data_6p10_residue ############################ # Computer software used # ############################ save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 6p10 _Structure_validation_residue.Date_analyzed 2019-07-20 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 ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.25 0 N-CA-C 112.191 -0.364 . . . . 81.32 112.191 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 2.6 t -69.55 -36.77 72.61 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 C-N-CA 120.17 -0.612 . . . . 87.57 109.999 171.656 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 462' ' ' GLU . . . . . . . . . . . . . . . -69.69 -31.98 70.32 Favored 'General case' 0 C--O 1.236 0.382 0 O-C-N 121.939 -0.476 . . . . 72.56 111.533 174.299 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 463' ' ' GLN . . . . . . . . . . . . . . . -67.98 -36.08 79.42 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.228 -0.589 . . . . 69.57 111.235 177.329 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 464' ' ' LYS . . . . . . . . . . . . . . . -73.06 -28.91 62.59 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 120.596 -0.442 . . . . 70.87 111.611 178.334 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 465' ' ' LEU . . . . . . . . . . . . . 8.8 mt -64.23 -47.27 80.32 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.005 0.431 . . . . 66.28 110.836 172.844 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 466' ' ' VAL . . . . . . . . . . . . . 7.0 t -61.46 -45.82 97.84 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 CA-C-O 121.139 0.495 . . . . 50.99 110.14 178.139 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 467' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -57.31 -41.87 80.72 Favored 'General case' 0 C--O 1.236 0.378 0 O-C-N 122.1 -0.375 . . . . 69.62 111.395 178.039 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 468' ' ' LEU . . . . . . . . . . . . . 42.1 tp -64.32 -43.94 93.11 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.111 -0.636 . . . . 59.73 111.278 177.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 469' ' ' ILE . . . . . . . . . . . . . 24.8 mt -61.68 -41.22 89.58 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 C-N-CA 120.501 -0.48 . . . . 51.58 110.561 177.569 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 470' ' ' LEU . . . . . . . . . . . . . 43.8 mt -68.88 -30.67 69.22 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 119.513 -0.875 . . . . 51.57 111.529 177.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 471' ' ' ASP . . . . . . . . . . . . . 31.2 m-20 -73.29 -49.33 28.19 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 120.617 -0.433 . . . . 60.36 111.418 -179.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 472' ' ' GLU . . . . . . . . . . . . . 41.4 mm-40 -108.36 -30.66 8.2 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 114.662 1.356 . . . . 72.71 114.662 -162.819 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 473' ' ' ILE . . . . . . . . . . . . . 18.4 mt -102.65 -50.85 9.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 118.535 0.607 . . . . 59.03 111.771 -169.0 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 474' ' ' VAL . . . . . . . . . . . . . 94.8 t -64.2 123.46 17.06 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 N-CA-C 108.368 -0.975 . . . . 52.53 108.368 174.39 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 475' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -94.87 145.51 24.85 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.313 0.578 . . . . 66.98 110.467 -177.558 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 476' ' ' GLY . . . . . . . . . . . . . . . -140.06 -150.67 5.51 Favored Glycine 0 N--CA 1.449 -0.472 0 CA-C-N 115.391 -0.822 . . . . 68.46 111.93 177.51 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 477' ' ' GLY . . . . . . . . . . . . . . . 75.22 -159.38 51.63 Favored Glycine 0 N--CA 1.446 -0.663 0 C-N-CA 118.514 -1.803 . . . . 68.33 110.811 -174.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -68.19 130.23 42.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.854 -0.673 . . . . 68.15 110.473 -177.239 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 479' ' ' LYS . . . . . . . . . . . . . 29.8 mttm -75.95 137.39 40.3 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.087 -0.506 . . . . 90.21 110.188 177.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 480' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -86.42 130.58 36.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 N-CA-C 107.409 -1.33 . . . . 61.65 107.409 172.228 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 481' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -100.37 161.71 13.43 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.557 0.694 . . . . 97.72 110.778 -175.229 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 482' ' ' TRP . . . . . . . . . . . . . 2.6 t-105 -53.59 -42.37 67.56 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.109 -0.951 . . . . 66.3 110.987 177.327 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 483' ' ' THR . . . . . . . . . . . . . 2.5 m -62.95 -29.93 71.18 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 111.749 0.278 . . . . 63.56 111.749 179.982 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 484' ' ' ASP . . . . . 0.445 ' O ' ' N3 ' ' B' ' 802' ' ' SKE . 90.4 m-20 -69.84 -3.08 14.13 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 113.57 0.952 . . . . 72.01 113.57 -177.482 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 485' ' ' ILE . . . . . . . . . . . . . 59.7 mt -105.66 106.17 20.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 N-CA-C 107.72 -1.215 . . . . 60.7 107.72 -177.664 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 486' ' ' ALA . . . . . . . . . . . . . . . -70.93 131.03 43.11 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.783 -0.644 . . . . 67.01 110.52 179.083 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 487' ' ' GLY . . . . . . . . . . . . . . . 66.26 -151.33 52.11 Favored Glycine 0 C--N 1.334 0.42 0 C-N-CA 120.593 -0.813 . . . . 65.44 112.19 177.568 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 488' ' ' GLN . . . . . . . . . . . . . 47.4 mm-40 55.45 37.32 28.72 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.29 0.567 . . . . 71.22 111.009 -177.849 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 489' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -66.74 -28.75 68.66 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.357 -0.537 . . . . 83.39 112.061 -176.818 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 490' ' ' VAL . . . . . . . . . . . . . 43.7 t -63.58 -59.6 4.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 CA-C-O 121.378 0.609 . . . . 68.86 109.86 177.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 491' ' ' ALA . . . . . . . . . . . . . . . -59.7 -35.99 75.62 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-N 116.328 -0.397 . . . . 59.42 111.45 178.577 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 492' ' ' LYS . . . . . . . . . . . . . 20.7 mttt -59.49 -49.52 77.46 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 120.838 0.351 . . . . 64.65 111.5 179.118 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . . . -66.7 -36.05 81.57 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 120.456 -0.497 . . . . 57.58 111.278 -178.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 494' ' ' ALA . . . . . . . . . . . . . . . -61.8 -44.06 97.62 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.384 -0.527 . . . . 58.26 111.025 175.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 495' ' ' LEU . . . . . . . . . . . . . 41.0 mt -66.83 -31.81 72.67 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.175 -0.61 . . . . 53.62 111.658 179.343 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 496' ' ' GLN . . . . . . . . . . . . . 36.4 mm-40 -62.76 -48.23 80.08 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.454 -0.498 . . . . 61.86 111.159 175.32 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 497' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -67.64 -39.48 84.62 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.106 -0.638 . . . . 86.86 111.605 -177.418 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 498' ' ' MET . . . . . . . . . . . . . 41.1 mtm -93.62 -24.78 17.78 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 113.926 1.084 . . . . 89.05 113.926 -167.515 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 499' ' ' VAL . . . . . . . . . . . . . 16.4 t -123.97 -57.65 2.28 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 119.034 0.834 . . . . 51.83 111.18 -178.54 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 500' ' ' ILE . . . . . . . . . . . . . 44.5 mt -63.73 -62.19 1.32 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.347 0 C-N-CA 120.75 -0.38 . . . . 56.83 110.855 -168.863 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 50.1 mt -56.02 -45.88 99.84 Favored Pre-proline 0 C--O 1.244 0.79 0 CA-C-O 118.251 -0.881 . . . . 65.24 113.074 -178.1 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 502' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -61.94 -27.0 79.39 Favored 'Trans proline' 0 C--O 1.238 0.479 0 CA-C-N 121.558 1.592 . . . . 58.94 113.345 174.487 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 503' ' ' SER . . . . . . . . . . . . . 40.5 t -76.21 -42.79 45.0 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 120.379 -0.528 . . . . 62.08 111.765 179.852 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 504' ' ' VAL . . . . . . . . . . . . . 10.6 m -91.25 -22.68 6.1 Favored 'Isoleucine or valine' 0 C--O 1.24 0.586 0 N-CA-C 113.511 0.93 . . . . 73.21 113.511 -174.015 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 505' ' ' ARG . . . . . 0.547 ' NE ' ' OE2' ' B' ' 507' ' ' GLU . 51.8 mmm-85 -124.55 68.09 50.46 Favored Pre-proline 0 C--O 1.24 0.553 0 N-CA-C 108.916 -0.772 . . . . 81.21 108.916 174.457 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -65.88 -21.42 57.46 Favored 'Trans proline' 0 C--O 1.238 0.519 0 N-CA-C 114.054 0.751 . . . . 75.6 114.054 -174.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 507' ' ' GLU . . . . . 0.547 ' OE2' ' NE ' ' B' ' 505' ' ' ARG . 22.2 pm0 -68.95 -28.67 66.84 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 118.812 0.733 . . . . 85.5 111.741 -179.119 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 508' ' ' LEU . . . . . . . . . . . . . 12.8 mt -81.46 4.17 22.04 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 112.996 0.739 . . . . 77.87 112.996 177.715 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 509' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -135.36 49.87 2.16 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.784 0.802 . . . . 71.07 110.323 -174.791 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 510' ' ' THR . . . . . . . . . . . . . 17.0 p -99.99 167.71 10.32 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.8 0.81 . . . . 72.23 110.09 175.089 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 511' ' ' GLY . . . . . . . . . . . . . . . 63.0 -122.95 29.02 Favored Glycine 0 C--O 1.237 0.317 0 CA-C-N 115.125 -0.943 . . . . 65.07 111.664 175.422 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 512' ' ' LEU . . . . . . . . . . . . . 59.3 mt -69.59 -13.37 62.28 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 112.951 0.723 . . . . 60.65 112.951 -179.553 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 513' ' ' ARG . . . . . . . . . . . . . 92.1 mtm-85 -96.73 12.92 30.21 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 118.563 0.62 . . . . 69.13 112.539 176.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 514' ' ' ALA . . . . . . . . . . . . . . . -60.95 132.88 92.22 Favored Pre-proline 0 C--O 1.241 0.638 0 CA-C-N 117.911 0.323 . . . . 61.31 110.396 -177.392 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 515' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -74.74 156.47 44.17 Favored 'Trans proline' 0 CA--C 1.517 -0.345 0 CA-C-O 121.855 0.689 . . . . 61.42 112.033 -172.792 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 516' ' ' ALA . . . . . . . . . . . . . . . -74.08 153.83 39.45 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.016 -0.993 . . . . 60.7 109.823 171.267 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 517' ' ' LYS . . . . . 0.578 ' NZ ' ' O ' ' B' ' 620' ' ' ASP . 5.5 mttm -102.76 -4.71 24.58 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.74 -0.663 . . . . 86.03 112.512 -179.892 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 518' ' ' GLY . . . . . . . . . . . . . . . -139.48 128.84 4.12 Favored Glycine 0 N--CA 1.448 -0.536 0 N-CA-C 112.111 -0.396 . . . . 54.98 112.111 176.315 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 519' ' ' LEU . . . . . . . . . . . . . 9.8 tt -132.75 140.85 48.25 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 109.251 -0.648 . . . . 55.69 109.251 -179.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 520' ' ' LEU . . . . . . . . . . . . . 32.2 tp -107.99 131.05 54.97 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 123.026 0.53 . . . . 50.27 109.905 -179.228 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 521' ' ' LEU . . . . . . . . . . . . . 23.5 mt -105.69 132.24 52.07 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.324 -0.991 . . . . 56.63 108.324 168.741 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 35.5 p90 -141.94 153.09 44.1 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.27 0.557 . . . . 54.8 109.815 -176.89 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 523' ' ' GLY . . . . . . . . . . . . . . . 151.77 -175.59 30.49 Favored Glycine 0 N--CA 1.439 -1.138 0 CA-C-N 115.138 -0.937 . . . . 52.53 110.913 179.874 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -66.15 153.76 76.79 Favored 'Trans proline' 0 C--O 1.241 0.669 0 C-N-CA 120.861 1.041 . . . . 61.98 111.412 -177.693 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 525' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -68.08 151.44 77.39 Favored 'Trans proline' 0 C--N 1.332 -0.304 0 C-N-CA 120.308 0.672 . . . . 61.62 112.267 -179.752 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . 76.82 22.45 71.95 Favored Glycine 0 C--N 1.334 0.439 0 CA-C-N 115.094 -0.957 . . . . 55.05 115.362 175.742 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 527' ' ' CYS . . . . . . . . . . . . . 92.5 m -112.0 5.98 19.08 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 118.275 1.037 . . . . 58.64 113.37 -176.92 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 528' ' ' GLY . . . . . . . . . . . . . . . 103.39 21.06 10.22 Favored Glycine 0 N--CA 1.447 -0.589 0 N-CA-C 117.394 1.717 . . . . 51.91 117.394 170.804 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 529' ' ' LYS . . . . . . . . . . . . . 36.7 mtmm -64.14 -48.3 76.56 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 119.097 1.449 . . . . 47.77 110.819 175.808 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 530' ' ' THR . . . . . . . . . . . . . 53.1 m -59.78 -51.62 68.95 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.556 -0.458 . . . . 44.29 110.888 176.028 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 531' ' ' LEU . . . . . . . . . . . . . 50.2 mt -58.18 -39.68 79.53 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.632 -0.427 . . . . 70.1 111.546 -179.058 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 532' ' ' LEU . . . . . . . . . . . . . 16.1 mt -63.9 -39.23 93.69 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 119.928 -0.709 . . . . 56.2 111.01 177.438 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 533' ' ' ALA . . . . . . . . . . . . . . . -64.43 -43.97 92.66 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 120.46 -0.496 . . . . 43.26 111.399 179.035 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 534' ' ' ARG . . . . . . . . . . . . . 35.6 mtp180 -59.49 -46.86 87.61 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.605 -0.438 . . . . 86.64 111.079 177.077 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 535' ' ' ALA . . . . . . . . . . . . . . . -64.11 -35.02 79.38 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 119.921 -0.712 . . . . 44.66 111.966 179.159 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 536' ' ' VAL . . . . . . . . . . . . . 40.8 t -57.97 -43.58 85.11 Favored 'Isoleucine or valine' 0 C--O 1.237 0.439 0 C-N-CA 120.042 -0.663 . . . . 44.81 110.415 174.634 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 537' ' ' ALA . . . . . . . . . . . . . . . -63.17 -42.06 99.34 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 120.26 -0.576 . . . . 44.23 111.304 177.784 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 538' ' ' THR . . . . . . . . . . . . . 34.7 m -57.39 -47.93 80.39 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-O 121.055 0.455 . . . . 48.12 110.839 174.65 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 539' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -60.93 -32.08 71.6 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 112.088 0.403 . . . . 60.95 112.088 179.174 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 540' ' ' CYS . . . . . . . . . . . . . 93.5 m -88.18 -2.91 58.88 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 113.197 0.814 . . . . 53.24 113.197 -178.413 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 541' ' ' SER . . . . . . . . . . . . . 18.2 m 52.33 48.19 23.15 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 122.099 0.952 . . . . 59.8 110.111 -169.29 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 542' ' ' ALA . . . . . . . . . . . . . . . -117.89 151.25 37.77 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.497 -0.774 . . . . 52.35 110.938 -172.449 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 543' ' ' THR . . . . . . . . . . . . . 23.7 m -67.31 133.17 49.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.259 -0.882 . . . . 48.65 109.267 170.375 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 544' ' ' PHE . . . . . . . . . . . . . 74.5 t80 -103.52 118.48 36.84 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.123 -0.695 . . . . 44.82 109.123 179.043 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 545' ' ' LEU . . . . . . . . . . . . . 5.3 mp -111.52 113.78 26.42 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 107.341 -1.355 . . . . 50.28 107.341 179.146 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 546' ' ' ASN . . . . . . . . . . . . . 53.3 t-20 -110.56 109.28 19.54 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.436 -0.95 . . . . 53.36 108.436 -172.21 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 547' ' ' ILE . . . . . . . . . . . . . 4.3 tp -116.26 126.43 73.74 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 N-CA-C 108.562 -0.903 . . . . 66.04 108.562 178.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 548' ' ' SER . . . . . . . . . . . . . 1.8 t -86.33 113.46 22.33 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 108.363 -0.977 . . . . 78.15 108.363 175.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 549' ' ' ALA . . . . . . . . . . . . . . . -63.95 -34.55 78.24 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.327 -0.549 . . . . 71.51 111.896 -178.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -62.44 -54.96 32.51 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.003 0.43 . . . . 79.94 110.947 -179.77 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 1.7 p -70.29 5.65 1.64 Allowed 'General case' 0 C--O 1.24 0.564 0 N-CA-C 112.931 0.715 . . . . 81.16 112.931 176.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 552' ' ' LEU . . . . . . . . . . . . . 36.5 tp -97.61 -47.78 5.5 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 123.463 0.705 . . . . 86.64 112.387 -178.554 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . . . -67.25 -21.3 65.73 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 112.429 0.529 . . . . 108.79 112.429 -178.676 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 554' ' ' SER . . . . . . . . . . . . . . . -74.01 -172.16 1.28 Allowed 'General case' 0 C--O 1.235 0.341 0 CA-C-O 122.213 1.006 . . . . 95.34 110.125 -174.148 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 555' ' ' LYS . . . . . . . . . . . . . . . -80.85 56.21 2.65 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.958 -0.564 . . . . 96.41 112.156 -173.936 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 556' ' ' TYR . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.315 0 CA-C-O 120.853 0.358 . . . . 88.28 110.814 177.967 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 560' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.267 0 CA-C-O 120.915 0.175 . . . . 81.07 113.139 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 561' ' ' GLU . . . . . . . . . . . . . . . -70.09 -37.87 75.53 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.554 -0.458 . . . . 82.5 111.379 178.695 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 562' ' ' LYS . . . . . . . . . . . . . . . -70.69 -33.91 71.4 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.635 -0.426 . . . . 72.88 111.911 -177.421 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 563' ' ' LEU . . . . . . . . . . . . . 7.6 tp -65.9 -48.69 70.64 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 120.194 -0.602 . . . . 65.93 110.935 177.813 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 564' ' ' VAL . . . . . . . . . . . . . 89.0 t -56.54 -40.78 70.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 CA-C-O 121.011 0.434 . . . . 63.36 110.319 175.669 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 565' ' ' ARG . . . . . . . . . . . . . 21.1 ttm180 -64.67 -39.92 94.52 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.295 -0.562 . . . . 