286 . . . . 62.2 111.391 179.281 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 735' ' ' ARG . . . . . . . . . . . . . 63.9 mtt180 -65.25 -43.29 91.8 Favored 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 118.599 -1.241 . . . . 62.02 110.78 177.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 736' ' ' ARG . . . . . . . . . . . . . 84.8 mtt180 -61.56 -45.18 95.26 Favored 'General case' 0 C--N 1.329 -0.306 0 C-N-CA 120.616 -0.433 . . . . 61.22 111.259 179.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 737' ' ' GLN . . . . . . . . . . . . . 89.1 mt-30 -61.01 -41.9 97.41 Favored 'General case' 0 C--N 1.329 -0.285 0 C-N-CA 119.957 -0.697 . . . . 50.77 110.405 177.981 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 738' ' ' HIS . . . . . 0.504 ' HD2' HE22 ' A' ' 674' ' ' GLN . 65.6 t-80 -62.68 -43.43 98.82 Favored 'General case' 0 C--O 1.165 -3.346 0 CA-C-O 118.145 -0.931 . . . . 90.92 112.861 175.782 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 739' ' ' ALA . . . . . . . . . . . . . . . -60.8 -40.66 93.49 Favored 'General case' 0 C--N 1.323 -0.553 0 CA-C-N 119.168 0.895 . . . . 38.85 111.369 176.53 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 740' ' ' ARG . . . . . . . . . . . . . 80.8 mtt180 -65.59 -42.08 92.09 Favored 'General case' 0 C--N 1.325 -0.49 0 N-CA-C 112.726 0.639 . . . . 40.81 112.726 178.509 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 741' ' ' ALA . . . . . . . . . . . . . . . -64.28 -42.78 96.26 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 108.788 -0.819 . . . . 30.43 108.788 179.135 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 742' ' ' SER . . . . . . . . . . . . . 33.2 t -62.81 -47.69 82.35 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.086 -0.506 . . . . 55.85 111.395 178.859 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 743' ' ' HIS . . . . . . . . . . . . . 47.4 t-80 -56.81 -35.79 69.17 Favored 'General case' 0 C--N 1.326 -0.448 0 N-CA-C 113.155 0.798 . . . . 34.52 113.155 173.867 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 744' ' ' LEU . . . . . . . . . . . . . 62.6 mt -88.22 1.82 53.62 Favored 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 120.152 -0.619 . . . . 34.71 112.018 -176.737 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 745' ' ' GLY . . . . . . . . . . . . . . . 71.6 19.24 77.75 Favored Glycine 0 C--O 1.222 -0.601 0 C-N-CA 120.556 -0.83 . . . . 36.33 112.612 178.113 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 746' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -90.05 -18.39 26.02 Favored 'General case' 0 CA--C 1.509 -0.61 0 N-CA-C 108.297 -1.001 . . . . 62.6 108.297 176.523 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 747' ' ' ALA . . . . . . . . . . . . . . . -6.33 114.39 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 116.735 2.124 . . . . 117.02 116.735 179.08 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 748' ' ' ARG . . . . . . . . . . . . . 14.6 mmt85 . . . . . 0 N--CA 1.464 0.232 0 CA-C-O 121.085 0.469 . . . . 103.1 112.17 -176.315 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 672' ' ' SER . . . . . 0.535 ' OG ' ' N ' ' B' ' 673' ' ' VAL . 40.5 t . . . . . 0 C--O 1.233 0.185 0 CA-C-O 120.902 0.382 . . . . 123.37 112.009 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 673' ' ' VAL . . . . . 0.535 ' N ' ' OG ' ' B' ' 672' ' ' SER . 44.0 t -66.58 -70.16 0.21 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.263 0 CA-C-N 115.857 -0.61 . . . . 121.68 111.807 -176.133 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 674' ' ' GLN . . . . . . . . . . . . . 27.6 mp0 -84.66 -1.36 56.0 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.176 -0.465 . . . . 130.0 111.389 -179.472 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 675' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -81.63 -38.83 25.36 Favored 'General case' 0 N--CA 1.465 0.276 0 CA-C-N 116.556 -0.293 . . . . 102.34 111.304 179.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 676' ' ' THR . . . . . . . . . . . . . 61.0 m -57.0 -32.59 66.27 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.233 0.539 . . . . 123.6 109.629 175.614 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 677' ' ' GLU . . . . . . . . . . . . . 74.7 tt0 -65.15 -59.29 4.26 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 115.434 -0.803 . . . . 131.7 112.199 178.988 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 678' ' ' LYS . . . . . . . . . . . . . 15.7 mmmt -60.91 -21.45 63.37 Favored 'General case' 0 C--N 1.326 -0.425 0 N-CA-C 112.282 0.475 . . . . 