67.08 111.134 177.925 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 566' ' ' ALA . . . . . . . . . . . . . . . -72.27 -29.25 63.72 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.396 -0.522 . . . . 56.69 111.676 179.222 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 567' ' ' LEU . . . . . . . . . . . . . 27.6 tp -65.44 -52.07 55.77 Favored 'General case' 0 C--O 1.239 0.5 0 CA-C-O 120.803 0.335 . . . . 60.14 111.069 178.423 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 35.1 m-85 -64.33 -30.88 71.92 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.621 -0.432 . . . . 53.47 111.575 177.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 569' ' ' ALA . . . . . . . . . . . . . . . -67.86 -44.7 76.51 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.711 -0.396 . . . . 57.11 110.942 176.358 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 570' ' ' VAL . . . . . . . . . . . . . 12.0 t -62.32 -37.91 79.83 Favored 'Isoleucine or valine' 0 C--O 1.237 0.447 0 C-N-CA 120.509 -0.476 . . . . 55.85 110.291 174.573 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 571' ' ' ALA . . . . . . . . . . . . . . . -59.99 -41.56 92.31 Favored 'General case' 0 C--O 1.237 0.424 0 O-C-N 121.872 -0.518 . . . . 59.25 111.413 176.969 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 572' ' ' ARG . . . . . 0.607 ' NE ' ' O ' ' B' ' 904' ' ' HOH . 15.4 mtt85 -65.41 -42.16 92.83 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.419 -0.513 . . . . 76.55 111.384 179.388 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 573' ' ' HIS . . . . . . . . . . . . . 48.2 m170 -70.87 -20.24 62.54 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 112.753 0.649 . . . . 79.2 112.753 -177.528 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 574' ' ' MET . . . . . . . . . . . . . 82.6 mtp -111.31 17.9 19.78 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 118.503 0.592 . . . . 64.6 112.438 -178.623 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 575' ' ' GLN . . . . . . . . . . . . . 29.9 pt20 -67.64 152.91 95.86 Favored Pre-proline 0 N--CA 1.45 -0.453 0 C-N-CA 120.61 -0.436 . . . . 89.13 110.868 -174.514 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 576' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -64.0 136.77 25.18 Favored 'Cis proline' 0 C--N 1.347 0.485 0 C-N-CA 128.015 0.423 . . . . 60.53 112.601 1.175 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 577' ' ' SER . . . . . . . . . . . . . 48.7 m -134.17 149.5 51.04 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 121.388 0.614 . . . . 55.62 110.11 -171.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 578' ' ' ILE . . . . . . . . . . . . . 10.1 mt -120.83 117.0 51.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 N-CA-C 107.555 -1.276 . . . . 54.06 107.555 172.561 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 579' ' ' ILE . . . . . . . . . . . . . 49.5 mt -94.04 118.92 41.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 107.296 -1.372 . . . . 44.19 107.296 174.615 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 580' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -113.7 123.94 51.09 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 108.607 -0.886 . . . . 42.96 108.607 -177.793 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 581' ' ' ILE . . . . . . . . . . . . . 5.7 mt -110.99 109.28 27.9 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 N-CA-C 107.569 -1.271 . . . . 68.25 107.569 178.116 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 34.3 t0 -77.22 140.87 40.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.954 -0.566 . . . . 82.24 109.834 176.042 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 583' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 51.13 55.06 10.11 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 121.833 0.825 . . . . 93.29 111.005 178.454 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 584' ' ' VAL . . . . . . . . . . . . . 9.5 p -60.96 -21.11 23.45 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 CA-C-N 115.085 -0.961 . . . . 62.61 111.841 -176.391 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 585' ' ' ASP . . . . . 0.506 ' OD2' ' NH1' ' B' ' 630' ' ' ARG . 3.7 p-10 -64.2 -30.62 71.67 Favored 'General case' 0 C--O 1.237 0.401 0 O-C-N 122.148 -0.345 . . . . 69.08 111.879 179.274 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 53.7 p -73.55 -11.56 60.48 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 112.605 0.594 . . . . 74.74 112.605 177.096 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 587' ' ' LEU . . . . . . . . . . . . . 4.3 mt -78.83 -86.13 0.07 Allowed 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.017 -0.735 . . . . 78.55 109.017 162.341 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 588' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 115.94 -0.573 . . . . 75.24 111.152 178.561 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 599' ' ' SER . . . . . 0.557 ' N ' ' O ' ' B' ' 905' ' ' HOH . . . . . . . . 0 C--O 1.232 0.169 0 CA-C-O 120.823 0.345 . . . . 85.43 110.883 . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 600' ' ' ARG . . . . . . . . . . . . . . . -67.45 -28.62 68.03 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.439 -0.504 . . . . 80.2 111.59 177.342 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 601' ' ' ARG . . . . . . . . . . . . . . . -69.96 -28.48 65.59 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.671 -0.412 . . . . 76.48 111.893 179.995 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 602' ' ' LEU . . . . . . . . . . . . . 1.1 tt -78.36 -47.09 18.43 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.165 -0.614 . . . . 76.51 111.44 -178.3 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 603' ' ' LYS . . . . . . . . . . . . . . . -58.46 -37.87 76.36 Favored 'General case' 0 C--O 1.239 0.5 0 C-N-CA 120.559 -0.456 . . . . 66.25 111.118 176.576 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 604' ' ' THR . . . . . . . . . . . . . 2.2 m -65.44 -46.13 81.09 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.887 0.375 . . . . 72.26 111.212 179.828 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 605' ' ' GLU . . . . . . . . . . . . . 45.0 tp10 -65.62 -27.03 68.09 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.162 -0.615 . . . . 89.66 111.644 179.59 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 606' ' ' PHE . . . . . . . . . . . . . 54.8 t80 -68.25 -49.02 63.48 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 119.082 -1.047 . . . . 80.69 110.968 172.692 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 607' ' ' LEU . . . . . . . . . . . . . 72.4 mt -56.47 -43.08 79.25 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.6 -0.44 . . . . 71.21 111.104 177.31 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 608' ' ' VAL . . . . . . . . . . . . . 44.7 t -62.0 -39.24 83.01 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 CA-C-O 120.894 0.378 . . . . 62.29 110.619 179.814 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 609' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -73.13 -39.67 65.52 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 119.913 -0.715 . . . . 72.67 111.254 -178.761 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -61.28 -44.53 97.08 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 120.337 -0.545 . . . . 74.86 111.121 176.264 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 611' ' ' ASP . . . . . 0.617 ' OD1' ' NH2' ' B' ' 641' ' ' ARG . 82.8 m-20 -67.31 -29.8 69.47 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.615 -0.434 . . . . 72.86 112.032 -176.564 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 612' ' ' GLY . . . . . . . . . . . . . . . -84.38 12.1 56.31 Favored Glycine 0 N--CA 1.447 -0.589 0 N-CA-C 115.589 0.995 . . . . 70.78 115.589 177.337 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 613' ' ' LEU . . . . . . . . . . . . . 12.3 mt -70.74 -50.07 13.63 Favored Pre-proline 0 C--O 1.248 0.998 0 CA-C-N 118.072 0.936 . . . . 70.28 112.422 -177.517 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 614' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo . . . . . 0 C--N 1.344 0.316 0 C-N-CA 116.419 -1.921 . . . . 93.42 112.385 179.044 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 617' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo . . . . . 0 C--O 1.233 0.239 0 CA-C-O 120.559 0.15 . . . . 106.16 112.204 . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 618' ' ' ASP . . . . . . . . . . . . . . . -100.09 21.57 12.63 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 116.019 -0.537 . . . . 101.11 111.988 171.905 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 619' ' ' GLY . . . . . . . . . . . . . . . -135.05 -90.64 0.34 Allowed Glycine 0 N--CA 1.449 -0.465 0 CA-C-O 120.045 -0.309 . . . . 93.21 112.622 178.757 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 620' ' ' ASP . . . . . 0.578 ' O ' ' NZ ' ' B' ' 517' ' ' LYS . . . 86.54 -49.75 0.05 Allowed 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 126.751 2.02 . . . . 82.86 112.712 176.539 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 621' ' ' ARG . . . . . . . . . . . . . 44.2 mtp180 -86.34 69.39 10.43 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 122.675 1.226 . . . . 85.07 110.486 -173.286 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 622' ' ' ILE . . . . . . . . . . . . . 57.1 mt -136.93 137.35 47.1 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-N 114.669 -1.15 . . . . 57.46 108.17 176.498 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 623' ' ' VAL . . . . . . . . . . . . . 3.3 p -124.38 138.57 53.46 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 N-CA-C 108.049 -1.093 . . . . 60.67 108.049 171.795 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 624' ' ' VAL . . . . . . . . . . . . . 84.3 t -105.34 117.5 51.15 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 108.108 -1.071 . . . . 49.47 108.108 -179.862 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 625' ' ' LEU . . . . . . . . . . . . . 52.3 mt -104.75 128.23 52.8 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.625 -0.88 . . . . 51.83 108.625 171.346 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 626' ' ' ALA . . . . . . . . . . . . . . . -117.38 146.48 43.39 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.852 -0.796 . . . . 46.99 108.852 177.596 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 627' ' ' ALA . . . . . . . . . . . . . . . -127.39 146.2 50.55 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.258 -0.645 . . . . 46.44 109.258 179.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 628' ' ' THR . . . . . . . . . . . . . 7.1 t -152.05 144.21 23.91 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.91 -0.586 . . . . 57.8 109.5 176.291 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 629' ' ' ASN . . . . . 0.465 ' O ' ' OH ' ' B' ' 746' ' ' TYR . 40.6 m-20 -95.17 -2.28 50.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.737 -0.665 . . . . 64.34 112.125 168.596 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 630' ' ' ARG . . . . . 0.506 ' NH1' ' OD2' ' B' ' 585' ' ' ASP . 19.3 mtt85 -133.16 71.22 77.44 Favored Pre-proline 0 C--O 1.237 0.418 0 C-N-CA 123.363 0.665 . . . . 94.58 109.268 178.696 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 631' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -62.99 -26.1 74.0 Favored 'Trans proline' 0 C--O 1.238 0.514 0 N-CA-C 113.157 0.407 . . . . 65.78 113.157 178.529 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 632' ' ' GLN . . . . . . . . . . . . . . . -65.98 -16.05 63.55 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 112.291 0.478 . . . . 81.62 112.291 177.783 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 633' ' ' GLU . . . . . . . . . . . . . . . -94.66 6.0 50.2 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 112.987 0.736 . . . . 78.08 112.987 -177.545 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 634' ' ' LEU . . . . . . . . . . . . . 95.3 mt -85.84 146.85 26.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.183 0.516 . . . . 87.63 110.17 176.717 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 635' ' ' ASP . . . . . . . . . . . . . 37.7 p-10 -97.66 179.82 4.71 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.836 0.827 . . . . 91.05 110.509 -177.665 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 636' ' ' GLU . . . . . . . . . . . . . . . -66.69 -30.58 70.86 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.523 -0.762 . . . . 85.11 111.812 -177.662 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 637' ' ' ALA . . . . . . . . . . . . . . . -62.2 -41.0 97.95 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 120.296 -0.562 . . . . 83.95 111.107 177.249 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 638' ' ' ALA . . . . . . . . . . . . . . . -72.92 -44.69 60.92 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.475 -0.49 . . . . 74.22 111.226 179.172 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 639' ' ' LEU . . . . . . . . . . . . . 9.4 mt -65.53 -32.83 74.63 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 112.276 0.473 . . . . 81.52 112.276 -172.96 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 640' ' ' ARG . . . . . . . . . . . . . . . -75.88 -19.85 58.52 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 112.764 0.653 . . . . 75.0 112.764 -179.024 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 641' ' ' ARG . . . . . 0.617 ' NH2' ' OD1' ' B' ' 611' ' ' ASP . 27.8 mtt85 -93.83 -24.62 17.69 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 112.897 0.702 . . . . 86.07 112.897 178.45 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 642' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -104.35 82.34 1.92 Allowed 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 107.567 -1.272 . . . . 72.99 107.567 175.984 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 643' ' ' THR . . . . . . . . . . . . . 6.8 p -61.51 -65.58 0.67 Allowed 'General case' 0 C--O 1.235 0.306 0 CA-C-N 114.623 -1.171 . . . . 84.09 110.225 178.759 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 644' ' ' LYS . . . . . . . . . . . . . 51.1 mmtt -73.41 129.68 38.52 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.39 -0.368 . . . . 86.83 110.307 -178.914 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 645' ' ' ARG . . . . . 0.548 ' NH1' ' O ' ' B' ' 753' ' ' TYR . 22.9 mtt180 -130.99 135.5 47.68 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 108.803 -0.814 . . . . 89.77 108.803 178.006 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 646' ' ' VAL . . . . . . . . . . . . . 15.5 t -125.0 127.65 72.54 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 N-CA-C 108.989 -0.745 . . . . 65.92 108.989 -178.311 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 647' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -83.84 136.3 34.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.057 -0.52 . . . . 62.1 109.914 179.45 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 648' ' ' VAL . . . . . . . . . . . . . 74.0 t -123.68 99.45 6.53 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 N-CA-C 106.649 -1.612 . . . . 51.13 106.649 179.888 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 649' ' ' SER . . . . . . . . . . . . . 71.2 p -86.28 170.91 11.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 122.042 0.925 . . . . 65.04 111.924 -168.998 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 650' ' ' LEU . . . . . . . . . . . . . 31.6 mt -55.43 146.65 42.14 Favored Pre-proline 0 N--CA 1.452 -0.341 0 CA-C-N 114.919 -1.037 . . . . 61.55 109.29 165.273 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 651' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -72.68 140.84 33.16 Favored 'Trans proline' 0 C--N 1.33 -0.429 0 N-CA-C 110.929 -0.45 . . . . 55.51 110.929 -179.294 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 652' ' ' ASP . . . . . . . . . . . . . 48.5 p-10 -83.25 -175.64 5.93 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.526 0.679 . . . . 73.19 109.59 176.538 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 653' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -62.02 -46.38 89.43 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.387 -0.525 . . . . 77.92 111.679 -169.861 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 654' ' ' GLN . . . . . . . . . . . . . . . -62.93 -33.61 75.71 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 120.265 -0.574 . . . . 55.7 111.732 -178.199 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 655' ' ' THR . . . . . . . . . . . . . 85.8 m -73.64 -41.38 62.83 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.53 -0.468 . . . . 64.26 111.135 177.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 656' ' ' ARG . . . . . . . . . . . . . 86.5 mtm-85 -59.28 -39.57 83.36 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.139 -0.624 . . . . 59.55 110.867 176.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 657' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -59.22 -47.31 85.8 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.951 -0.299 . . . . 74.42 110.821 176.869 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 658' ' ' LEU . . . . . . . . . . . . . 24.7 mt -65.57 -37.96 88.18 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 120.42 -0.512 . . . . 69.65 111.29 179.491 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 659' ' ' LEU . . . . . . . . . . . . . 22.8 mt -64.03 -53.69 45.94 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.783 -0.367 . . . . 70.47 111.249 179.654 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 46.6 mt -57.09 -34.89 68.77 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 120.682 -0.407 . . . . 53.88 111.023 176.266 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 661' ' ' ASN . . . . . . . . . . . . . 45.4 t-20 -61.7 -51.75 67.11 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.533 -0.467 . . . . 57.59 110.704 173.86 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 662' ' ' ARG . . . . . . . . . . . . . 9.3 ttt-85 -60.15 -40.74 90.92 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.757 -0.377 . . . . 83.77 111.239 -179.956 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 38.2 mt -66.84 -37.66 84.9 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.676 -0.41 . . . . 54.33 111.901 -177.817 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 664' ' ' LEU . . . . . . . . . . . . . 26.8 mt -84.31 -9.12 58.74 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 113.082 0.771 . . . . 59.85 113.082 -175.873 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 665' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -62.06 -26.22 68.14 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.131 -0.628 . . . . 71.59 111.332 169.205 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 666' ' ' LYS . . . . . . . . . . . . . 2.3 mttm -67.1 -14.1 62.58 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 112.803 0.668 . . . . 87.68 112.803 178.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 667' ' ' GLN . . . . . . . . . . . . . 16.9 mm-40 -120.89 22.25 11.14 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 118.442 0.564 . . . . 80.98 112.142 -179.833 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 668' ' ' GLY . . . . . . . . . . . . . . . 84.15 22.2 55.29 Favored Glycine 0 N--CA 1.449 -0.438 0 N-CA-C 115.565 0.986 . . . . 73.66 115.565 178.815 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 669' ' ' SER . . . . . . . . . . . . . 59.2 m 46.3 67.0 4.76 Favored Pre-proline 0 C--O 1.236 0.37 0 C-N-CA 125.158 1.383 . . . . 68.24 111.96 177.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 670' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -76.95 -11.12 18.1 Favored 'Trans proline' 0 C--O 1.239 0.541 0 N-CA-C 115.058 1.138 . . . . 66.0 115.058 -174.054 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 671' ' ' LEU . . . . . . . . . . . . . 44.1 mt -115.29 140.63 48.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 119.501 1.046 . . . . 58.04 110.618 -175.065 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 6.1 p30 -78.07 178.28 7.65 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-O 122.038 0.923 . . . . 67.63 110.437 -179.81 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 673' ' ' THR . . . . . . . . . . . . . 13.2 m -64.7 -33.51 76.13 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 115.597 -0.728 . . . . 74.07 111.897 -177.67 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 674' ' ' GLU . . . . . . . . . . . . . 15.8 mp0 -67.29 -41.36 85.57 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 120.306 -0.558 . . . . 85.24 111.151 179.394 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 675' ' ' ALA . . . . . . . . . . . . . . . -63.93 -40.55 96.72 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 120.25 -0.58 . . . . 55.9 111.682 178.725 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 676' ' ' LEU . . . . . . . . . . . . . 5.0 mt -74.43 -28.47 61.07 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 120.459 -0.496 . . . . 62.2 111.792 -179.308 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 677' ' ' ARG . . . . . . . . . . . . . . . -64.84 -42.25 95.06 Favored 'General case' 0 C--N 1.329 -0.283 0 O-C-N 121.865 -0.522 . . . . 54.19 110.375 169.891 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 678' ' ' ARG . . . . . . . . . . . . . 90.3 mtm-85 -65.85 -36.71 84.22 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.703 -0.399 . . . . 56.15 111.479 176.678 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 679' ' ' LEU . . . . . . . . . . . . . 17.9 mt -69.25 -40.02 78.12 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 119.476 -0.89 . . . . 58.54 110.971 179.147 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 680' ' ' ALA . . . . . . . . . . . . . . . -57.24 -38.41 73.76 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.65 -0.42 . . . . 57.6 111.234 173.857 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 681' ' ' LYS . . . . . . . . . . . . . 72.9 mttt -63.78 -41.31 97.97 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 120.892 -0.323 . . . . 64.57 111.687 -177.108 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 682' ' ' ILE . . . . . . . . . . . . . 8.7 pt -88.77 11.25 1.78 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.37 0 O-C-N 121.98 -0.45 . . . . 57.56 111.434 -173.975 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 683' ' ' THR . . . . . . . . . . . . . 63.7 p -125.34 29.21 6.11 Favored 'General case' 0 C--O 1.231 0.106 0 O-C-N 122.036 -0.415 . . . . 63.34 111.974 179.144 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -72.04 134.2 45.71 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 108.586 -0.894 . . . . 83.33 108.586 177.943 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 685' ' ' GLY . . . . . . . . . . . . . . . 94.21 -5.59 71.61 Favored Glycine 0 N--CA 1.445 -0.752 0 CA-C-O 119.122 -0.821 . . . . 62.46 114.371 -169.942 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 686' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -80.92 144.32 32.0 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 118.137 0.969 . . . . 73.09 110.375 177.691 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 687' ' ' SER . . . . . . . . . . . . . 93.4 p -87.74 167.67 13.63 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 121.557 0.694 . . . . 54.34 109.847 171.884 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 688' ' ' GLY . . . . . . . . . . . . . . . -58.39 -39.34 92.68 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 119.942 -1.123 . . . . 52.45 112.565 176.349 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 689' ' ' SER . . . . . . . . . . . . . 88.8 p -72.22 -29.23 63.75 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.006 -0.678 . . . . 53.87 111.488 178.918 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 690' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -62.03 -45.06 95.25 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.316 -0.554 . . . . 64.81 111.041 171.658 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 78.8 mt -64.71 -42.4 95.28 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.714 -0.394 . . . . 51.58 111.481 -178.53 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 692' ' ' THR . . . . . . . . . . . . . 28.9 m -56.22 -50.89 69.99 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 120.837 0.351 . . . . 52.22 111.005 177.211 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 693' ' ' ALA . . . . . . . . . . . . . . . -64.32 -37.06 86.18 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.775 -0.37 . . . . 56.63 111.333 179.839 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 694' ' ' LEU . . . . . . . . . . . . . 52.2 tp -59.28 -49.75 76.64 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 120.616 -0.434 . . . . 63.32 111.031 176.031 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 695' ' ' ALA . . . . . . . . . . . . . . . -63.6 -37.79 88.67 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 121.045 -0.262 . . . . 53.89 111.568 179.928 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 696' ' ' LYS . . . . . . . . . . . . . 12.9 mtpt -70.33 -35.38 73.58 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.126 -0.63 . . . . 83.32 111.322 -177.448 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 697' ' ' ASP . . . . . 0.41 ' O ' ' NH2' ' B' ' 704' ' ' ARG . 6.7 t70 -74.64 -36.5 62.89 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 119.722 -0.791 . . . . 73.04 111.084 177.174 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 698' ' ' ALA . . . . . . . . . . . . . . . -65.47 -37.05 85.7 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.086 -0.646 . . . . 57.5 111.137 176.35 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 699' ' ' ALA . . . . . . . . . . . . . . . -63.63 -20.2 65.48 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 112.257 0.466 . . . . 56.73 112.257 178.963 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 36.7 mt -92.8 -0.1 57.32 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 113.004 0.742 . . . . 65.3 113.004 179.533 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 701' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -61.31 -43.88 91.21 Favored Pre-proline 0 C--O 1.244 0.794 0 CA-C-O 117.992 -1.004 . . . . 85.23 113.336 178.769 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 702' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -66.54 -17.19 52.87 Favored 'Trans proline' 0 C--O 1.237 0.466 0 CA-C-N 121.592 1.604 . . . . 81.15 113.42 176.522 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 703' ' ' ILE . . . . . . . . . . . . . 15.3 mm -79.26 -46.98 23.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.365 0 CA-C-N 118.669 0.668 . . . . 73.2 110.284 172.763 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 704' ' ' ARG . . . . . 0.41 ' NH2' ' O ' ' B' ' 697' ' ' ASP . 79.2 mtm-85 -65.46 -22.51 66.76 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.731 0.641 . . . . 82.48 112.731 -176.123 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 705' ' ' GLU . . . . . . . . . . . . . 26.7 pt-20 -83.55 -4.0 58.16 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 112.946 0.721 . . . . 87.17 112.946 -178.367 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 706' ' ' LEU . . . . . . . . . . . . . 6.7 mp -106.49 -176.67 3.14 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 123.942 0.897 . . . . 82.78 108.915 172.138 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 707' ' ' ASN . . . . . . . . . . . . . 32.0 p30 -117.49 172.35 7.39 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.568 0.699 . . . . 90.24 109.414 172.399 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 53.9 t -55.82 -42.05 68.89 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 CA-C-N 115.063 -0.971 . . . . 83.0 110.791 -175.462 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 709' ' ' GLU . . . . . . . . . . . . . . . -63.53 -46.54 85.56 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.412 -0.515 . . . . 82.23 111.037 179.532 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -61.65 -47.36 85.73 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.554 -0.458 . . . . 82.96 111.118 178.06 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 711' ' ' VAL . . . . . . . . . . . . . 95.7 t -62.33 -36.57 75.33 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 CA-C-O 120.99 0.424 . . . . 81.44 110.456 -179.079 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 712' ' ' LYS . . . . . . . . . . . . . . . -64.26 -25.92 68.27 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.427 -0.509 . . . . 85.49 111.853 -179.365 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 713' ' ' CYS . . . . . . . . . . . . . . . -111.19 -5.33 14.74 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 113.684 0.994 . . . . 90.85 113.684 -179.776 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 714' ' ' LEU . . . . . . . . . . . . . . . -64.13 129.69 40.97 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 118.714 0.688 . . . . 90.96 110.854 -175.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 715' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -80.95 153.0 27.74 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.378 0.609 . . . . 103.64 110.669 -177.901 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 716' ' ' ILE . . . . . . . . . . . . . . . -63.93 -28.05 44.11 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 CA-C-N 115.449 -0.796 . . . . 93.64 110.87 179.582 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 717' ' ' SER . . . . . . . . . . . . . . . -70.42 -39.56 74.35 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.446 -0.501 . . . . 94.14 111.341 178.675 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 718' ' ' ALA . . . . . . . . . . . . . . . -81.28 13.69 2.77 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 113.172 0.804 . . . . 84.88 113.172 -179.225 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 719' ' ' MET . . . . . . . . . . . . . 9.0 tpt -77.48 108.61 10.77 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 108.624 -0.88 . . . . 97.25 108.624 176.798 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 720' ' ' ARG . . . . . . . . . . . . . 23.1 ptt85 -73.95 151.46 40.35 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.739 0.78 . . . . 71.87 110.903 -177.218 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 721' ' ' ALA . . . . . . . . . . . . . . . -77.95 156.84 29.99 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.842 0.83 . . . . 76.82 110.691 -178.447 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 722' ' ' ILE . . . . . . . . . . . . . 18.6 mt -67.06 137.65 24.4 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 CA-C-N 115.248 -0.887 . . . . 71.67 109.401 176.443 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 723' ' ' THR . . . . . . . . . . . . . 24.7 p -108.19 165.78 11.23 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.733 0.778 . . . . 69.43 110.576 179.551 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 724' ' ' GLU . . . . . . . . . . . . . 82.1 tt0 -64.53 -29.87 70.9 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.007 -0.997 . . . . 64.4 111.093 173.003 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 725' ' ' GLN . . . . . . . . . . . . . 32.5 tp60 -70.78 -27.27 63.79 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.549 -0.46 . . . . 92.99 111.8 177.934 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 726' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -58.75 -41.72 87.2 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.133 -0.627 . . . . 66.18 110.952 174.966 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 727' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -65.39 -35.79 82.01 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.506 -0.478 . . . . 63.88 111.48 176.767 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 728' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.05 -38.7 92.23 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.162 -0.615 . . . . 71.58 111.24 -177.578 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 729' ' ' SER . . . . . . . . . . . . . 13.2 p -74.37 -32.39 62.73 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 119.951 -0.699 . . . . 75.97 111.605 175.183 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 730' ' ' SER . . . . . . . . . . . . . 41.2 m -68.67 -29.5 67.97 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 120.674 -0.41 . . . . 75.02 111.75 177.958 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 731' ' ' LEU . . . . . . . . . . . . . 22.1 mt -64.09 -19.59 65.36 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 112.152 0.427 . . . . 81.51 112.152 178.339 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 732' ' ' LYS . . . . . . . . . . . . . . . -73.84 -37.22 64.88 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.24 -0.584 . . . . 88.74 111.132 174.246 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 733' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? -79.23 -39.75 32.41 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 112.016 0.376 . . . . 87.01 112.016 -177.535 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 734' ' ' ILE . . . . . . . . . . . . . 82.0 mt -115.43 114.31 45.98 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 N-CA-C 108.138 -1.06 . . . . 88.07 108.138 -170.495 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 735' ' ' ARG . . . . . . . . . . . . . . . -110.09 167.98 9.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.761 0.791 . . . . 88.55 110.623 -177.705 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 736' ' ' ARG . . . . . . . . . . . . . . . -56.96 138.34 54.27 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.041 -0.982 . . . . 81.47 110.356 177.567 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 737' ' ' SER . . . . . 0.445 ' O ' ' O ' ' B' ' 901' ' ' HOH . 67.1 p -94.31 -20.53 19.7 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 113.613 0.968 . . . . 75.96 113.613 -173.308 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 738' ' ' VAL . . . . . . . . . . . . . 17.0 t -114.98 120.23 64.0 Favored 'Isoleucine or valine' 0 C--O 1.238 0.489 0 N-CA-C 108.611 -0.885 . . . . 92.3 108.611 -175.383 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 739' ' ' ALA . . . . . . . . . . . . . . . -77.92 147.96 74.72 Favored Pre-proline 0 C--O 1.234 0.272 0 CA-C-N 116.155 -0.475 . . . . 93.96 110.816 -171.807 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 740' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -59.77 -23.8 73.37 Favored 'Trans proline' 0 C--O 1.238 0.516 0 N-CA-C 113.863 0.678 . . . . 93.63 113.863 -179.57 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 741' ' ' GLN . . . . . . . . . . . . . . . -64.12 -36.49 84.2 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 120.115 -0.634 . . . . 93.33 110.943 172.768 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 742' ' ' SER . . . . . . . . . . . . . 2.1 m -69.18 -36.65 77.55 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.972 -0.291 . . . . 93.97 111.602 -174.771 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 743' ' ' LEU . . . . . . . . . . . . . 2.2 mp -64.68 -37.69 88.44 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 120.001 -0.679 . . . . 89.5 112.134 -176.142 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 744' ' ' ASN . . . . . . . . . . . . . . . -58.54 -35.87 72.99 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.018 -0.673 . . . . 89.27 110.931 -178.991 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 2.6 m -64.9 -49.2 71.39 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 120.609 -0.436 . . . . 82.87 110.985 176.103 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 746' ' ' TYR . . . . . 0.465 ' OH ' ' O ' ' B' ' 629' ' ' ASN . 49.2 m-85 -57.42 -43.01 83.43 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.57 -0.452 . . . . 74.59 111.091 177.317 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 747' ' ' GLU . . . . . . . . . . . . . . . -64.63 -46.79 81.07 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.625 -0.43 . . . . 84.43 110.83 177.456 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 748' ' ' LYS . . . . . . . . . . . . . . . -63.81 -47.24 81.65 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.507 -0.477 . . . . 83.49 110.942 178.845 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 749' ' ' TRP . . . . . . . . . . . . . 12.3 t90 -60.77 -39.3 88.29 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.491 -0.484 . . . . 87.66 111.147 179.571 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 750' ' ' SER . . . . . . . . . . . . . 31.3 t -64.34 -42.61 96.19 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.487 -0.485 . . . . 88.12 111.483 -179.362 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 751' ' ' GLN . . . . . . . . . . . . . . . -72.7 -42.57 64.08 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.15 -0.62 . . . . 95.87 111.453 -175.638 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 752' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -87.42 -26.5 23.25 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 113.475 0.917 . . . . 106.42 113.475 -172.014 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 753' ' ' TYR . . . . . 0.548 ' O ' ' NH1' ' B' ' 645' ' ' ARG . . . -129.46 -12.46 4.44 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 114.333 1.235 . . . . 95.72 114.333 -177.232 . . . . . . . . 2 2 . 1 . 001 ecloud orig full ' B' B ' 754' ' ' GLY . . . . . . . . . . . . . . . -77.74 -137.13 0.99 Allowed Glycine 0 N--CA 1.45 -0.383 0 CA-C-N 119.303 0.956 . . . . 95.4 113.567 -179.387 . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 755' ' ' ASP . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.273 0 O-C-N 122.656 -0.32 . . . . 97.35 111.09 179.615 . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 801' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 802' ' ' SKE . . . . . 0.445 ' N3 ' ' O ' ' B' ' 484' ' ' ASP . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 803' ' ' MPD . . . . . 0.434 ' O2 ' ' O4 ' ' B' ' 803' ' ' MPD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 901' ' ' HOH . . . . . 0.445 ' O ' ' O ' ' B' ' 737' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 . . . . . 0.607 ' O ' ' NE ' ' B' ' 572' ' ' ARG . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud orig full ' B' B ' 905' ' ' HOH . . . . . 0.557 ' O ' ' N ' ' B' ' 599' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 0 . 1 . 001 ecloud orig full ' B' B ' 915' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 916' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 917' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 918' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 919' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 920' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 921' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 922' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 923' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 924' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 925' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 926' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 927' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 928' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 929' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 930' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 931' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 932' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 933' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 934' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 935' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud orig full ' B' B ' 936' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.25 0 N-CA-C 112.191 -0.364 . . . . 81.32 112.191 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 2.6 t -69.55 -36.77 72.61 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 C-N-CA 120.17 -0.612 . . . . 87.57 109.999 171.656 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 462' ' ' GLU . . . . . . . . . . . . . . . -69.69 -31.98 70.32 Favored 'General case' 0 C--O 1.236 0.382 0 O-C-N 121.939 -0.476 . . . . 72.56 111.533 174.299 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 463' ' ' GLN . . . . . . . . . . . . . . . -67.98 -36.08 79.42 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.228 -0.589 . . . . 69.57 111.235 177.329 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 464' ' ' LYS . . . . . . . . . . . . . . . -73.06 -28.91 62.59 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 120.596 -0.442 . . . . 70.87 111.611 178.334 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 465' ' ' LEU . . . . . . . . . . . . . 8.8 mt -64.23 -47.27 80.32 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.005 0.431 . . . . 66.28 110.836 172.844 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 466' ' ' VAL . . . . . . . . . . . . . 7.0 t -61.46 -45.82 97.84 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 CA-C-O 121.139 0.495 . . . . 50.99 110.14 178.139 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 467' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -57.31 -41.87 80.72 Favored 'General case' 0 C--O 1.236 0.378 0 O-C-N 122.1 -0.375 . . . . 69.62 111.395 178.039 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 468' ' ' LEU . . . . . . . . . . . . . 42.1 tp -64.32 -43.94 93.11 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.111 -0.636 . . . . 59.73 111.278 177.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 469' ' ' ILE . . . . . . . . . . . . . 24.8 mt -61.68 -41.22 89.58 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 C-N-CA 120.501 -0.48 . . . . 51.58 110.561 177.569 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 470' ' ' LEU . . . . . . . . . . . . . 43.8 mt -68.88 -30.67 69.22 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 119.513 -0.875 . . . . 51.57 111.529 177.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 471' ' ' ASP . . . . . . . . . . . . . 31.2 m-20 -73.29 -49.33 28.19 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 120.617 -0.433 . . . . 60.36 111.418 -179.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 472' ' ' GLU . . . . . . . . . . . . . 41.4 mm-40 -108.36 -30.66 8.2 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 114.662 1.356 . . . . 72.71 114.662 -162.819 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 473' ' ' ILE . . . . . . . . . . . . . 18.4 mt -102.65 -50.85 9.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 118.535 0.607 . . . . 59.03 111.771 -169.0 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 474' ' ' VAL . . . . . . . . . . . . . 94.8 t -64.2 123.46 17.06 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 N-CA-C 108.368 -0.975 . . . . 52.53 108.368 174.39 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 475' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -94.87 145.51 24.85 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.313 0.578 . . . . 66.98 110.467 -177.558 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 476' ' ' GLY . . . . . . . . . . . . . . . -140.06 -150.67 5.51 Favored Glycine 0 N--CA 1.449 -0.472 0 CA-C-N 115.391 -0.822 . . . . 68.46 111.93 177.51 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 477' ' ' GLY . . . . . . . . . . . . . . . 75.22 -159.38 51.63 Favored Glycine 0 N--CA 1.446 -0.663 0 C-N-CA 118.514 -1.803 . . . . 68.33 110.811 -174.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -68.19 130.23 42.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.854 -0.673 . . . . 