106.48 112.282 -179.549 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 679' ' ' ARG . . . . . . . . . . . . . 14.5 mtm180 -71.52 -45.5 62.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.679 -0.237 . . . . 101.43 110.978 175.273 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 680' ' ' MET . . . . . . . . . . . . . 83.4 mmm -63.01 -43.76 97.88 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.192 -0.458 . . . . 111.85 109.78 179.625 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 681' ' ' ASP . . . . . . . . . . . . . 5.1 m-20 -58.4 -40.46 82.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 115.938 -0.574 . . . . 99.81 110.493 178.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 682' ' ' LYS . . . . . . . . . . . . . 19.5 tptt -70.73 -48.65 53.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.2 -0.455 . . . . 71.14 111.19 -178.158 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 683' ' ' VAL . . . . . . . . . . . . . 12.6 t -56.01 -40.38 63.03 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.357 -0.383 . . . . 77.43 111.151 176.985 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 684' ' ' GLY . . . . . . . . . . . . . . . -57.89 -31.97 65.49 Favored Glycine 0 CA--C 1.521 0.441 0 CA-C-N 116.475 -0.329 . . . . 99.51 113.768 176.904 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 685' ' ' LYS . . . . . . . . . . . . . 2.1 mptm? -62.33 -8.52 6.04 Favored 'General case' 0 N--CA 1.465 0.287 0 N-CA-C 115.171 1.545 . . . . 86.47 115.171 -176.835 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 686' ' ' TYR . . . . . . . . . . . . . 92.1 m-85 -114.62 153.39 46.76 Favored Pre-proline 0 CA--C 1.51 -0.573 0 N-CA-C 112.974 0.731 . . . . 75.57 112.974 -170.428 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 687' ' ' PRO . . . . . . . . . . . . . 86.4 Cg_exo -48.14 142.44 16.09 Favored 'Trans proline' 0 CA--C 1.516 -0.417 0 C-N-CA 122.986 2.458 . . . . 90.17 109.293 171.548 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 688' ' ' LYS . . . . . . . . . . . . . 2.2 mppt? -56.37 -25.13 48.43 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 114.589 1.329 . . . . 103.43 114.589 -165.13 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 689' ' ' GLU . . . . . . . . . . . . . 16.3 pm0 -98.73 9.05 44.2 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 112.994 0.739 . . . . 99.34 112.994 -176.124 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 690' ' ' LEU . . . . . . . . . . . . . 52.3 mt -117.18 13.1 14.62 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 109.772 -0.455 . . . . 73.84 109.772 177.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 691' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -80.11 -31.99 39.13 Favored 'General case' 0 C--N 1.327 -0.385 0 N-CA-C 112.495 0.554 . . . . 88.91 112.495 -177.282 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 692' ' ' LYS . . . . . . . . . . . . . 22.0 tttt -61.41 -40.85 95.9 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-O 120.863 0.363 . . . . 106.69 110.249 173.489 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 693' ' ' CYS . . . . . . . . . . . . . 85.8 m -62.65 -40.22 96.35 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-N 116.107 -0.497 . . . . 100.22 111.17 179.583 -59.591 -106.92 -106.745 108.209 2.032 109.201 73.84 178.584 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 694' ' ' CYS . . . . . . . . . . . . . 37.4 t -69.01 -52.92 23.69 Favored 'General case' 0 N--CA 1.451 -0.41 0 CA-C-N 115.51 -0.768 . . . . 63.34 109.84 -179.755 -171.949 58.861 -97.153 107.117 2.045 112.899 -147.324 -68.681 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 695' ' ' GLU . . . . . . . . . . . . . 29.2 tt0 -47.15 -53.48 12.89 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 124.055 0.942 . . . . 91.51 113.197 174.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 696' ' ' ASP . . . . . . . . . . . . . 79.3 m-20 -66.77 -23.66 66.1 Favored 'General case' 0 C--O 1.236 0.362 0 CA-C-O 120.973 0.416 . . . . 87.88 111.903 -179.312 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 697' ' ' GLY . . . . . . . . . . . . . . . -71.16 -18.94 76.97 Favored Glycine 0 C--O 1.217 -0.914 0 N-CA-C 109.891 -1.284 . . . . 53.5 109.891 179.215 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 698' ' ' MET . . . . . . . . . . . . . 65.6 mtm -110.75 16.42 21.37 Favored 'General case' 0 C--N 1.326 -0.423 0 N-CA-C 114.768 1.396 . . . . 49.75 114.768 -173.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 699' ' ' ARG . . . . . . . . . . . . . 