68.15 110.473 -177.239 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 479' ' ' LYS . . . . . . . . . . . . . 29.8 mttm -75.95 137.39 40.3 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.087 -0.506 . . . . 90.21 110.188 177.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 480' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -86.42 130.58 36.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 N-CA-C 107.409 -1.33 . . . . 61.65 107.409 172.228 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 481' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -100.37 161.71 13.43 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.557 0.694 . . . . 97.72 110.778 -175.229 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 482' ' ' TRP . . . . . . . . . . . . . 2.6 t-105 -53.59 -42.37 67.56 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.109 -0.951 . . . . 66.3 110.987 177.327 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 483' ' ' THR . . . . . . . . . . . . . 2.5 m -62.95 -29.93 71.18 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 111.749 0.278 . . . . 63.56 111.749 179.982 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 484' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -69.84 -3.08 14.13 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 113.57 0.952 . . . . 72.01 113.57 -177.482 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 485' ' ' ILE . . . . . . . . . . . . . 59.7 mt -105.66 106.17 20.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 N-CA-C 107.72 -1.215 . . . . 60.7 107.72 -177.664 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 486' ' ' ALA . . . . . . . . . . . . . . . -70.93 131.03 43.11 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.783 -0.644 . . . . 67.01 110.52 179.083 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 487' ' ' GLY . . . . . . . . . . . . . . . 66.26 -151.33 52.11 Favored Glycine 0 C--N 1.334 0.42 0 C-N-CA 120.593 -0.813 . . . . 65.44 112.19 177.568 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 488' ' ' GLN . . . . . . . . . . . . . 47.4 mm-40 55.45 37.32 28.72 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.29 0.567 . . . . 71.22 111.009 -177.849 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 489' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -66.74 -28.75 68.66 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.357 -0.537 . . . . 83.39 112.061 -176.818 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 490' ' ' VAL . . . . . . . . . . . . . 43.7 t -63.58 -59.6 4.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 CA-C-O 121.378 0.609 . . . . 68.86 109.86 177.662 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 491' ' ' ALA . . . . . . . . . . . . . . . -59.7 -35.99 75.62 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-N 116.328 -0.397 . . . . 59.42 111.45 178.577 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 492' ' ' LYS . . . . . . . . . . . . . 20.7 mttt -59.49 -49.52 77.46 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 120.838 0.351 . . . . 64.65 111.5 179.118 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . . . -66.7 -36.05 81.57 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 120.456 -0.497 . . . . 57.58 111.278 -178.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 494' ' ' ALA . . . . . . . . . . . . . . . -61.8 -44.06 97.62 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.384 -0.527 . . . . 58.26 111.025 175.422 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 495' ' ' LEU . . . . . . . . . . . . . 41.0 mt -66.83 -31.81 72.67 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.175 -0.61 . . . . 53.62 111.658 179.343 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 496' ' ' GLN . . . . . . . . . . . . . 36.4 mm-40 -62.76 -48.23 80.08 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.454 -0.498 . . . . 61.86 111.159 175.32 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 497' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -67.64 -39.48 84.62 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.106 -0.638 . . . . 86.86 111.605 -177.418 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 498' ' ' MET . . . . . . . . . . . . . 41.1 mtm -93.62 -24.78 17.78 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 113.926 1.084 . . . . 89.05 113.926 -167.515 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 499' ' ' VAL . . . . . . . . . . . . . 16.4 t -123.97 -57.65 2.28 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 119.034 0.834 . . . . 51.83 111.18 -178.54 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 500' ' ' ILE . . . . . . . . . . . . . 44.5 mt -63.73 -62.19 1.32 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.347 0 C-N-CA 120.75 -0.38 . . . . 56.83 110.855 -168.863 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 50.1 mt -56.02 -45.88 99.84 Favored Pre-proline 0 C--O 1.244 0.79 0 CA-C-O 118.251 -0.881 . . . . 65.24 113.074 -178.1 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 502' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -61.94 -27.0 79.39 Favored 'Trans proline' 0 C--O 1.238 0.479 0 CA-C-N 121.558 1.592 . . . . 58.94 113.345 174.487 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 503' ' ' SER . . . . . . . . . . . . . 40.5 t -76.21 -42.79 45.0 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 120.379 -0.528 . . . . 62.08 111.765 179.852 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 504' ' ' VAL . . . . . . . . . . . . . 10.6 m -91.25 -22.68 6.1 Favored 'Isoleucine or valine' 0 C--O 1.24 0.586 0 N-CA-C 113.511 0.93 . . . . 73.21 113.511 -174.015 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 505' ' ' ARG . . . . . . . . . . . . . 51.8 mmm-85 -124.55 68.09 50.46 Favored Pre-proline 0 C--O 1.24 0.553 0 N-CA-C 108.916 -0.772 . . . . 81.21 108.916 174.457 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -65.88 -21.42 57.46 Favored 'Trans proline' 0 C--O 1.238 0.519 0 N-CA-C 114.054 0.751 . . . . 75.6 114.054 -174.662 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 507' ' ' GLU . . . . . . . . . . . . . 22.2 pm0 -68.95 -28.67 66.84 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 118.812 0.733 . . . . 85.5 111.741 -179.119 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 508' ' ' LEU . . . . . . . . . . . . . 12.8 mt -81.46 4.17 22.04 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 112.996 0.739 . . . . 77.87 112.996 177.715 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 509' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -135.36 49.87 2.16 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.784 0.802 . . . . 71.07 110.323 -174.791 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 510' ' ' THR . . . . . . . . . . . . . 17.0 p -99.99 167.71 10.32 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.8 0.81 . . . . 72.23 110.09 175.089 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 511' ' ' GLY . . . . . . . . . . . . . . . 63.0 -122.95 29.02 Favored Glycine 0 C--O 1.237 0.317 0 CA-C-N 115.125 -0.943 . . . . 65.07 111.664 175.422 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 512' ' ' LEU . . . . . . . . . . . . . 59.3 mt -69.59 -13.37 62.28 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 112.951 0.723 . . . . 60.65 112.951 -179.553 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 513' ' ' ARG . . . . . . . . . . . . . 92.1 mtm-85 -96.73 12.92 30.21 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 118.563 0.62 . . . . 69.13 112.539 176.573 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 514' ' ' ALA . . . . . . . . . . . . . . . -60.95 132.88 92.22 Favored Pre-proline 0 C--O 1.241 0.638 0 CA-C-N 117.911 0.323 . . . . 61.31 110.396 -177.392 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 515' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -74.74 156.47 44.17 Favored 'Trans proline' 0 CA--C 1.517 -0.345 0 CA-C-O 121.855 0.689 . . . . 61.42 112.033 -172.792 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 516' ' ' ALA . . . . . . . . . . . . . . . -74.08 153.83 39.45 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.016 -0.993 . . . . 60.7 109.823 171.267 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 517' ' ' LYS . . . . . 0.47 ' NZ ' ' O ' ' B' ' 620' ' ' ASP . 5.5 mttm -102.76 -4.71 24.58 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.74 -0.663 . . . . 86.03 112.512 -179.892 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 518' ' ' GLY . . . . . . . . . . . . . . . -139.48 128.84 4.12 Favored Glycine 0 N--CA 1.448 -0.536 0 N-CA-C 112.111 -0.396 . . . . 54.98 112.111 176.315 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 519' ' ' LEU . . . . . . . . . . . . . 9.8 tt -132.75 140.85 48.25 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 109.251 -0.648 . . . . 55.69 109.251 -179.024 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 520' ' ' LEU . . . . . 0.455 HD11 HG22 ' B' ' 628' ' ' THR . 32.2 tp -107.99 131.05 54.97 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 123.026 0.53 . . . . 50.27 109.905 -179.228 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 521' ' ' LEU . . . . . 0.425 ' O ' ' HA ' ' B' ' 627' ' ' ALA . 23.5 mt -105.69 132.24 52.07 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.324 -0.991 . . . . 56.63 108.324 168.741 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 35.5 p90 -141.94 153.09 44.1 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.27 0.557 . . . . 54.8 109.815 -176.89 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 523' ' ' GLY . . . . . . . . . . . . . . . 151.77 -175.59 30.49 Favored Glycine 0 N--CA 1.439 -1.138 0 CA-C-N 115.138 -0.937 . . . . 52.53 110.913 179.874 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -66.15 153.76 76.79 Favored 'Trans proline' 0 C--O 1.241 0.669 0 C-N-CA 120.861 1.041 . . . . 61.98 111.412 -177.693 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 525' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -68.08 151.44 77.39 Favored 'Trans proline' 0 C--N 1.332 -0.304 0 C-N-CA 120.308 0.672 . . . . 61.62 112.267 -179.752 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . 76.82 22.45 71.95 Favored Glycine 0 C--N 1.334 0.439 0 CA-C-N 115.094 -0.957 . . . . 55.05 115.362 175.742 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 527' ' ' CYS . . . . . 0.518 ' SG ' HD23 ' B' ' 650' ' ' LEU . 92.5 m -112.0 5.98 19.08 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 118.275 1.037 . . . . 58.64 113.37 -176.92 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 528' ' ' GLY . . . . . . . . . . . . . . . 103.39 21.06 10.22 Favored Glycine 0 N--CA 1.447 -0.589 0 N-CA-C 117.394 1.717 . . . . 51.91 117.394 170.804 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 529' ' ' LYS . . . . . . . . . . . . . 36.7 mtmm -64.14 -48.3 76.56 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 119.097 1.449 . . . . 47.77 110.819 175.808 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 530' ' ' THR . . . . . 0.553 ' O ' ' HG3' ' B' ' 534' ' ' ARG . 53.1 m -59.78 -51.62 68.95 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.556 -0.458 . . . . 44.29 110.888 176.028 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 531' ' ' LEU . . . . . . . . . . . . . 50.2 mt -58.18 -39.68 79.53 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.632 -0.427 . . . . 70.1 111.546 -179.058 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 532' ' ' LEU . . . . . . . . . . . . . 16.1 mt -63.9 -39.23 93.69 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 119.928 -0.709 . . . . 56.2 111.01 177.438 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 533' ' ' ALA . . . . . . . . . . . . . . . -64.43 -43.97 92.66 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 120.46 -0.496 . . . . 43.26 111.399 179.035 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 534' ' ' ARG . . . . . 0.553 ' HG3' ' O ' ' B' ' 530' ' ' THR . 35.6 mtp180 -59.49 -46.86 87.61 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.605 -0.438 . . . . 86.64 111.079 177.077 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 535' ' ' ALA . . . . . . . . . . . . . . . -64.11 -35.02 79.38 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 119.921 -0.712 . . . . 44.66 111.966 179.159 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 536' ' ' VAL . . . . . . . . . . . . . 40.8 t -57.97 -43.58 85.11 Favored 'Isoleucine or valine' 0 C--O 1.237 0.439 0 C-N-CA 120.042 -0.663 . . . . 44.81 110.415 174.634 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 537' ' ' ALA . . . . . . . . . . . . . . . -63.17 -42.06 99.34 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 120.26 -0.576 . . . . 44.23 111.304 177.784 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 538' ' ' THR . . . . . . . . . . . . . 34.7 m -57.39 -47.93 80.39 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-O 121.055 0.455 . . . . 48.12 110.839 174.65 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 539' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -60.93 -32.08 71.6 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 112.088 0.403 . . . . 60.95 112.088 179.174 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 540' ' ' CYS . . . . . . . . . . . . . 93.5 m -88.18 -2.91 58.88 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 113.197 0.814 . . . . 53.24 113.197 -178.413 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 541' ' ' SER . . . . . . . . . . . . . 18.2 m 52.33 48.19 23.15 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 122.099 0.952 . . . . 59.8 110.111 -169.29 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 542' ' ' ALA . . . . . . . . . . . . . . . -117.89 151.25 37.77 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.497 -0.774 . . . . 52.35 110.938 -172.449 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 543' ' ' THR . . . . . . . . . . . . . 23.7 m -67.31 133.17 49.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.259 -0.882 . . . . 48.65 109.267 170.375 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 544' ' ' PHE . . . . . 0.448 ' CE2' ' HB2' ' B' ' 546' ' ' ASN . 74.5 t80 -103.52 118.48 36.84 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.123 -0.695 . . . . 44.82 109.123 179.043 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 545' ' ' LEU . . . . . . . . . . . . . 5.3 mp -111.52 113.78 26.42 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 107.341 -1.355 . . . . 50.28 107.341 179.146 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 546' ' ' ASN . . . . . 0.448 ' HB2' ' CE2' ' B' ' 544' ' ' PHE . 53.3 t-20 -110.56 109.28 19.54 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.436 -0.95 . . . . 53.36 108.436 -172.21 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 547' ' ' ILE . . . . . 0.666 HD11 HD13 ' B' ' 552' ' ' LEU . 4.3 tp -116.26 126.43 73.74 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 N-CA-C 108.562 -0.903 . . . . 66.04 108.562 178.861 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 548' ' ' SER . . . . . . . . . . . . . 1.8 t -86.33 113.46 22.33 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 108.363 -0.977 . . . . 78.15 108.363 175.454 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 549' ' ' ALA . . . . . . . . . . . . . . . -63.95 -34.55 78.24 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.327 -0.549 . . . . 71.51 111.896 -178.535 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -62.44 -54.96 32.51 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.003 0.43 . . . . 79.94 110.947 -179.77 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 1.7 p -70.29 5.65 1.64 Allowed 'General case' 0 C--O 1.24 0.564 0 N-CA-C 112.931 0.715 . . . . 81.16 112.931 176.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 552' ' ' LEU . . . . . 0.666 HD13 HD11 ' B' ' 547' ' ' ILE . 36.5 tp -97.61 -47.78 5.5 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 123.463 0.705 . . . . 86.64 112.387 -178.554 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . . . -67.25 -21.3 65.73 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 112.429 0.529 . . . . 108.79 112.429 -178.676 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 554' ' ' SER . . . . . . . . . . . . . . . -74.01 -172.16 1.28 Allowed 'General case' 0 C--O 1.235 0.341 0 CA-C-O 122.213 1.006 . . . . 95.34 110.125 -174.148 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 555' ' ' LYS . . . . . . . . . . . . . . . -80.85 56.21 2.65 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.958 -0.564 . . . . 96.41 112.156 -173.936 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 556' ' ' TYR . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.315 0 CA-C-O 120.853 0.358 . . . . 88.28 110.814 177.967 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 560' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.267 0 CA-C-O 120.915 0.175 . . . . 81.07 113.139 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 561' ' ' GLU . . . . . . . . . . . . . . . -70.09 -37.87 75.53 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.554 -0.458 . . . . 82.5 111.379 178.695 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 562' ' ' LYS . . . . . . . . . . . . . . . -70.69 -33.91 71.4 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.635 -0.426 . . . . 72.88 111.911 -177.421 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 563' ' ' LEU . . . . . . . . . . . . . 7.6 tp -65.9 -48.69 70.64 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 120.194 -0.602 . . . . 65.93 110.935 177.813 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 564' ' ' VAL . . . . . . . . . . . . . 89.0 t -56.54 -40.78 70.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 CA-C-O 121.011 0.434 . . . . 63.36 110.319 175.669 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 565' ' ' ARG . . . . . . . . . . . . . 21.1 ttm180 -64.67 -39.92 94.52 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.295 -0.562 . . . . 67.92 111.134 177.925 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 566' ' ' ALA . . . . . . . . . . . . . . . -72.27 -29.25 63.72 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.396 -0.522 . . . . 56.69 111.676 179.222 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 567' ' ' LEU . . . . . . . . . . . . . 27.6 tp -65.44 -52.07 55.77 Favored 'General case' 0 C--O 1.239 0.5 0 CA-C-O 120.803 0.335 . . . . 60.14 111.069 178.423 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 35.1 m-85 -64.33 -30.88 71.92 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.621 -0.432 . . . . 53.47 111.575 177.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 569' ' ' ALA . . . . . . . . . . . . . . . -67.86 -44.7 76.51 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.711 -0.396 . . . . 57.11 110.942 176.358 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 570' ' ' VAL . . . . . . . . . . . . . 12.0 t -62.32 -37.91 79.83 Favored 'Isoleucine or valine' 0 C--O 1.237 0.447 0 C-N-CA 120.509 -0.476 . . . . 55.85 110.291 174.573 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 571' ' ' ALA . . . . . . . . . . . . . . . -59.99 -41.56 92.31 Favored 'General case' 0 C--O 1.237 0.424 0 O-C-N 121.872 -0.518 . . . . 59.25 111.413 176.969 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 572' ' ' ARG . . . . . . . . . . . . . 15.4 mtt85 -65.41 -42.16 92.83 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.419 -0.513 . . . . 76.55 111.384 179.388 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 573' ' ' HIS . . . . . . . . . . . . . 48.2 m170 -70.87 -20.24 62.54 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 112.753 0.649 . . . . 79.2 112.753 -177.528 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 574' ' ' MET . . . . . . . . . . . . . 82.6 mtp -111.31 17.9 19.78 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 118.503 0.592 . . . . 64.6 112.438 -178.623 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 575' ' ' GLN . . . . . . . . . . . . . 29.9 pt20 -67.64 152.91 95.86 Favored Pre-proline 0 N--CA 1.45 -0.453 0 C-N-CA 120.61 -0.436 . . . . 89.13 110.868 -174.514 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 576' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -64.0 136.77 25.18 Favored 'Cis proline' 0 C--N 1.347 0.485 0 C-N-CA 128.015 0.423 . . . . 60.53 112.601 1.175 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 577' ' ' SER . . . . . . . . . . . . . 48.7 m -134.17 149.5 51.04 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 121.388 0.614 . . . . 55.62 110.11 -171.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 578' ' ' ILE . . . . . . . . . . . . . 10.1 mt -120.83 117.0 51.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 N-CA-C 107.555 -1.276 . . . . 54.06 107.555 172.561 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 579' ' ' ILE . . . . . . . . . . . . . 49.5 mt -94.04 118.92 41.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 107.296 -1.372 . . . . 44.19 107.296 174.615 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 580' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -113.7 123.94 51.09 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 108.607 -0.886 . . . . 42.96 108.607 -177.793 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 581' ' ' ILE . . . . . . . . . . . . . 5.7 mt -110.99 109.28 27.9 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 N-CA-C 107.569 -1.271 . . . . 68.25 107.569 178.116 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 34.3 t0 -77.22 140.87 40.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.954 -0.566 . . . . 82.24 109.834 176.042 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 583' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 51.13 55.06 10.11 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 121.833 0.825 . . . . 93.29 111.005 178.454 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 584' ' ' VAL . . . . . . . . . . . . . 9.5 p -60.96 -21.11 23.45 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 CA-C-N 115.085 -0.961 . . . . 62.61 111.841 -176.391 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 585' ' ' ASP . . . . . 0.488 ' OD2' ' NH1' ' B' ' 630' ' ' ARG . 3.7 p-10 -64.2 -30.62 71.67 Favored 'General case' 0 C--O 1.237 0.401 0 O-C-N 122.148 -0.345 . . . . 69.08 111.879 179.274 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 53.7 p -73.55 -11.56 60.48 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 112.605 0.594 . . . . 74.74 112.605 177.096 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 587' ' ' LEU . . . . . . . . . . . . . 4.3 mt -78.83 -86.13 0.07 Allowed 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.017 -0.735 . . . . 78.55 109.017 162.341 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 588' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 115.94 -0.573 . . . . 75.24 111.152 178.561 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 599' ' ' SER . . . . . 0.557 ' N ' ' O ' ' B' ' 905' ' ' HOH . . . . . . . . 0 C--O 1.232 0.169 0 CA-C-O 120.823 0.345 . . . . 85.43 110.883 . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 600' ' ' ARG . . . . . . . . . . . . . . . -67.45 -28.62 68.03 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.439 -0.504 . . . . 80.2 111.59 177.342 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 601' ' ' ARG . . . . . . . . . . . . . . . -69.96 -28.48 65.59 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.671 -0.412 . . . . 76.48 111.893 179.995 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 602' ' ' LEU . . . . . . . . . . . . . 1.1 tt -78.36 -47.09 18.43 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.165 -0.614 . . . . 76.51 111.44 -178.3 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 603' ' ' LYS . . . . . . . . . . . . . . . -58.46 -37.87 76.36 Favored 'General case' 0 C--O 1.239 0.5 0 C-N-CA 120.559 -0.456 . . . . 66.25 111.118 176.576 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 604' ' ' THR . . . . . . . . . . . . . 2.2 m -65.44 -46.13 81.09 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.887 0.375 . . . . 72.26 111.212 179.828 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 605' ' ' GLU . . . . . . . . . . . . . 45.0 tp10 -65.62 -27.03 68.09 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.162 -0.615 . . . . 89.66 111.644 179.59 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 606' ' ' PHE . . . . . . . . . . . . . 54.8 t80 -68.25 -49.02 63.48 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 119.082 -1.047 . . . . 80.69 110.968 172.692 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 607' ' ' LEU . . . . . . . . . . . . . 72.4 mt -56.47 -43.08 79.25 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.6 -0.44 . . . . 71.21 111.104 177.31 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 608' ' ' VAL . . . . . . . . . . . . . 44.7 t -62.0 -39.24 83.01 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 CA-C-O 120.894 0.378 . . . . 62.29 110.619 179.814 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 609' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -73.13 -39.67 65.52 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 119.913 -0.715 . . . . 72.67 111.254 -178.761 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -61.28 -44.53 97.08 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 120.337 -0.545 . . . . 74.86 111.121 176.264 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 611' ' ' ASP . . . . . 0.468 ' OD1' ' NH2' ' B' ' 641' ' ' ARG . 82.8 m-20 -67.31 -29.8 69.47 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.615 -0.434 . . . . 72.86 112.032 -176.564 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 612' ' ' GLY . . . . . . . . . . . . . . . -84.38 12.1 56.31 Favored Glycine 0 N--CA 1.447 -0.589 0 N-CA-C 115.589 0.995 . . . . 70.78 115.589 177.337 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 613' ' ' LEU . . . . . . . . . . . . . 12.3 mt -70.74 -50.07 13.63 Favored Pre-proline 0 C--O 1.248 0.998 0 CA-C-N 118.072 0.936 . . . . 70.28 112.422 -177.517 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 614' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo . . . . . 0 C--N 1.344 0.316 0 C-N-CA 116.419 -1.921 . . . . 93.42 112.385 179.044 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 617' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo . . . . . 0 C--O 1.233 0.239 0 CA-C-O 120.559 0.15 . . . . 106.16 112.204 . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 618' ' ' ASP . . . . . . . . . . . . . . . -100.09 21.57 12.63 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 116.019 -0.537 . . . . 101.11 111.988 171.905 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 619' ' ' GLY . . . . . . . . . . . . . . . -135.05 -90.64 0.34 Allowed Glycine 0 N--CA 1.449 -0.465 0 CA-C-O 120.045 -0.309 . . . . 93.21 112.622 178.757 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 620' ' ' ASP . . . . . 0.47 ' O ' ' NZ ' ' B' ' 517' ' ' LYS . . . 86.54 -49.75 0.05 Allowed 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 126.751 2.02 . . . . 82.86 112.712 176.539 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 621' ' ' ARG . . . . . . . . . . . . . 44.2 mtp180 -86.34 69.39 10.43 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 122.675 1.226 . . . . 85.07 110.486 -173.286 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 622' ' ' ILE . . . . . . . . . . . . . 57.1 mt -136.93 137.35 47.1 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-N 114.669 -1.15 . . . . 57.46 108.17 176.498 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 623' ' ' VAL . . . . . . . . . . . . . 3.3 p -124.38 138.57 53.46 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 N-CA-C 108.049 -1.093 . . . . 60.67 108.049 171.795 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 624' ' ' VAL . . . . . . . . . . . . . 84.3 t -105.34 117.5 51.15 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 108.108 -1.071 . . . . 49.47 108.108 -179.862 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 625' ' ' LEU . . . . . . . . . . . . . 52.3 mt -104.75 128.23 52.8 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.625 -0.88 . . . . 51.83 108.625 171.346 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 626' ' ' ALA . . . . . . . . . . . . . . . -117.38 146.48 43.39 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.852 -0.796 . . . . 46.99 108.852 177.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 627' ' ' ALA . . . . . 0.425 ' HA ' ' O ' ' B' ' 521' ' ' LEU . . . -127.39 146.2 50.55 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.258 -0.645 . . . . 46.44 109.258 179.725 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 628' ' ' THR . . . . . 0.455 HG22 HD11 ' B' ' 520' ' ' LEU . 7.1 t -152.05 144.21 23.91 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.91 -0.586 . . . . 57.8 109.5 176.291 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 629' ' ' ASN . . . . . . . . . . . . . 40.6 m-20 -95.17 -2.28 50.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.737 -0.665 . . . . 64.34 112.125 168.596 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 630' ' ' ARG . . . . . 0.488 ' NH1' ' OD2' ' B' ' 585' ' ' ASP . 19.3 mtt85 -133.16 71.22 77.44 Favored Pre-proline 0 C--O 1.237 0.418 0 C-N-CA 123.363 0.665 . . . . 94.58 109.268 178.696 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 631' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -62.99 -26.1 74.0 Favored 'Trans proline' 0 C--O 1.238 0.514 0 N-CA-C 113.157 0.407 . . . . 65.78 113.157 178.529 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 632' ' ' GLN . . . . . . . . . . . . . . . -65.98 -16.05 63.55 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 112.291 0.478 . . . . 81.62 112.291 177.783 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 633' ' ' GLU . . . . . . . . . . . . . . . -94.66 6.0 50.2 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 112.987 0.736 . . . . 78.08 112.987 -177.545 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 634' ' ' LEU . . . . . . . . . . . . . 95.3 mt -85.84 146.85 26.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.183 0.516 . . . . 87.63 110.17 176.717 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 635' ' ' ASP . . . . . . . . . . . . . 37.7 p-10 -97.66 179.82 4.71 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.836 0.827 . . . . 91.05 110.509 -177.665 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 636' ' ' GLU . . . . . . . . . . . . . . . -66.69 -30.58 70.86 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.523 -0.762 . . . . 85.11 111.812 -177.662 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 637' ' ' ALA . . . . . . . . . . . . . . . -62.2 -41.0 97.95 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 120.296 -0.562 . . . . 83.95 111.107 177.249 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 638' ' ' ALA . . . . . . . . . . . . . . . -72.92 -44.69 60.92 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.475 -0.49 . . . . 74.22 111.226 179.172 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 639' ' ' LEU . . . . . . . . . . . . . 9.4 mt -65.53 -32.83 74.63 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 112.276 0.473 . . . . 81.52 112.276 -172.96 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 640' ' ' ARG . . . . . . . . . . . . . . . -75.88 -19.85 58.52 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 112.764 0.653 . . . . 75.0 112.764 -179.024 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 641' ' ' ARG . . . . . 0.468 ' NH2' ' OD1' ' B' ' 611' ' ' ASP . 27.8 mtt85 -93.83 -24.62 17.69 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 112.897 0.702 . . . . 86.07 112.897 178.45 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 642' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -104.35 82.34 1.92 Allowed 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 107.567 -1.272 . . . . 72.99 107.567 175.984 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 643' ' ' THR . . . . . . . . . . . . . 6.8 p -61.51 -65.58 0.67 Allowed 'General case' 0 C--O 1.235 0.306 0 CA-C-N 114.623 -1.171 . . . . 84.09 110.225 178.759 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 644' ' ' LYS . . . . . . . . . . . . . 51.1 mmtt -73.41 129.68 38.52 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.39 -0.368 . . . . 86.83 110.307 -178.914 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 645' ' ' ARG . . . . . 0.548 ' NH1' ' O ' ' B' ' 753' ' ' TYR . 22.9 mtt180 -130.99 135.5 47.68 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 108.803 -0.814 . . . . 89.77 108.803 178.006 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 646' ' ' VAL . . . . . . . . . . . . . 15.5 t -125.0 127.65 72.54 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 N-CA-C 108.989 -0.745 . . . . 65.92 108.989 -178.311 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 647' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -83.84 136.3 34.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.057 -0.52 . . . . 62.1 109.914 179.45 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 648' ' ' VAL . . . . . . . . . . . . . 74.0 t -123.68 99.45 6.53 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 N-CA-C 106.649 -1.612 . . . . 51.13 106.649 179.888 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 649' ' ' SER . . . . . . . . . . . . . 71.2 p -86.28 170.91 11.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 122.042 0.925 . . . . 65.04 111.924 -168.998 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 650' ' ' LEU . . . . . 0.518 HD23 ' SG ' ' B' ' 527' ' ' CYS . 31.6 mt -55.43 146.65 42.14 Favored Pre-proline 0 N--CA 1.452 -0.341 0 CA-C-N 114.919 -1.037 . . . . 61.55 109.29 165.273 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 651' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -72.68 140.84 33.16 Favored 'Trans proline' 0 C--N 1.33 -0.429 0 N-CA-C 110.929 -0.45 . . . . 55.51 110.929 -179.294 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 652' ' ' ASP . . . . . 0.419 ' O ' ' HG3' ' B' ' 656' ' ' ARG . 48.5 p-10 -83.25 -175.64 5.93 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.526 0.679 . . . . 73.19 109.59 176.538 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 653' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -62.02 -46.38 89.43 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.387 -0.525 . . . . 77.92 111.679 -169.861 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 654' ' ' GLN . . . . . . . . . . . . . . . -62.93 -33.61 75.71 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 120.265 -0.574 . . . . 55.7 111.732 -178.199 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 655' ' ' THR . . . . . . . . . . . . . 85.8 m -73.64 -41.38 62.83 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.53 -0.468 . . . . 64.26 111.135 177.638 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 656' ' ' ARG . . . . . 0.419 ' HG3' ' O ' ' B' ' 652' ' ' ASP . 86.5 mtm-85 -59.28 -39.57 83.36 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.139 -0.624 . . . . 59.55 110.867 176.495 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 657' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -59.22 -47.31 85.8 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.951 -0.299 . . . . 74.42 110.821 176.869 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 658' ' ' LEU . . . . . . . . . . . . . 24.7 mt -65.57 -37.96 88.18 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 120.42 -0.512 . . . . 69.65 111.29 179.491 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 659' ' ' LEU . . . . . 0.582 HD21 ' C1 ' ' B' ' 802' ' ' SKE . 22.8 mt -64.03 -53.69 45.94 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.783 -0.367 . . . . 70.47 111.249 179.654 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 46.6 mt -57.09 -34.89 68.77 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 120.682 -0.407 . . . . 53.88 111.023 176.266 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 661' ' ' ASN . . . . . . . . . . . . . 45.4 t-20 -61.7 -51.75 67.11 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.533 -0.467 . . . . 57.59 110.704 173.86 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 662' ' ' ARG . . . . . 0.545 HH22 ' HE3' ' B' ' 666' ' ' LYS . 9.3 ttt-85 -60.15 -40.74 90.92 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.757 -0.377 . . . . 83.77 111.239 -179.956 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 38.2 mt -66.84 -37.66 84.9 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.676 -0.41 . . . . 54.33 111.901 -177.817 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 664' ' ' LEU . . . . . . . . . . . . . 26.8 mt -84.31 -9.12 58.74 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 113.082 0.771 . . . . 59.85 113.082 -175.873 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 665' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -62.06 -26.22 68.14 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.131 -0.628 . . . . 71.59 111.332 169.205 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 666' ' ' LYS . . . . . 0.545 ' HE3' HH22 ' B' ' 662' ' ' ARG . 2.3 mttm -67.1 -14.1 62.58 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 112.803 0.668 . . . . 87.68 112.803 178.014 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 667' ' ' GLN . . . . . . . . . . . . . 16.9 mm-40 -120.89 22.25 11.14 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 118.442 0.564 . . . . 80.98 112.142 -179.833 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 668' ' ' GLY . . . . . . . . . . . . . . . 84.15 22.2 55.29 Favored Glycine 0 N--CA 1.449 -0.438 0 N-CA-C 115.565 0.986 . . . . 73.66 115.565 178.815 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 669' ' ' SER . . . . . . . . . . . . . 59.2 m 46.3 67.0 4.76 Favored Pre-proline 0 C--O 1.236 0.37 0 C-N-CA 125.158 1.383 . . . . 68.24 111.96 177.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 670' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -76.95 -11.12 18.1 Favored 'Trans proline' 0 C--O 1.239 0.541 0 N-CA-C 115.058 1.138 . . . . 66.0 115.058 -174.054 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 671' ' ' LEU . . . . . . . . . . . . . 44.1 mt -115.29 140.63 48.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 119.501 1.046 . . . . 58.04 110.618 -175.065 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 6.1 p30 -78.07 178.28 7.65 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-O 122.038 0.923 . . . . 67.63 110.437 -179.81 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 673' ' ' THR . . . . . . . . . . . . . 13.2 m -64.7 -33.51 76.13 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 115.597 -0.728 . . . . 74.07 111.897 -177.67 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 674' ' ' GLU . . . . . . . . . . . . . 15.8 mp0 -67.29 -41.36 85.57 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 120.306 -0.558 . . . . 85.24 111.151 179.394 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 675' ' ' ALA . . . . . . . . . . . . . . . -63.93 -40.55 96.72 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 120.25 -0.58 . . . . 55.9 111.682 178.725 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 676' ' ' LEU . . . . . . . . . . . . . 5.0 mt -74.43 -28.47 61.07 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 120.459 -0.496 . . . . 62.2 111.792 -179.308 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 677' ' ' ARG . . . . . . . . . . . . . . . -64.84 -42.25 95.06 Favored 'General case' 0 C--N 1.329 -0.283 0 O-C-N 121.865 -0.522 . . . . 54.19 110.375 169.891 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 678' ' ' ARG . . . . . . . . . . . . . 90.3 mtm-85 -65.85 -36.71 84.22 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.703 -0.399 . . . . 56.15 111.479 176.678 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 679' ' ' LEU . . . . . 0.484 HD23 HD11 ' B' ' 682' ' ' ILE . 17.9 mt -69.25 -40.02 78.12 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 119.476 -0.89 . . . . 58.54 110.971 179.147 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 680' ' ' ALA . . . . . . . . . . . . . . . -57.24 -38.41 73.76 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.65 -0.42 . . . . 57.6 111.234 173.857 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 681' ' ' LYS . . . . . . . . . . . . . 72.9 mttt -63.78 -41.31 97.97 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 120.892 -0.323 . . . . 64.57 111.687 -177.108 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 682' ' ' ILE . . . . . 0.484 HD11 HD23 ' B' ' 679' ' ' LEU . 8.7 pt -88.77 11.25 1.78 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.37 0 O-C-N 121.98 -0.45 . . . . 57.56 111.434 -173.975 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 683' ' ' THR . . . . . . . . . . . . . 63.7 p -125.34 29.21 6.11 Favored 'General case' 0 C--O 1.231 0.106 0 O-C-N 122.036 -0.415 . . . . 63.34 111.974 179.144 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -72.04 134.2 45.71 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 108.586 -0.894 . . . . 83.33 108.586 177.943 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 685' ' ' GLY . . . . . . . . . . . . . . . 94.21 -5.59 71.61 Favored Glycine 0 N--CA 1.445 -0.752 0 CA-C-O 119.122 -0.821 . . . . 62.46 114.371 -169.942 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 686' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -80.92 144.32 32.0 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 118.137 0.969 . . . . 73.09 110.375 177.691 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 687' ' ' SER . . . . . . . . . . . . . 93.4 p -87.74 167.67 13.63 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 121.557 0.694 . . . . 54.34 109.847 171.884 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 688' ' ' GLY . . . . . . . . . . . . . . . -58.39 -39.34 92.68 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 119.942 -1.123 . . . . 52.45 112.565 176.349 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 689' ' ' SER . . . . . . . . . . . . . 88.8 p -72.22 -29.23 63.75 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.006 -0.678 . . . . 53.87 111.488 178.918 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 690' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -62.03 -45.06 95.25 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.316 -0.554 . . . . 64.81 111.041 171.658 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 78.8 mt -64.71 -42.4 95.28 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.714 -0.394 . . . . 51.58 111.481 -178.53 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 692' ' ' THR . . . . . . . . . . . . . 28.9 m -56.22 -50.89 69.99 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 120.837 0.351 . . . . 52.22 111.005 177.211 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 693' ' ' ALA . . . . . . . . . . . . . . . -64.32 -37.06 86.18 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.775 -0.37 . . . . 56.63 111.333 179.839 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 694' ' ' LEU . . . . . . . . . . . . . 52.2 tp -59.28 -49.75 76.64 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 120.616 -0.434 . . . . 63.32 111.031 176.031 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 695' ' ' ALA . . . . . . . . . . . . . . . -63.6 -37.79 88.67 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 121.045 -0.262 . . . . 53.89 111.568 179.928 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 696' ' ' LYS . . . . . . . . . . . . . 12.9 mtpt -70.33 -35.38 73.58 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.126 -0.63 . . . . 83.32 111.322 -177.448 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 697' ' ' ASP . . . . . 0.41 ' O ' ' NH2' ' B' ' 704' ' ' ARG . 6.7 t70 -74.64 -36.5 62.89 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 119.722 -0.791 . . . . 73.04 111.084 177.174 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 698' ' ' ALA . . . . . . . . . . . . . . . -65.47 -37.05 85.7 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.086 -0.646 . . . . 