47.1 mtp180 -77.36 160.86 28.48 Favored 'General case' 0 C--N 1.327 -0.407 0 C-N-CA 119.758 -0.777 . . . . 122.4 109.107 179.082 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 700' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -52.08 158.07 1.18 Allowed 'General case' 0 C--O 1.224 -0.274 0 CA-C-N 116.6 -0.273 . . . . 119.18 111.629 179.335 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 701' ' ' ASN . . . . . . . . . . . . . 57.1 t30 -128.21 67.69 75.4 Favored Pre-proline 0 CA--C 1.537 0.462 0 CA-C-N 116.475 -0.329 . . . . 48.35 111.795 -173.021 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 702' ' ' PRO . . . . . . . . . . . . . 29.2 Cg_endo -67.52 -31.19 34.37 Favored 'Trans proline' 0 CA--C 1.536 0.623 0 C-N-CA 118.132 -0.779 . . . . 49.71 113.693 -174.238 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 703' ' ' MET . . . . . . . . . . . . . 96.3 mmm -76.32 2.24 13.93 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 112.671 0.619 . . . . 50.76 112.671 177.564 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 704' ' ' ARG . . . . . 0.452 ' NH1' ' O1 ' ' B' ' 801' ' ' SO4 . 31.4 mtp180 48.93 45.72 22.43 Favored 'General case' 0 N--CA 1.468 0.466 0 N-CA-C 113.286 0.847 . . . . 78.48 113.286 179.766 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 705' ' ' PHE . . . . . . . . . . . . . 10.6 m-30 -88.06 145.08 26.15 Favored 'General case' 0 C--N 1.325 -0.47 0 CA-C-N 116.198 -0.455 . . . . 56.58 110.71 177.68 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 706' ' ' SER . . . . . . . . . . . . . 81.5 p -61.54 160.67 10.83 Favored 'General case' 0 C--O 1.241 0.616 0 N-CA-C 109.775 -0.454 . . . . 48.06 109.775 171.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 707' ' ' CYS . . . . . . . . . . . . . 63.2 m -62.52 -38.43 89.91 Favored 'General case' 0 N--CA 1.467 0.422 0 CA-C-O 121.229 0.538 . . . . 53.44 111.647 178.707 -73.442 -66.778 -83.202 103.513 2.062 103.012 -88.392 -175.179 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 708' ' ' GLN . . . . . . . . . . . . . 65.0 tp60 -66.4 -39.8 89.22 Favored 'General case' 0 N--CA 1.45 -0.439 0 CA-C-N 115.733 -0.667 . . . . 83.25 109.682 179.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 709' ' ' ARG . . . . . . . . . . . . . 61.7 ttt180 -64.35 -41.45 96.75 Favored 'General case' 0 C--N 1.33 -0.266 0 C-N-CA 120.798 -0.361 . . . . 95.59 111.862 -177.476 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 710' ' ' ARG . . . . . 0.415 ' NH2' ' SG ' ' B' ' 728' ' ' CYS . 66.3 mtm180 -65.92 -15.31 62.85 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 114.707 1.373 . . . . 82.12 114.707 179.344 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 711' ' ' THR . . . . . 0.459 HG22 ' CD1' ' B' ' 724' ' ' PHE . 32.4 p -87.01 -20.34 27.37 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 113.335 0.865 . . . . 80.37 113.335 177.1 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 712' ' ' ARG . . . . . . . . . . . . . 35.5 mtt85 -59.57 -20.24 54.26 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 116.764 2.135 . . . . 102.09 116.764 -165.731 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 713' ' ' PHE . . . . . . . . . . . . . 78.9 m-85 -131.88 20.61 4.57 Favored 'General case' 0 C--N 1.327 -0.389 0 N-CA-C 113.685 0.994 . . . . 97.95 113.685 -177.099 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 714' ' ' ILE . . . . . . . . . . . . . 11.3 mt -83.98 -27.4 7.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 C-N-CA 120.43 -0.508 . . . . 102.19 110.551 176.526 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 715' ' ' SER . . . . . . . . . . . . . 76.7 p 53.39 -115.45 0.95 Allowed 'General case' 0 N--CA 1.463 0.18 0 N-CA-C 109.027 -0.731 . . . . 116.45 109.027 -167.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 716' ' ' LEU . . . . . . . . . . . . . 13.4 tp 61.11 -4.18 0.15 Allowed 'General case' 0 CA--C 1.541 0.602 0 N-CA-C 115.786 1.772 . . . . 114.2 115.786 167.716 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 717' ' ' GLY . . . . . . . . . . . . . . . 130.39 161.12 10.28 Favored Glycine 0 C--O 1.225 -0.407 0 N-CA-C 116.584 1.394 . . . . 95.91 116.584 171.906 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 718' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -80.88 -50.64 9.52 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 115.614 -0.293 . . . . 137.7 111.209 177.047 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 719' ' ' ALA . . . . . . . . . . . . . . . -64.66 -25.07 67.79 Favored 'General case' 0 CA--C 1.52 -0.185 0 CA-C-N 116.184 -0.462 . . . . 