57.5 111.137 176.35 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 699' ' ' ALA . . . . . . . . . . . . . . . -63.63 -20.2 65.48 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 112.257 0.466 . . . . 56.73 112.257 178.963 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 36.7 mt -92.8 -0.1 57.32 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 113.004 0.742 . . . . 65.3 113.004 179.533 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 701' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -61.31 -43.88 91.21 Favored Pre-proline 0 C--O 1.244 0.794 0 CA-C-O 117.992 -1.004 . . . . 85.23 113.336 178.769 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 702' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -66.54 -17.19 52.87 Favored 'Trans proline' 0 C--O 1.237 0.466 0 CA-C-N 121.592 1.604 . . . . 81.15 113.42 176.522 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 703' ' ' ILE . . . . . . . . . . . . . 15.3 mm -79.26 -46.98 23.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.365 0 CA-C-N 118.669 0.668 . . . . 73.2 110.284 172.763 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 704' ' ' ARG . . . . . 0.41 ' NH2' ' O ' ' B' ' 697' ' ' ASP . 79.2 mtm-85 -65.46 -22.51 66.76 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.731 0.641 . . . . 82.48 112.731 -176.123 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 705' ' ' GLU . . . . . . . . . . . . . 26.7 pt-20 -83.55 -4.0 58.16 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 112.946 0.721 . . . . 87.17 112.946 -178.367 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 706' ' ' LEU . . . . . . . . . . . . . 6.7 mp -106.49 -176.67 3.14 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 123.942 0.897 . . . . 82.78 108.915 172.138 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 707' ' ' ASN . . . . . . . . . . . . . 32.0 p30 -117.49 172.35 7.39 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.568 0.699 . . . . 90.24 109.414 172.399 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 53.9 t -55.82 -42.05 68.89 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 CA-C-N 115.063 -0.971 . . . . 83.0 110.791 -175.462 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 709' ' ' GLU . . . . . . . . . . . . . . . -63.53 -46.54 85.56 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.412 -0.515 . . . . 82.23 111.037 179.532 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -61.65 -47.36 85.73 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.554 -0.458 . . . . 82.96 111.118 178.06 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 711' ' ' VAL . . . . . . . . . . . . . 95.7 t -62.33 -36.57 75.33 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 CA-C-O 120.99 0.424 . . . . 81.44 110.456 -179.079 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 712' ' ' LYS . . . . . . . . . . . . . . . -64.26 -25.92 68.27 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.427 -0.509 . . . . 85.49 111.853 -179.365 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 713' ' ' CYS . . . . . . . . . . . . . . . -111.19 -5.33 14.74 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 113.684 0.994 . . . . 90.85 113.684 -179.776 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 714' ' ' LEU . . . . . . . . . . . . . . . -64.13 129.69 40.97 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 118.714 0.688 . . . . 90.96 110.854 -175.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 715' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -80.95 153.0 27.74 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.378 0.609 . . . . 103.64 110.669 -177.901 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 716' ' ' ILE . . . . . . . . . . . . . . . -63.93 -28.05 44.11 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 CA-C-N 115.449 -0.796 . . . . 93.64 110.87 179.582 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 717' ' ' SER . . . . . . . . . . . . . . . -70.42 -39.56 74.35 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.446 -0.501 . . . . 94.14 111.341 178.675 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 718' ' ' ALA . . . . . . . . . . . . . . . -81.28 13.69 2.77 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 113.172 0.804 . . . . 84.88 113.172 -179.225 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 719' ' ' MET . . . . . . . . . . . . . 9.0 tpt -77.48 108.61 10.77 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 108.624 -0.88 . . . . 97.25 108.624 176.798 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 720' ' ' ARG . . . . . . . . . . . . . 23.1 ptt85 -73.95 151.46 40.35 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.739 0.78 . . . . 71.87 110.903 -177.218 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 721' ' ' ALA . . . . . . . . . . . . . . . -77.95 156.84 29.99 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.842 0.83 . . . . 76.82 110.691 -178.447 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 722' ' ' ILE . . . . . . . . . . . . . 18.6 mt -67.06 137.65 24.4 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 CA-C-N 115.248 -0.887 . . . . 71.67 109.401 176.443 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 723' ' ' THR . . . . . . . . . . . . . 24.7 p -108.19 165.78 11.23 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.733 0.778 . . . . 69.43 110.576 179.551 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 724' ' ' GLU . . . . . . . . . . . . . 82.1 tt0 -64.53 -29.87 70.9 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.007 -0.997 . . . . 64.4 111.093 173.003 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 725' ' ' GLN . . . . . . . . . . . . . 32.5 tp60 -70.78 -27.27 63.79 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.549 -0.46 . . . . 92.99 111.8 177.934 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 726' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -58.75 -41.72 87.2 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.133 -0.627 . . . . 66.18 110.952 174.966 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 727' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -65.39 -35.79 82.01 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.506 -0.478 . . . . 63.88 111.48 176.767 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 728' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.05 -38.7 92.23 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.162 -0.615 . . . . 71.58 111.24 -177.578 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 729' ' ' SER . . . . . . . . . . . . . 13.2 p -74.37 -32.39 62.73 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 119.951 -0.699 . . . . 75.97 111.605 175.183 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 730' ' ' SER . . . . . . . . . . . . . 41.2 m -68.67 -29.5 67.97 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 120.674 -0.41 . . . . 75.02 111.75 177.958 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 731' ' ' LEU . . . . . . . . . . . . . 22.1 mt -64.09 -19.59 65.36 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 112.152 0.427 . . . . 81.51 112.152 178.339 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 732' ' ' LYS . . . . . . . . . . . . . . . -73.84 -37.22 64.88 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.24 -0.584 . . . . 88.74 111.132 174.246 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 733' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? -79.23 -39.75 32.41 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 112.016 0.376 . . . . 87.01 112.016 -177.535 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 734' ' ' ILE . . . . . . . . . . . . . 82.0 mt -115.43 114.31 45.98 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 N-CA-C 108.138 -1.06 . . . . 88.07 108.138 -170.495 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 735' ' ' ARG . . . . . . . . . . . . . . . -110.09 167.98 9.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.761 0.791 . . . . 88.55 110.623 -177.705 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 736' ' ' ARG . . . . . . . . . . . . . . . -56.96 138.34 54.27 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.041 -0.982 . . . . 81.47 110.356 177.567 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 737' ' ' SER . . . . . 0.445 ' O ' ' O ' ' B' ' 901' ' ' HOH . 67.1 p -94.31 -20.53 19.7 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 113.613 0.968 . . . . 75.96 113.613 -173.308 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 738' ' ' VAL . . . . . . . . . . . . . 17.0 t -114.98 120.23 64.0 Favored 'Isoleucine or valine' 0 C--O 1.238 0.489 0 N-CA-C 108.611 -0.885 . . . . 92.3 108.611 -175.383 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 739' ' ' ALA . . . . . . . . . . . . . . . -77.92 147.96 74.72 Favored Pre-proline 0 C--O 1.234 0.272 0 CA-C-N 116.155 -0.475 . . . . 93.96 110.816 -171.807 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 740' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -59.77 -23.8 73.37 Favored 'Trans proline' 0 C--O 1.238 0.516 0 N-CA-C 113.863 0.678 . . . . 93.63 113.863 -179.57 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 741' ' ' GLN . . . . . . . . . . . . . . . -64.12 -36.49 84.2 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 120.115 -0.634 . . . . 93.33 110.943 172.768 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 742' ' ' SER . . . . . . . . . . . . . 2.1 m -69.18 -36.65 77.55 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.972 -0.291 . . . . 93.97 111.602 -174.771 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 743' ' ' LEU . . . . . . . . . . . . . 2.2 mp -64.68 -37.69 88.44 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 120.001 -0.679 . . . . 89.5 112.134 -176.142 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 744' ' ' ASN . . . . . . . . . . . . . . . -58.54 -35.87 72.99 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.018 -0.673 . . . . 89.27 110.931 -178.991 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 2.6 m -64.9 -49.2 71.39 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 120.609 -0.436 . . . . 82.87 110.985 176.103 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 746' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -57.42 -43.01 83.43 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.57 -0.452 . . . . 74.59 111.091 177.317 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 747' ' ' GLU . . . . . . . . . . . . . . . -64.63 -46.79 81.07 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.625 -0.43 . . . . 84.43 110.83 177.456 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 748' ' ' LYS . . . . . . . . . . . . . . . -63.81 -47.24 81.65 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.507 -0.477 . . . . 83.49 110.942 178.845 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 749' ' ' TRP . . . . . . . . . . . . . 12.3 t90 -60.77 -39.3 88.29 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.491 -0.484 . . . . 87.66 111.147 179.571 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 750' ' ' SER . . . . . . . . . . . . . 31.3 t -64.34 -42.61 96.19 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.487 -0.485 . . . . 88.12 111.483 -179.362 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 751' ' ' GLN . . . . . . . . . . . . . . . -72.7 -42.57 64.08 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.15 -0.62 . . . . 95.87 111.453 -175.638 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 752' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -87.42 -26.5 23.25 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 113.475 0.917 . . . . 106.42 113.475 -172.014 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 753' ' ' TYR . . . . . 0.548 ' O ' ' NH1' ' B' ' 645' ' ' ARG . . . -129.46 -12.46 4.44 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 114.333 1.235 . . . . 95.72 114.333 -177.232 . . . . . . . . 2 2 . 1 . 001 ecloud build full ' B' B ' 754' ' ' GLY . . . . . . . . . . . . . . . -77.74 -137.13 0.99 Allowed Glycine 0 N--CA 1.45 -0.383 0 CA-C-N 119.303 0.956 . . . . 95.4 113.567 -179.387 . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 755' ' ' ASP . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.273 0 O-C-N 122.656 -0.32 . . . . 97.35 111.09 179.615 . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 801' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 802' ' ' SKE . . . . . 0.582 ' C1 ' HD21 ' B' ' 659' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud build full ' B' B ' 803' ' ' MPD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 901' ' ' HOH . . . . . 0.445 ' O ' ' O ' ' B' ' 737' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 0 . 1 . 001 ecloud build full ' B' B ' 905' ' ' HOH . . . . . 0.557 ' O ' ' N ' ' B' ' 599' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 0 . 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 0 . 1 . 001 ecloud build full ' B' B ' 917' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 918' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 919' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 920' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 921' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 922' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 923' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 924' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 925' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 926' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 927' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 928' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 929' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 930' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 931' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 932' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 933' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 934' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 935' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud build full ' B' B ' 936' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 460' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.25 0 N-CA-C 112.191 -0.364 . . . . 81.32 112.191 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 461' ' ' VAL . . . . . . . . . . . . . 2.6 t -69.55 -36.77 72.61 Favored 'Isoleucine or valine' 0 C--O 1.238 0.461 0 C-N-CA 120.17 -0.612 . . . . 87.57 109.999 171.656 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 462' ' ' GLU . . . . . . . . . . . . . . . -69.69 -31.98 70.32 Favored 'General case' 0 C--O 1.236 0.382 0 O-C-N 121.939 -0.476 . . . . 72.56 111.533 174.299 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 463' ' ' GLN . . . . . . . . . . . . . . . -67.98 -36.08 79.42 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.228 -0.589 . . . . 69.57 111.235 177.329 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 464' ' ' LYS . . . . . . . . . . . . . . . -73.06 -28.91 62.59 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 120.596 -0.442 . . . . 70.87 111.611 178.334 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 465' ' ' LEU . . . . . . . . . . . . . 8.8 mt -64.23 -47.27 80.32 Favored 'General case' 0 C--O 1.238 0.451 0 CA-C-O 121.005 0.431 . . . . 66.28 110.836 172.844 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 466' ' ' VAL . . . . . . . . . . . . . 7.0 t -61.46 -45.82 97.84 Favored 'Isoleucine or valine' 0 C--O 1.237 0.403 0 CA-C-O 121.139 0.495 . . . . 50.99 110.14 178.139 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 467' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -57.31 -41.87 80.72 Favored 'General case' 0 C--O 1.236 0.378 0 O-C-N 122.1 -0.375 . . . . 69.62 111.395 178.039 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 468' ' ' LEU . . . . . . . . . . . . . 42.1 tp -64.32 -43.94 93.11 Favored 'General case' 0 C--O 1.237 0.414 0 C-N-CA 120.111 -0.636 . . . . 59.73 111.278 177.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 469' ' ' ILE . . . . . . . . . . . . . 24.8 mt -61.68 -41.22 89.58 Favored 'Isoleucine or valine' 0 C--O 1.237 0.427 0 C-N-CA 120.501 -0.48 . . . . 51.58 110.561 177.569 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 470' ' ' LEU . . . . . . . . . . . . . 43.8 mt -68.88 -30.67 69.22 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 119.513 -0.875 . . . . 51.57 111.529 177.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 471' ' ' ASP . . . . . . . . . . . . . 31.2 m-20 -73.29 -49.33 28.19 Favored 'General case' 0 C--O 1.235 0.299 0 C-N-CA 120.617 -0.433 . . . . 60.36 111.418 -179.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 472' ' ' GLU . . . . . . . . . . . . . 41.4 mm-40 -108.36 -30.66 8.2 Favored 'General case' 0 CA--C 1.518 -0.283 0 N-CA-C 114.662 1.356 . . . . 72.71 114.662 -162.819 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 473' ' ' ILE . . . . . . . . . . . . . 18.4 mt -102.65 -50.85 9.49 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.375 0 CA-C-N 118.535 0.607 . . . . 59.03 111.771 -169.0 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 474' ' ' VAL . . . . . . . . . . . . . 94.8 t -64.2 123.46 17.06 Favored 'Isoleucine or valine' 0 C--O 1.238 0.471 0 N-CA-C 108.368 -0.975 . . . . 52.53 108.368 174.39 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 475' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -94.87 145.51 24.85 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-O 121.313 0.578 . . . . 66.98 110.467 -177.558 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 476' ' ' GLY . . . . . . . . . . . . . . . -140.06 -150.67 5.51 Favored Glycine 0 N--CA 1.449 -0.472 0 CA-C-N 115.391 -0.822 . . . . 68.46 111.93 177.51 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 477' ' ' GLY . . . . . . . . . . . . . . . 75.22 -159.38 51.63 Favored Glycine 0 N--CA 1.446 -0.663 0 C-N-CA 118.514 -1.803 . . . . 68.33 110.811 -174.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 478' ' ' ALA . . . . . . . . . . . . . . . -68.19 130.23 42.3 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 114.854 -0.673 . . . . 68.15 110.473 -177.239 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 479' ' ' LYS . . . . . . . . . . . . . 29.8 mttm -75.95 137.39 40.3 Favored 'General case' 0 C--N 1.326 -0.441 0 CA-C-N 116.087 -0.506 . . . . 90.21 110.188 177.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 480' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -86.42 130.58 36.43 Favored 'Isoleucine or valine' 0 C--O 1.236 0.381 0 N-CA-C 107.409 -1.33 . . . . 61.65 107.409 172.228 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 481' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -100.37 161.71 13.43 Favored 'General case' 0 C--N 1.326 -0.417 0 CA-C-O 121.557 0.694 . . . . 97.72 110.778 -175.229 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 482' ' ' TRP . . . . . . . . . . . . . 2.6 t-105 -53.59 -42.37 67.56 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 115.109 -0.951 . . . . 66.3 110.987 177.327 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 483' ' ' THR . . . . . . . . . . . . . 2.5 m -62.95 -29.93 71.18 Favored 'General case' 0 C--O 1.237 0.425 0 N-CA-C 111.749 0.278 . . . . 63.56 111.749 179.982 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 484' ' ' ASP . . . . . . . . . . . . . 90.4 m-20 -69.84 -3.08 14.13 Favored 'General case' 0 C--O 1.238 0.458 0 N-CA-C 113.57 0.952 . . . . 72.01 113.57 -177.482 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 485' ' ' ILE . . . . . . . . . . . . . 59.7 mt -105.66 106.17 20.04 Favored 'Isoleucine or valine' 0 C--O 1.237 0.434 0 N-CA-C 107.72 -1.215 . . . . 60.7 107.72 -177.664 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 486' ' ' ALA . . . . . . . . . . . . . . . -70.93 131.03 43.11 Favored 'General case' 0 C--O 1.234 0.275 0 CA-C-N 115.783 -0.644 . . . . 67.01 110.52 179.083 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 487' ' ' GLY . . . . . . . . . . . . . . . 66.26 -151.33 52.11 Favored Glycine 0 C--N 1.334 0.42 0 C-N-CA 120.593 -0.813 . . . . 65.44 112.19 177.568 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 488' ' ' GLN . . . . . . . . . . . . . 47.4 mm-40 55.45 37.32 28.72 Favored 'General case' 0 N--CA 1.466 0.345 0 CA-C-O 121.29 0.567 . . . . 71.22 111.009 -177.849 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 489' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -66.74 -28.75 68.66 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 120.357 -0.537 . . . . 83.39 112.061 -176.818 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 490' ' ' VAL . . . . . . . . . . . . . 43.7 t -63.58 -59.6 4.06 Favored 'Isoleucine or valine' 0 C--O 1.237 0.405 0 CA-C-O 121.378 0.609 . . . . 68.86 109.86 177.662 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 491' ' ' ALA . . . . . . . . . . . . . . . -59.7 -35.99 75.62 Favored 'General case' 0 C--O 1.238 0.47 0 CA-C-N 116.328 -0.397 . . . . 59.42 111.45 178.577 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 492' ' ' LYS . . . . . . . . . . . . . 20.7 mttt -59.49 -49.52 77.46 Favored 'General case' 0 C--O 1.236 0.354 0 CA-C-O 120.838 0.351 . . . . 64.65 111.5 179.118 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 493' ' ' GLN . . . . . . . . . . . . . . . -66.7 -36.05 81.57 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 120.456 -0.497 . . . . 57.58 111.278 -178.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 494' ' ' ALA . . . . . . . . . . . . . . . -61.8 -44.06 97.62 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.384 -0.527 . . . . 58.26 111.025 175.422 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 495' ' ' LEU . . . . . . . . . . . . . 41.0 mt -66.83 -31.81 72.67 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 120.175 -0.61 . . . . 53.62 111.658 179.343 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 496' ' ' GLN . . . . . . . . . . . . . 36.4 mm-40 -62.76 -48.23 80.08 Favored 'General case' 0 C--O 1.236 0.35 0 C-N-CA 120.454 -0.498 . . . . 61.86 111.159 175.32 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 497' ' ' GLU . . . . . . . . . . . . . 24.4 tt0 -67.64 -39.48 84.62 Favored 'General case' 0 C--O 1.236 0.349 0 C-N-CA 120.106 -0.638 . . . . 86.86 111.605 -177.418 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 498' ' ' MET . . . . . . . . . . . . . 41.1 mtm -93.62 -24.78 17.78 Favored 'General case' 0 C--O 1.236 0.365 0 N-CA-C 113.926 1.084 . . . . 89.05 113.926 -167.515 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 499' ' ' VAL . . . . . . . . . . . . . 16.4 t -123.97 -57.65 2.28 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 CA-C-N 119.034 0.834 . . . . 51.83 111.18 -178.54 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 500' ' ' ILE . . . . . . . . . . . . . 44.5 mt -63.73 -62.19 1.32 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.347 0 C-N-CA 120.75 -0.38 . . . . 56.83 110.855 -168.863 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 501' ' ' LEU . . . . . . . . . . . . . 50.1 mt -56.02 -45.88 99.84 Favored Pre-proline 0 C--O 1.244 0.79 0 CA-C-O 118.251 -0.881 . . . . 65.24 113.074 -178.1 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 502' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -61.94 -27.0 79.39 Favored 'Trans proline' 0 C--O 1.238 0.479 0 CA-C-N 121.558 1.592 . . . . 58.94 113.345 174.487 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 503' ' ' SER . . . . . . . . . . . . . 40.5 t -76.21 -42.79 45.0 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 120.379 -0.528 . . . . 62.08 111.765 179.852 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 504' ' ' VAL . . . . . . . . . . . . . 10.6 m -91.25 -22.68 6.1 Favored 'Isoleucine or valine' 0 C--O 1.24 0.586 0 N-CA-C 113.511 0.93 . . . . 73.21 113.511 -174.015 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 505' ' ' ARG . . . . . . . . . . . . . 51.8 mmm-85 -124.55 68.09 50.46 Favored Pre-proline 0 C--O 1.24 0.553 0 N-CA-C 108.916 -0.772 . . . . 81.21 108.916 174.457 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 506' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -65.88 -21.42 57.46 Favored 'Trans proline' 0 C--O 1.238 0.519 0 N-CA-C 114.054 0.751 . . . . 75.6 114.054 -174.662 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 507' ' ' GLU . . . . . . . . . . . . . 22.2 pm0 -68.95 -28.67 66.84 Favored 'General case' 0 C--O 1.236 0.358 0 CA-C-N 118.812 0.733 . . . . 85.5 111.741 -179.119 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 508' ' ' LEU . . . . . . . . . . . . . 12.8 mt -81.46 4.17 22.04 Favored 'General case' 0 C--O 1.235 0.328 0 N-CA-C 112.996 0.739 . . . . 77.87 112.996 177.715 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 509' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -135.36 49.87 2.16 Favored 'General case' 0 C--N 1.33 -0.247 0 CA-C-O 121.784 0.802 . . . . 71.07 110.323 -174.791 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 510' ' ' THR . . . . . . . . . . . . . 17.0 p -99.99 167.71 10.32 Favored 'General case' 0 C--N 1.326 -0.425 0 CA-C-O 121.8 0.81 . . . . 72.23 110.09 175.089 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 511' ' ' GLY . . . . . . . . . . . . . . . 63.0 -122.95 29.02 Favored Glycine 0 C--O 1.237 0.317 0 CA-C-N 115.125 -0.943 . . . . 65.07 111.664 175.422 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 512' ' ' LEU . . . . . . . . . . . . . 59.3 mt -69.59 -13.37 62.28 Favored 'General case' 0 C--O 1.236 0.351 0 N-CA-C 112.951 0.723 . . . . 60.65 112.951 -179.553 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 513' ' ' ARG . . . . . . . . . . . . . 92.1 mtm-85 -96.73 12.92 30.21 Favored 'General case' 0 C--O 1.236 0.376 0 CA-C-N 118.563 0.62 . . . . 69.13 112.539 176.573 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 514' ' ' ALA . . . . . . . . . . . . . . . -60.95 132.88 92.22 Favored Pre-proline 0 C--O 1.241 0.638 0 CA-C-N 117.911 0.323 . . . . 61.31 110.396 -177.392 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 515' ' ' PRO . . . . . . . . . . . . . 86.9 Cg_endo -74.74 156.47 44.17 Favored 'Trans proline' 0 CA--C 1.517 -0.345 0 CA-C-O 121.855 0.689 . . . . 61.42 112.033 -172.792 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 516' ' ' ALA . . . . . . . . . . . . . . . -74.08 153.83 39.45 Favored 'General case' 0 N--CA 1.452 -0.358 0 CA-C-N 115.016 -0.993 . . . . 60.7 109.823 171.267 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 517' ' ' LYS . . . . . 0.47 ' NZ ' ' O ' ' B' ' 620' ' ' ASP . 5.5 mttm -102.76 -4.71 24.58 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 115.74 -0.663 . . . . 86.03 112.512 -179.892 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 518' ' ' GLY . . . . . . . . . . . . . . . -139.48 128.84 4.12 Favored Glycine 0 N--CA 1.448 -0.536 0 N-CA-C 112.111 -0.396 . . . . 54.98 112.111 176.315 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 519' ' ' LEU . . . . . . . . . . . . . 9.8 tt -132.75 140.85 48.25 Favored 'General case' 0 C--O 1.234 0.255 0 N-CA-C 109.251 -0.648 . . . . 55.69 109.251 -179.024 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 520' ' ' LEU . . . . . 0.455 HD11 HG22 ' B' ' 628' ' ' THR . 32.2 tp -107.99 131.05 54.97 Favored 'General case' 0 C--N 1.328 -0.364 0 C-N-CA 123.026 0.53 . . . . 50.27 109.905 -179.228 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 521' ' ' LEU . . . . . 0.425 ' O ' ' HA ' ' B' ' 627' ' ' ALA . 23.5 mt -105.69 132.24 52.07 Favored 'General case' 0 C--N 1.327 -0.373 0 N-CA-C 108.324 -0.991 . . . . 56.63 108.324 168.741 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 522' ' ' PHE . . . . . . . . . . . . . 35.5 p90 -141.94 153.09 44.1 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-O 121.27 0.557 . . . . 54.8 109.815 -176.89 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 523' ' ' GLY . . . . . . . . . . . . . . . 151.77 -175.59 30.49 Favored Glycine 0 N--CA 1.439 -1.138 0 CA-C-N 115.138 -0.937 . . . . 52.53 110.913 179.874 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 524' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -66.15 153.76 76.79 Favored 'Trans proline' 0 C--O 1.241 0.669 0 C-N-CA 120.861 1.041 . . . . 61.98 111.412 -177.693 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 525' ' ' PRO . . . . . . . . . . . . . 38.0 Cg_endo -68.08 151.44 77.39 Favored 'Trans proline' 0 C--N 1.332 -0.304 0 C-N-CA 120.308 0.672 . . . . 61.62 112.267 -179.752 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 526' ' ' GLY . . . . . . . . . . . . . . . 76.82 22.45 71.95 Favored Glycine 0 C--N 1.334 0.439 0 CA-C-N 115.094 -0.957 . . . . 55.05 115.362 175.742 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 527' ' ' CYS . . . . . 0.518 ' SG ' HD23 ' B' ' 650' ' ' LEU . 92.5 m -112.0 5.98 19.08 Favored 'General case' 0 C--O 1.233 0.188 0 CA-C-N 118.275 1.037 . . . . 58.64 113.37 -176.92 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 528' ' ' GLY . . . . . . . . . . . . . . . 103.39 21.06 10.22 Favored Glycine 0 N--CA 1.447 -0.589 0 N-CA-C 117.394 1.717 . . . . 51.91 117.394 170.804 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 529' ' ' LYS . . . . . . . . . . . . . 36.7 mtmm -64.14 -48.3 76.56 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 119.097 1.449 . . . . 47.77 110.819 175.808 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 530' ' ' THR . . . . . 0.553 ' O ' ' HG3' ' B' ' 534' ' ' ARG . 53.1 m -59.78 -51.62 68.95 Favored 'General case' 0 C--O 1.237 0.401 0 C-N-CA 120.556 -0.458 . . . . 44.29 110.888 176.028 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 531' ' ' LEU . . . . . . . . . . . . . 50.2 mt -58.18 -39.68 79.53 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.632 -0.427 . . . . 70.1 111.546 -179.058 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 532' ' ' LEU . . . . . . . . . . . . . 16.1 mt -63.9 -39.23 93.69 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 119.928 -0.709 . . . . 56.2 111.01 177.438 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 533' ' ' ALA . . . . . . . . . . . . . . . -64.43 -43.97 92.66 Favored 'General case' 0 C--O 1.238 0.469 0 C-N-CA 120.46 -0.496 . . . . 43.26 111.399 179.035 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 534' ' ' ARG . . . . . 0.553 ' HG3' ' O ' ' B' ' 530' ' ' THR . 35.6 mtp180 -59.49 -46.86 87.61 Favored 'General case' 0 C--O 1.236 0.36 0 C-N-CA 120.605 -0.438 . . . . 86.64 111.079 177.077 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 535' ' ' ALA . . . . . . . . . . . . . . . -64.11 -35.02 79.38 Favored 'General case' 0 C--O 1.236 0.37 0 C-N-CA 119.921 -0.712 . . . . 44.66 111.966 179.159 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 536' ' ' VAL . . . . . . . . . . . . . 40.8 t -57.97 -43.58 85.11 Favored 'Isoleucine or valine' 0 C--O 1.237 0.439 0 C-N-CA 120.042 -0.663 . . . . 44.81 110.415 174.634 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 537' ' ' ALA . . . . . . . . . . . . . . . -63.17 -42.06 99.34 Favored 'General case' 0 C--O 1.238 0.467 0 C-N-CA 120.26 -0.576 . . . . 44.23 111.304 177.784 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 538' ' ' THR . . . . . . . . . . . . . 34.7 m -57.39 -47.93 80.39 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-O 121.055 0.455 . . . . 48.12 110.839 174.65 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 539' ' ' GLU . . . . . . . . . . . . . 26.0 mm-40 -60.93 -32.08 71.6 Favored 'General case' 0 C--O 1.237 0.434 0 N-CA-C 112.088 0.403 . . . . 60.95 112.088 179.174 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 540' ' ' CYS . . . . . . . . . . . . . 93.5 m -88.18 -2.91 58.88 Favored 'General case' 0 C--O 1.236 0.375 0 N-CA-C 113.197 0.814 . . . . 53.24 113.197 -178.413 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 541' ' ' SER . . . . . . . . . . . . . 18.2 m 52.33 48.19 23.15 Favored 'General case' 0 C--O 1.233 0.235 0 CA-C-O 122.099 0.952 . . . . 59.8 110.111 -169.29 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 542' ' ' ALA . . . . . . . . . . . . . . . -117.89 151.25 37.77 Favored 'General case' 0 N--CA 1.452 -0.361 0 CA-C-N 115.497 -0.774 . . . . 52.35 110.938 -172.449 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 543' ' ' THR . . . . . . . . . . . . . 23.7 m -67.31 133.17 49.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.259 -0.882 . . . . 48.65 109.267 170.375 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 544' ' ' PHE . . . . . 0.448 ' CE2' ' HB2' ' B' ' 546' ' ' ASN . 74.5 t80 -103.52 118.48 36.84 Favored 'General case' 0 C--N 1.327 -0.38 0 N-CA-C 109.123 -0.695 . . . . 44.82 109.123 179.043 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 545' ' ' LEU . . . . . . . . . . . . . 5.3 mp -111.52 113.78 26.42 Favored 'General case' 0 C--N 1.327 -0.397 0 N-CA-C 107.341 -1.355 . . . . 50.28 107.341 179.146 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 546' ' ' ASN . . . . . 0.448 ' HB2' ' CE2' ' B' ' 544' ' ' PHE . 53.3 t-20 -110.56 109.28 19.54 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 108.436 -0.95 . . . . 53.36 108.436 -172.21 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 547' ' ' ILE . . . . . 0.666 HD11 HD13 ' B' ' 552' ' ' LEU . 4.3 tp -116.26 126.43 73.74 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 N-CA-C 108.562 -0.903 . . . . 66.04 108.562 178.861 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 548' ' ' SER . . . . . . . . . . . . . 1.8 t -86.33 113.46 22.33 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 108.363 -0.977 . . . . 78.15 108.363 175.454 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 549' ' ' ALA . . . . . . . . . . . . . . . -63.95 -34.55 78.24 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.327 -0.549 . . . . 71.51 111.896 -178.535 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 550' ' ' ALA . . . . . . . . . . . . . . . -62.44 -54.96 32.51 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-O 121.003 0.43 . . . . 79.94 110.947 -179.77 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 551' ' ' SER . . . . . . . . . . . . . 1.7 p -70.29 5.65 1.64 Allowed 'General case' 0 C--O 1.24 0.564 0 N-CA-C 112.931 0.715 . . . . 81.16 112.931 176.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 552' ' ' LEU . . . . . 0.666 HD13 HD11 ' B' ' 547' ' ' ILE . 36.5 tp -97.61 -47.78 5.5 Favored 'General case' 0 C--O 1.234 0.244 0 C-N-CA 123.463 0.705 . . . . 86.64 112.387 -178.554 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 553' ' ' THR . . . . . . . . . . . . . . . -67.25 -21.3 65.73 Favored 'General case' 0 C--O 1.236 0.342 0 N-CA-C 112.429 0.529 . . . . 108.79 112.429 -178.676 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 554' ' ' SER . . . . . . . . . . . . . . . -74.01 -172.16 1.28 Allowed 'General case' 0 C--O 1.235 0.341 0 CA-C-O 122.213 1.006 . . . . 95.34 110.125 -174.148 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 555' ' ' LYS . . . . . . . . . . . . . . . -80.85 56.21 2.65 Favored 'General case' 0 C--O 1.236 0.367 0 CA-C-N 115.958 -0.564 . . . . 96.41 112.156 -173.936 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 556' ' ' TYR . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.315 0 CA-C-O 120.853 0.358 . . . . 88.28 110.814 177.967 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 560' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.267 0 CA-C-O 120.915 0.175 . . . . 81.07 113.139 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 561' ' ' GLU . . . . . . . . . . . . . . . -70.09 -37.87 75.53 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.554 -0.458 . . . . 82.5 111.379 178.695 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 562' ' ' LYS . . . . . . . . . . . . . . . -70.69 -33.91 71.4 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 120.635 -0.426 . . . . 72.88 111.911 -177.421 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 563' ' ' LEU . . . . . . . . . . . . . 7.6 tp -65.9 -48.69 70.64 Favored 'General case' 0 C--O 1.239 0.53 0 C-N-CA 120.194 -0.602 . . . . 65.93 110.935 177.813 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 564' ' ' VAL . . . . . . . . . . . . . 89.0 t -56.54 -40.78 70.55 Favored 'Isoleucine or valine' 0 C--O 1.238 0.476 0 CA-C-O 121.011 0.434 . . . . 63.36 110.319 175.669 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 565' ' ' ARG . . . . . . . . . . . . . 21.1 ttm180 -64.67 -39.92 94.52 Favored 'General case' 0 C--O 1.236 0.393 0 C-N-CA 120.295 -0.562 . . . . 67.92 111.134 177.925 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 566' ' ' ALA . . . . . . . . . . . . . . . -72.27 -29.25 63.72 Favored 'General case' 0 C--O 1.237 0.426 0 C-N-CA 120.396 -0.522 . . . . 56.69 111.676 179.222 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 567' ' ' LEU . . . . . . . . . . . . . 27.6 tp -65.44 -52.07 55.77 Favored 'General case' 0 C--O 1.239 0.5 0 CA-C-O 120.803 0.335 . . . . 60.14 111.069 178.423 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 568' ' ' PHE . . . . . . . . . . . . . 35.1 m-85 -64.33 -30.88 71.92 Favored 'General case' 0 C--O 1.237 0.421 0 C-N-CA 120.621 -0.432 . . . . 53.47 111.575 177.172 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 569' ' ' ALA . . . . . . . . . . . . . . . -67.86 -44.7 76.51 Favored 'General case' 0 C--O 1.235 0.332 0 C-N-CA 120.711 -0.396 . . . . 57.11 110.942 176.358 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 570' ' ' VAL . . . . . . . . . . . . . 12.0 t -62.32 -37.91 79.83 Favored 'Isoleucine or valine' 0 C--O 1.237 0.447 0 C-N-CA 120.509 -0.476 . . . . 55.85 110.291 174.573 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 571' ' ' ALA . . . . . . . . . . . . . . . -59.99 -41.56 92.31 Favored 'General case' 0 C--O 1.237 0.424 0 O-C-N 121.872 -0.518 . . . . 59.25 111.413 176.969 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 572' ' ' ARG . . . . . . . . . . . . . 15.4 mtt85 -65.41 -42.16 92.83 Favored 'General case' 0 C--O 1.236 0.381 0 C-N-CA 120.419 -0.513 . . . . 76.55 111.384 179.388 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 573' ' ' HIS . . . . . . . . . . . . . 48.2 m170 -70.87 -20.24 62.54 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 112.753 0.649 . . . . 79.2 112.753 -177.528 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 574' ' ' MET . . . . . . . . . . . . . 82.6 mtp -111.31 17.9 19.78 Favored 'General case' 0 C--O 1.234 0.279 0 CA-C-N 118.503 0.592 . . . . 64.6 112.438 -178.623 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 575' ' ' GLN . . . . . . . . . . . . . 29.9 pt20 -67.64 152.91 95.86 Favored Pre-proline 0 N--CA 1.45 -0.453 0 C-N-CA 120.61 -0.436 . . . . 89.13 110.868 -174.514 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 576' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -64.0 136.77 25.18 Favored 'Cis proline' 0 C--N 1.347 0.485 0 C-N-CA 128.015 0.423 . . . . 60.53 112.601 1.175 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 577' ' ' SER . . . . . . . . . . . . . 48.7 m -134.17 149.5 51.04 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-O 121.388 0.614 . . . . 55.62 110.11 -171.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 578' ' ' ILE . . . . . . . . . . . . . 10.1 mt -120.83 117.0 51.64 Favored 'Isoleucine or valine' 0 C--O 1.236 0.392 0 N-CA-C 107.555 -1.276 . . . . 54.06 107.555 172.561 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 579' ' ' ILE . . . . . . . . . . . . . 49.5 mt -94.04 118.92 41.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.42 0 N-CA-C 107.296 -1.372 . . . . 44.19 107.296 174.615 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 580' ' ' PHE . . . . . . . . . . . . . 69.9 t80 -113.7 123.94 51.09 Favored 'General case' 0 C--N 1.326 -0.435 0 N-CA-C 108.607 -0.886 . . . . 42.96 108.607 -177.793 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 581' ' ' ILE . . . . . . . . . . . . . 5.7 mt -110.99 109.28 27.9 Favored 'Isoleucine or valine' 0 C--O 1.237 0.435 0 N-CA-C 107.569 -1.271 . . . . 68.25 107.569 178.116 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 582' ' ' ASP . . . . . . . . . . . . . 34.3 t0 -77.22 140.87 40.23 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.954 -0.566 . . . . 82.24 109.834 176.042 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 583' ' ' GLU . . . . . . . . . . . . . 27.9 mt-10 51.13 55.06 10.11 Favored 'General case' 0 N--CA 1.464 0.272 0 CA-C-O 121.833 0.825 . . . . 93.29 111.005 178.454 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 584' ' ' VAL . . . . . . . . . . . . . 9.5 p -60.96 -21.11 23.45 Favored 'Isoleucine or valine' 0 C--O 1.236 0.373 0 CA-C-N 115.085 -0.961 . . . . 62.61 111.841 -176.391 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 585' ' ' ASP . . . . . 0.488 ' OD2' ' NH1' ' B' ' 630' ' ' ARG . 3.7 p-10 -64.2 -30.62 71.67 Favored 'General case' 0 C--O 1.237 0.401 0 O-C-N 122.148 -0.345 . . . . 69.08 111.879 179.274 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 586' ' ' SER . . . . . . . . . . . . . 53.7 p -73.55 -11.56 60.48 Favored 'General case' 0 C--O 1.235 0.325 0 N-CA-C 112.605 0.594 . . . . 74.74 112.605 177.096 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 587' ' ' LEU . . . . . . . . . . . . . 4.3 mt -78.83 -86.13 0.07 Allowed 'General case' 0 C--O 1.236 0.351 0 N-CA-C 109.017 -0.735 . . . . 78.55 109.017 162.341 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 588' ' ' LEU . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 115.94 -0.573 . . . . 75.24 111.152 178.561 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 599' ' ' SER . . . . . 0.557 ' N ' ' O ' ' B' ' 905' ' ' HOH . . . . . . . . 0 C--O 1.232 0.169 0 CA-C-O 120.823 0.345 . . . . 85.43 110.883 . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 600' ' ' ARG . . . . . . . . . . . . . . . -67.45 -28.62 68.03 Favored 'General case' 0 C--O 1.236 0.377 0 C-N-CA 120.439 -0.504 . . . . 80.2 111.59 177.342 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 601' ' ' ARG . . . . . . . . . . . . . . . -69.96 -28.48 65.59 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.671 -0.412 . . . . 76.48 111.893 179.995 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 602' ' ' LEU . . . . . . . . . . . . . 1.1 tt -78.36 -47.09 18.43 Favored 'General case' 0 C--O 1.236 0.369 0 C-N-CA 120.165 -0.614 . . . . 76.51 111.44 -178.3 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 603' ' ' LYS . . . . . . . . . . . . . . . -58.46 -37.87 76.36 Favored 'General case' 0 C--O 1.239 0.5 0 C-N-CA 120.559 -0.456 . . . . 66.25 111.118 176.576 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 604' ' ' THR . . . . . . . . . . . . . 2.2 m -65.44 -46.13 81.09 Favored 'General case' 0 C--O 1.236 0.386 0 CA-C-O 120.887 0.375 . . . . 72.26 111.212 179.828 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 605' ' ' GLU . . . . . . . . . . . . . 45.0 tp10 -65.62 -27.03 68.09 Favored 'General case' 0 C--O 1.237 0.406 0 C-N-CA 120.162 -0.615 . . . . 89.66 111.644 179.59 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 606' ' ' PHE . . . . . . . . . . . . . 54.8 t80 -68.25 -49.02 63.48 Favored 'General case' 0 C--O 1.236 0.371 0 C-N-CA 119.082 -1.047 . . . . 80.69 110.968 172.692 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 607' ' ' LEU . . . . . . . . . . . . . 72.4 mt -56.47 -43.08 79.25 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 120.6 -0.44 . . . . 71.21 111.104 177.31 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 608' ' ' VAL . . . . . . . . . . . . . 44.7 t -62.0 -39.24 83.01 Favored 'Isoleucine or valine' 0 C--O 1.238 0.462 0 CA-C-O 120.894 0.378 . . . . 62.29 110.619 179.814 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 609' ' ' GLU . . . . . . . . . . . . . 71.4 mm-40 -73.13 -39.67 65.52 Favored 'General case' 0 C--O 1.236 0.356 0 C-N-CA 119.913 -0.715 . . . . 72.67 111.254 -178.761 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 610' ' ' PHE . . . . . . . . . . . . . 64.6 t80 -61.28 -44.53 97.08 Favored 'General case' 0 C--O 1.238 0.448 0 C-N-CA 120.337 -0.545 . . . . 