84.05 110.432 -179.736 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 720' ' ' CYS . . . . . . . . . . . . . 44.1 t -80.26 -29.53 38.36 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 115.749 -0.659 . . . . 92.82 111.768 178.224 178.584 73.84 -106.745 109.201 2.032 108.209 -106.92 -59.591 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 721' ' ' LYS . . . . . . . . . . . . . 85.9 mttt -70.72 -45.08 65.57 Favored 'General case' 0 C--N 1.329 -0.318 0 N-CA-C 110.332 -0.247 . . . . 85.43 110.332 176.285 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 722' ' ' LYS . . . . . . . . . . . . . 1.5 tmtp? -55.68 -41.03 73.14 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.973 0.416 . . . . 89.49 111.364 176.94 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 723' ' ' VAL . . . . . . . . . . . . . 36.2 t -65.73 -58.17 7.88 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.474 0 CA-C-N 116.045 -0.525 . . . . 59.61 110.161 178.802 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 724' ' ' PHE . . . . . 0.459 ' CD1' HG22 ' B' ' 711' ' ' THR . 33.0 t80 -44.66 -52.37 8.28 Favored 'General case' 0 C--N 1.331 -0.227 0 C-N-CA 123.499 0.72 . . . . 48.34 111.189 176.318 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 725' ' ' LEU . . . . . . . . . . . . . 13.1 tp -64.03 -41.41 97.44 Favored 'General case' 0 C--N 1.326 -0.454 0 CA-C-N 115.349 -0.842 . . . . 60.81 110.666 -174.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 726' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -67.41 -39.45 85.5 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 116.026 -0.534 . . . . 98.92 112.322 -179.021 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 727' ' ' CYS . . . . . . . . . . . . . 93.8 m -76.99 -38.2 53.61 Favored 'General case' 0 C--O 1.236 0.394 0 N-CA-C 109.787 -0.449 . . . . 47.36 109.787 -177.918 -68.681 -147.324 -97.153 112.899 2.045 107.117 58.861 -171.949 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 728' ' ' CYS . . . . . 0.415 ' SG ' ' NH2' ' B' ' 710' ' ' ARG . 44.6 t -58.46 -51.9 67.92 Favored 'General case' 0 C--O 1.22 -0.464 0 CA-C-N 115.621 -0.718 . . . . 41.9 111.451 173.878 -175.179 -88.392 -83.202 103.012 2.062 103.513 -66.778 -73.442 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 729' ' ' ASN . . . . . . . . . . . . . 89.2 m-20 -60.08 -38.24 82.3 Favored 'General case' 0 CA--C 1.503 -0.862 0 N-CA-C 111.677 0.251 . . . . 47.8 111.677 176.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 730' ' ' TYR . . . . . 0.472 ' O ' HD23 ' B' ' 734' ' ' LEU . 70.8 t80 -61.69 -53.44 56.09 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 116.376 -0.375 . . . . 69.6 111.631 177.515 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 731' ' ' ILE . . . . . . . . . . . . . 7.9 tp -72.48 -28.65 28.8 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 N-CA-C 112.57 0.582 . . . . 49.86 112.57 -176.472 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 732' ' ' THR . . . . . . . . . . . . . 30.7 m -63.27 -46.87 84.81 Favored 'General case' 0 C--N 1.329 -0.314 0 C-N-CA 119.789 -0.764 . . . . 47.03 109.189 178.237 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 733' ' ' GLU . . . . . . . . . . . . . 75.9 tt0 -59.83 -41.27 90.98 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.107 -0.497 . . . . 96.24 111.856 177.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 734' ' ' LEU . . . . . 0.472 HD23 ' O ' ' B' ' 730' ' ' TYR . 3.3 mm? -67.76 -37.62 82.34 Favored 'General case' 0 N--CA 1.467 0.412 0 O-C-N 123.121 0.263 . . . . 62.01 110.662 -179.428 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 735' ' ' ARG . . . . . . . . . . . . . 64.0 mtt180 -65.35 -43.26 91.41 Favored 'General case' 0 C--O 1.224 -0.287 0 C-N-CA 118.898 -1.121 . . . . 61.46 110.808 177.167 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 736' ' ' ARG . . . . . . . . . . . . . 85.6 mtt180 -61.75 -44.32 97.13 Favored 'General case' 0 C--N 1.329 -0.305 0 C-N-CA 120.595 -0.442 . . . . 61.22 111.466 179.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 737' ' ' GLN . . . . . . . . . . . . . 89.3 mt-30 -61.79 -41.39 97.68 Favored 'General case' 0 C--N 1.327 -0.389 0 C-N-CA 119.83 -0.748 . . . . 50.85 110.276 178.034 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 738' ' ' HIS . . . . . . . . . . . . . 66.1 t-80 -63.19 -43.47 98.12 Favored 'General case' 0 C--O 1.166 -3.327 0 CA-C-O 118.941 -0.552 . . . . 90.82 112.287 176.064 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 739' ' ' ALA . . . . . . . . . . . . . . . -60.92 -40.57 93.68 Favored 'General case' 0 C--N 1.318 -0.795 0 CA-C-N 118.936 0.789 . . . . 37.58 111.332 177.259 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 740' ' ' ARG . . . . . . . . . . . . . 80.6 mtt180 -65.59 -41.65 92.6 Favored 'General case' 0 C--N 1.323 -0.573 0 N-CA-C 112.664 0.616 . . . . 40.03 112.664 178.365 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 741' ' ' ALA . . . . . . . . . . . . . . . -64.29 -43.72 93.89 Favored 'General case' 0 N--CA 1.453 -0.313 0 N-CA-C 108.601 -0.889 . . . . 30.47 108.601 179.168 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 742' ' ' SER . . . . . . . . . . . . . 32.6 t -62.2 -47.05 86.2 Favored 'General case' 0 C--N 1.325 -0.477 0 CA-C-N 115.81 -0.632 . . . . 55.35 111.505 178.823 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 743' ' ' HIS . . . . . 0.419 ' HE1' ' O ' ' B' ' 904' ' ' HOH . 47.1 t-80 -58.17 -35.31 71.39 Favored 'General case' 0 C--N 1.326 -0.455 0 N-CA-C 113.09 0.774 . . . . 34.76 113.09 174.502 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 744' ' ' LEU . . . . . . . . . . . . . 70.8 mt -88.09 0.37 56.08 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 120.101 -0.64 . . . . 35.86 111.874 -177.248 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 745' ' ' GLY . . . . . . . . . . . . . . . 73.38 20.71 79.94 Favored Glycine 0 N--CA 1.449 -0.496 0 C-N-CA 120.538 -0.839 . . . . 35.54 112.845 177.926 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 746' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -89.4 -22.28 22.64 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 109.741 -0.466 . . . . 57.51 109.741 176.259 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 747' ' ' ALA . . . . . . . . . . . . . . . -5.36 115.5 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.783 0 N-CA-C 117.139 2.274 . . . . 116.77 117.139 -178.056 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 748' ' ' ARG . . . . . 0.857 ' HG2' HH11 ' B' ' 748' ' ' ARG . 0.0 OUTLIER . . . . . 0 C--O 1.285 2.93 0 C-N-CA 119.199 -1.0 . . . . 108.9 112.157 -171.041 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' A' A ' 801' ' ' SO4 . . . . . 0.513 ' O3 ' ' NH1' ' A' ' 704' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 801' ' ' SO4 . . . . . 0.452 ' O1 ' ' NH1' ' B' ' 704' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 901' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 902' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 903' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 904' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 905' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 906' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 907' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 908' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 909' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 910' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 911' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 912' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 913' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 914' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 915' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 916' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' A' A ' 917' ' ' HOH . . . . . 0.517 ' O ' ' N ' ' A' ' 672' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' A' A ' 918' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 901' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 902' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 903' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 904' ' ' HOH . . . . . 0.419 ' O ' ' HE1' ' B' ' 743' ' ' HIS . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 905' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 906' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 907' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 908' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 909' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 910' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 911' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 912' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 913' ' ' HOH . . . . . 0.438 ' O ' ' HD2' ' B' ' 748' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 914' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 915' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 916' ' ' HOH . . . . . 0.481 ' O ' ' N ' ' B' ' 672' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_