74.86 111.121 176.264 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 611' ' ' ASP . . . . . 0.468 ' OD1' ' NH2' ' B' ' 641' ' ' ARG . 82.8 m-20 -67.31 -29.8 69.47 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 120.615 -0.434 . . . . 72.86 112.032 -176.564 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 612' ' ' GLY . . . . . . . . . . . . . . . -84.38 12.1 56.31 Favored Glycine 0 N--CA 1.447 -0.589 0 N-CA-C 115.589 0.995 . . . . 70.78 115.589 177.337 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 613' ' ' LEU . . . . . . . . . . . . . 12.3 mt -70.74 -50.07 13.63 Favored Pre-proline 0 C--O 1.248 0.998 0 CA-C-N 118.072 0.936 . . . . 70.28 112.422 -177.517 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 614' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo . . . . . 0 C--N 1.344 0.316 0 C-N-CA 116.419 -1.921 . . . . 93.42 112.385 179.044 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 617' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo . . . . . 0 C--O 1.233 0.239 0 CA-C-O 120.559 0.15 . . . . 106.16 112.204 . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 618' ' ' ASP . . . . . . . . . . . . . . . -100.09 21.57 12.63 Favored 'General case' 0 C--O 1.235 0.304 0 CA-C-N 116.019 -0.537 . . . . 101.11 111.988 171.905 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 619' ' ' GLY . . . . . . . . . . . . . . . -135.05 -90.64 0.34 Allowed Glycine 0 N--CA 1.449 -0.465 0 CA-C-O 120.045 -0.309 . . . . 93.21 112.622 178.757 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 620' ' ' ASP . . . . . 0.47 ' O ' ' NZ ' ' B' ' 517' ' ' LYS . . . 86.54 -49.75 0.05 Allowed 'General case' 0 N--CA 1.465 0.312 0 C-N-CA 126.751 2.02 . . . . 82.86 112.712 176.539 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 621' ' ' ARG . . . . . . . . . . . . . 44.2 mtp180 -86.34 69.39 10.43 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 122.675 1.226 . . . . 85.07 110.486 -173.286 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 622' ' ' ILE . . . . . . . . . . . . . 57.1 mt -136.93 137.35 47.1 Favored 'Isoleucine or valine' 0 C--O 1.235 0.33 0 CA-C-N 114.669 -1.15 . . . . 57.46 108.17 176.498 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 623' ' ' VAL . . . . . . . . . . . . . 3.3 p -124.38 138.57 53.46 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 N-CA-C 108.049 -1.093 . . . . 60.67 108.049 171.795 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 624' ' ' VAL . . . . . . . . . . . . . 84.3 t -105.34 117.5 51.15 Favored 'Isoleucine or valine' 0 C--O 1.236 0.36 0 N-CA-C 108.108 -1.071 . . . . 49.47 108.108 -179.862 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 625' ' ' LEU . . . . . . . . . . . . . 52.3 mt -104.75 128.23 52.8 Favored 'General case' 0 C--N 1.328 -0.369 0 N-CA-C 108.625 -0.88 . . . . 51.83 108.625 171.346 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 626' ' ' ALA . . . . . . . . . . . . . . . -117.38 146.48 43.39 Favored 'General case' 0 C--N 1.324 -0.516 0 N-CA-C 108.852 -0.796 . . . . 46.99 108.852 177.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 627' ' ' ALA . . . . . 0.425 ' HA ' ' O ' ' B' ' 521' ' ' LEU . . . -127.39 146.2 50.55 Favored 'General case' 0 C--N 1.327 -0.4 0 N-CA-C 109.258 -0.645 . . . . 46.44 109.258 179.725 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 628' ' ' THR . . . . . 0.455 HG22 HD11 ' B' ' 520' ' ' LEU . 7.1 t -152.05 144.21 23.91 Favored 'General case' 0 C--O 1.234 0.268 0 CA-C-N 115.91 -0.586 . . . . 57.8 109.5 176.291 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 629' ' ' ASN . . . . . . . . . . . . . 40.6 m-20 -95.17 -2.28 50.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 115.737 -0.665 . . . . 64.34 112.125 168.596 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 630' ' ' ARG . . . . . 0.488 ' NH1' ' OD2' ' B' ' 585' ' ' ASP . 19.3 mtt85 -133.16 71.22 77.44 Favored Pre-proline 0 C--O 1.237 0.418 0 C-N-CA 123.363 0.665 . . . . 94.58 109.268 178.696 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 631' ' ' PRO . . . . . . . . . . . . . 38.8 Cg_endo -62.99 -26.1 74.0 Favored 'Trans proline' 0 C--O 1.238 0.514 0 N-CA-C 113.157 0.407 . . . . 65.78 113.157 178.529 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 632' ' ' GLN . . . . . . . . . . . . . . . -65.98 -16.05 63.55 Favored 'General case' 0 C--O 1.235 0.307 0 N-CA-C 112.291 0.478 . . . . 81.62 112.291 177.783 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 633' ' ' GLU . . . . . . . . . . . . . . . -94.66 6.0 50.2 Favored 'General case' 0 C--O 1.235 0.32 0 N-CA-C 112.987 0.736 . . . . 78.08 112.987 -177.545 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 634' ' ' LEU . . . . . . . . . . . . . 95.3 mt -85.84 146.85 26.56 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 121.183 0.516 . . . . 87.63 110.17 176.717 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 635' ' ' ASP . . . . . . . . . . . . . 37.7 p-10 -97.66 179.82 4.71 Favored 'General case' 0 C--O 1.235 0.3 0 CA-C-O 121.836 0.827 . . . . 91.05 110.509 -177.665 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 636' ' ' GLU . . . . . . . . . . . . . . . -66.69 -30.58 70.86 Favored 'General case' 0 C--O 1.237 0.399 0 CA-C-N 115.523 -0.762 . . . . 85.11 111.812 -177.662 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 637' ' ' ALA . . . . . . . . . . . . . . . -62.2 -41.0 97.95 Favored 'General case' 0 C--O 1.235 0.337 0 C-N-CA 120.296 -0.562 . . . . 83.95 111.107 177.249 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 638' ' ' ALA . . . . . . . . . . . . . . . -72.92 -44.69 60.92 Favored 'General case' 0 C--O 1.236 0.365 0 C-N-CA 120.475 -0.49 . . . . 74.22 111.226 179.172 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 639' ' ' LEU . . . . . . . . . . . . . 9.4 mt -65.53 -32.83 74.63 Favored 'General case' 0 C--O 1.236 0.372 0 N-CA-C 112.276 0.473 . . . . 81.52 112.276 -172.96 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 640' ' ' ARG . . . . . . . . . . . . . . . -75.88 -19.85 58.52 Favored 'General case' 0 C--O 1.236 0.359 0 N-CA-C 112.764 0.653 . . . . 75.0 112.764 -179.024 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 641' ' ' ARG . . . . . 0.468 ' NH2' ' OD1' ' B' ' 611' ' ' ASP . 27.8 mtt85 -93.83 -24.62 17.69 Favored 'General case' 0 C--O 1.237 0.418 0 N-CA-C 112.897 0.702 . . . . 86.07 112.897 178.45 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 642' ' ' PHE . . . . . . . . . . . . . 87.9 m-85 -104.35 82.34 1.92 Allowed 'General case' 0 C--N 1.331 -0.198 0 N-CA-C 107.567 -1.272 . . . . 72.99 107.567 175.984 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 643' ' ' THR . . . . . . . . . . . . . 6.8 p -61.51 -65.58 0.67 Allowed 'General case' 0 C--O 1.235 0.306 0 CA-C-N 114.623 -1.171 . . . . 84.09 110.225 178.759 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 644' ' ' LYS . . . . . . . . . . . . . 51.1 mmtt -73.41 129.68 38.52 Favored 'General case' 0 C--O 1.235 0.338 0 CA-C-N 116.39 -0.368 . . . . 86.83 110.307 -178.914 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 645' ' ' ARG . . . . . 0.548 ' NH1' ' O ' ' B' ' 753' ' ' TYR . 22.9 mtt180 -130.99 135.5 47.68 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 108.803 -0.814 . . . . 89.77 108.803 178.006 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 646' ' ' VAL . . . . . . . . . . . . . 15.5 t -125.0 127.65 72.54 Favored 'Isoleucine or valine' 0 C--O 1.236 0.369 0 N-CA-C 108.989 -0.745 . . . . 65.92 108.989 -178.311 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 647' ' ' TYR . . . . . . . . . . . . . 15.2 t80 -83.84 136.3 34.18 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.057 -0.52 . . . . 62.1 109.914 179.45 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 648' ' ' VAL . . . . . . . . . . . . . 74.0 t -123.68 99.45 6.53 Favored 'Isoleucine or valine' 0 C--O 1.238 0.458 0 N-CA-C 106.649 -1.612 . . . . 51.13 106.649 179.888 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 649' ' ' SER . . . . . . . . . . . . . 71.2 p -86.28 170.91 11.65 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 122.042 0.925 . . . . 65.04 111.924 -168.998 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 650' ' ' LEU . . . . . 0.518 HD23 ' SG ' ' B' ' 527' ' ' CYS . 31.6 mt -55.43 146.65 42.14 Favored Pre-proline 0 N--CA 1.452 -0.341 0 CA-C-N 114.919 -1.037 . . . . 61.55 109.29 165.273 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 651' ' ' PRO . . . . . . . . . . . . . 60.6 Cg_endo -72.68 140.84 33.16 Favored 'Trans proline' 0 C--N 1.33 -0.429 0 N-CA-C 110.929 -0.45 . . . . 55.51 110.929 -179.294 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 652' ' ' ASP . . . . . 0.419 ' O ' ' HG3' ' B' ' 656' ' ' ARG . 48.5 p-10 -83.25 -175.64 5.93 Favored 'General case' 0 C--O 1.235 0.315 0 CA-C-O 121.526 0.679 . . . . 73.19 109.59 176.538 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 653' ' ' GLU . . . . . . . . . . . . . 28.7 tt0 -62.02 -46.38 89.43 Favored 'General case' 0 C--O 1.237 0.408 0 C-N-CA 120.387 -0.525 . . . . 77.92 111.679 -169.861 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 654' ' ' GLN . . . . . . . . . . . . . . . -62.93 -33.61 75.71 Favored 'General case' 0 C--O 1.235 0.301 0 C-N-CA 120.265 -0.574 . . . . 55.7 111.732 -178.199 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 655' ' ' THR . . . . . . . . . . . . . 85.8 m -73.64 -41.38 62.83 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.53 -0.468 . . . . 64.26 111.135 177.638 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 656' ' ' ARG . . . . . 0.419 ' HG3' ' O ' ' B' ' 652' ' ' ASP . 86.5 mtm-85 -59.28 -39.57 83.36 Favored 'General case' 0 C--O 1.237 0.441 0 C-N-CA 120.139 -0.624 . . . . 59.55 110.867 176.495 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 657' ' ' GLU . . . . . . . . . . . . . 12.8 tm-20 -59.22 -47.31 85.8 Favored 'General case' 0 C--O 1.237 0.402 0 C-N-CA 120.951 -0.299 . . . . 74.42 110.821 176.869 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 658' ' ' LEU . . . . . . . . . . . . . 24.7 mt -65.57 -37.96 88.18 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 120.42 -0.512 . . . . 69.65 111.29 179.491 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 659' ' ' LEU . . . . . 0.582 HD21 ' C1 ' ' B' ' 802' ' ' SKE . 22.8 mt -64.03 -53.69 45.94 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.783 -0.367 . . . . 70.47 111.249 179.654 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 660' ' ' LEU . . . . . . . . . . . . . 46.6 mt -57.09 -34.89 68.77 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 120.682 -0.407 . . . . 53.88 111.023 176.266 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 661' ' ' ASN . . . . . . . . . . . . . 45.4 t-20 -61.7 -51.75 67.11 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.533 -0.467 . . . . 57.59 110.704 173.86 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 662' ' ' ARG . . . . . 0.545 HH22 ' HE3' ' B' ' 666' ' ' LYS . 9.3 ttt-85 -60.15 -40.74 90.92 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.757 -0.377 . . . . 83.77 111.239 -179.956 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 663' ' ' LEU . . . . . . . . . . . . . 38.2 mt -66.84 -37.66 84.9 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 120.676 -0.41 . . . . 54.33 111.901 -177.817 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 664' ' ' LEU . . . . . . . . . . . . . 26.8 mt -84.31 -9.12 58.74 Favored 'General case' 0 C--O 1.236 0.347 0 N-CA-C 113.082 0.771 . . . . 59.85 113.082 -175.873 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 665' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -62.06 -26.22 68.14 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.131 -0.628 . . . . 71.59 111.332 169.205 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 666' ' ' LYS . . . . . 0.545 ' HE3' HH22 ' B' ' 662' ' ' ARG . 2.3 mttm -67.1 -14.1 62.58 Favored 'General case' 0 C--O 1.235 0.335 0 N-CA-C 112.803 0.668 . . . . 87.68 112.803 178.014 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 667' ' ' GLN . . . . . . . . . . . . . 16.9 mm-40 -120.89 22.25 11.14 Favored 'General case' 0 C--O 1.235 0.298 0 CA-C-N 118.442 0.564 . . . . 80.98 112.142 -179.833 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 668' ' ' GLY . . . . . . . . . . . . . . . 84.15 22.2 55.29 Favored Glycine 0 N--CA 1.449 -0.438 0 N-CA-C 115.565 0.986 . . . . 73.66 115.565 178.815 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 669' ' ' SER . . . . . . . . . . . . . 59.2 m 46.3 67.0 4.76 Favored Pre-proline 0 C--O 1.236 0.37 0 C-N-CA 125.158 1.383 . . . . 68.24 111.96 177.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 670' ' ' PRO . . . . . . . . . . . . . 64.8 Cg_endo -76.95 -11.12 18.1 Favored 'Trans proline' 0 C--O 1.239 0.541 0 N-CA-C 115.058 1.138 . . . . 66.0 115.058 -174.054 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 671' ' ' LEU . . . . . . . . . . . . . 44.1 mt -115.29 140.63 48.94 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 119.501 1.046 . . . . 58.04 110.618 -175.065 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 672' ' ' ASP . . . . . . . . . . . . . 6.1 p30 -78.07 178.28 7.65 Favored 'General case' 0 C--O 1.236 0.343 0 CA-C-O 122.038 0.923 . . . . 67.63 110.437 -179.81 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 673' ' ' THR . . . . . . . . . . . . . 13.2 m -64.7 -33.51 76.13 Favored 'General case' 0 C--O 1.235 0.342 0 CA-C-N 115.597 -0.728 . . . . 74.07 111.897 -177.67 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 674' ' ' GLU . . . . . . . . . . . . . 15.8 mp0 -67.29 -41.36 85.57 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 120.306 -0.558 . . . . 85.24 111.151 179.394 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 675' ' ' ALA . . . . . . . . . . . . . . . -63.93 -40.55 96.72 Favored 'General case' 0 C--O 1.235 0.333 0 C-N-CA 120.25 -0.58 . . . . 55.9 111.682 178.725 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 676' ' ' LEU . . . . . . . . . . . . . 5.0 mt -74.43 -28.47 61.07 Favored 'General case' 0 CA--C 1.518 -0.262 0 C-N-CA 120.459 -0.496 . . . . 62.2 111.792 -179.308 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 677' ' ' ARG . . . . . . . . . . . . . . . -64.84 -42.25 95.06 Favored 'General case' 0 C--N 1.329 -0.283 0 O-C-N 121.865 -0.522 . . . . 54.19 110.375 169.891 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 678' ' ' ARG . . . . . . . . . . . . . 90.3 mtm-85 -65.85 -36.71 84.22 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 120.703 -0.399 . . . . 56.15 111.479 176.678 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 679' ' ' LEU . . . . . 0.484 HD23 HD11 ' B' ' 682' ' ' ILE . 17.9 mt -69.25 -40.02 78.12 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 119.476 -0.89 . . . . 58.54 110.971 179.147 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 680' ' ' ALA . . . . . . . . . . . . . . . -57.24 -38.41 73.76 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 120.65 -0.42 . . . . 57.6 111.234 173.857 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 681' ' ' LYS . . . . . . . . . . . . . 72.9 mttt -63.78 -41.31 97.97 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 120.892 -0.323 . . . . 64.57 111.687 -177.108 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 682' ' ' ILE . . . . . 0.484 HD11 HD23 ' B' ' 679' ' ' LEU . 8.7 pt -88.77 11.25 1.78 Allowed 'Isoleucine or valine' 0 C--O 1.236 0.37 0 O-C-N 121.98 -0.45 . . . . 57.56 111.434 -173.975 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 683' ' ' THR . . . . . . . . . . . . . 63.7 p -125.34 29.21 6.11 Favored 'General case' 0 C--O 1.231 0.106 0 O-C-N 122.036 -0.415 . . . . 63.34 111.974 179.144 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 684' ' ' ASP . . . . . . . . . . . . . 20.3 t70 -72.04 134.2 45.71 Favored 'General case' 0 C--N 1.329 -0.299 0 N-CA-C 108.586 -0.894 . . . . 83.33 108.586 177.943 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 685' ' ' GLY . . . . . . . . . . . . . . . 94.21 -5.59 71.61 Favored Glycine 0 N--CA 1.445 -0.752 0 CA-C-O 119.122 -0.821 . . . . 62.46 114.371 -169.942 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 686' ' ' TYR . . . . . . . . . . . . . 7.7 m-85 -80.92 144.32 32.0 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 118.137 0.969 . . . . 73.09 110.375 177.691 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 687' ' ' SER . . . . . . . . . . . . . 93.4 p -87.74 167.67 13.63 Favored 'General case' 0 N--CA 1.452 -0.36 0 CA-C-O 121.557 0.694 . . . . 54.34 109.847 171.884 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 688' ' ' GLY . . . . . . . . . . . . . . . -58.39 -39.34 92.68 Favored Glycine 0 C--N 1.334 0.446 0 C-N-CA 119.942 -1.123 . . . . 52.45 112.565 176.349 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 689' ' ' SER . . . . . . . . . . . . . 88.8 p -72.22 -29.23 63.75 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 120.006 -0.678 . . . . 53.87 111.488 178.918 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 690' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -62.03 -45.06 95.25 Favored 'General case' 0 C--O 1.236 0.362 0 C-N-CA 120.316 -0.554 . . . . 64.81 111.041 171.658 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 691' ' ' LEU . . . . . . . . . . . . . 78.8 mt -64.71 -42.4 95.28 Favored 'General case' 0 C--O 1.236 0.345 0 C-N-CA 120.714 -0.394 . . . . 51.58 111.481 -178.53 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 692' ' ' THR . . . . . . . . . . . . . 28.9 m -56.22 -50.89 69.99 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 120.837 0.351 . . . . 52.22 111.005 177.211 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 693' ' ' ALA . . . . . . . . . . . . . . . -64.32 -37.06 86.18 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.775 -0.37 . . . . 56.63 111.333 179.839 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 694' ' ' LEU . . . . . . . . . . . . . 52.2 tp -59.28 -49.75 76.64 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 120.616 -0.434 . . . . 63.32 111.031 176.031 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 695' ' ' ALA . . . . . . . . . . . . . . . -63.6 -37.79 88.67 Favored 'General case' 0 C--O 1.236 0.387 0 C-N-CA 121.045 -0.262 . . . . 53.89 111.568 179.928 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 696' ' ' LYS . . . . . . . . . . . . . 12.9 mtpt -70.33 -35.38 73.58 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 120.126 -0.63 . . . . 83.32 111.322 -177.448 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 697' ' ' ASP . . . . . 0.41 ' O ' ' NH2' ' B' ' 704' ' ' ARG . 6.7 t70 -74.64 -36.5 62.89 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 119.722 -0.791 . . . . 73.04 111.084 177.174 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 698' ' ' ALA . . . . . . . . . . . . . . . -65.47 -37.05 85.7 Favored 'General case' 0 C--O 1.237 0.436 0 C-N-CA 120.086 -0.646 . . . . 57.5 111.137 176.35 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 699' ' ' ALA . . . . . . . . . . . . . . . -63.63 -20.2 65.48 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 112.257 0.466 . . . . 56.73 112.257 178.963 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 700' ' ' LEU . . . . . . . . . . . . . 36.7 mt -92.8 -0.1 57.32 Favored 'General case' 0 C--O 1.236 0.349 0 N-CA-C 113.004 0.742 . . . . 65.3 113.004 179.533 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 701' ' ' GLU . . . . . . . . . . . . . 22.1 mm-40 -61.31 -43.88 91.21 Favored Pre-proline 0 C--O 1.244 0.794 0 CA-C-O 117.992 -1.004 . . . . 85.23 113.336 178.769 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 702' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_exo -66.54 -17.19 52.87 Favored 'Trans proline' 0 C--O 1.237 0.466 0 CA-C-N 121.592 1.604 . . . . 81.15 113.42 176.522 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 703' ' ' ILE . . . . . . . . . . . . . 15.3 mm -79.26 -46.98 23.0 Favored 'Isoleucine or valine' 0 C--O 1.236 0.365 0 CA-C-N 118.669 0.668 . . . . 73.2 110.284 172.763 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 704' ' ' ARG . . . . . 0.41 ' NH2' ' O ' ' B' ' 697' ' ' ASP . 79.2 mtm-85 -65.46 -22.51 66.76 Favored 'General case' 0 C--O 1.236 0.38 0 N-CA-C 112.731 0.641 . . . . 82.48 112.731 -176.123 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 705' ' ' GLU . . . . . . . . . . . . . 26.7 pt-20 -83.55 -4.0 58.16 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 112.946 0.721 . . . . 87.17 112.946 -178.367 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 706' ' ' LEU . . . . . . . . . . . . . 6.7 mp -106.49 -176.67 3.14 Favored 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 123.942 0.897 . . . . 82.78 108.915 172.138 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 707' ' ' ASN . . . . . . . . . . . . . 32.0 p30 -117.49 172.35 7.39 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-O 121.568 0.699 . . . . 90.24 109.414 172.399 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 708' ' ' VAL . . . . . . . . . . . . . 53.9 t -55.82 -42.05 68.89 Favored 'Isoleucine or valine' 0 C--O 1.237 0.445 0 CA-C-N 115.063 -0.971 . . . . 83.0 110.791 -175.462 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 709' ' ' GLU . . . . . . . . . . . . . . . -63.53 -46.54 85.56 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 120.412 -0.515 . . . . 82.23 111.037 179.532 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 710' ' ' GLN . . . . . . . . . . . . . 37.9 mt-30 -61.65 -47.36 85.73 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 120.554 -0.458 . . . . 82.96 111.118 178.06 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 711' ' ' VAL . . . . . . . . . . . . . 95.7 t -62.33 -36.57 75.33 Favored 'Isoleucine or valine' 0 C--O 1.238 0.45 0 CA-C-O 120.99 0.424 . . . . 81.44 110.456 -179.079 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 712' ' ' LYS . . . . . . . . . . . . . . . -64.26 -25.92 68.27 Favored 'General case' 0 C--O 1.237 0.396 0 C-N-CA 120.427 -0.509 . . . . 85.49 111.853 -179.365 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 713' ' ' CYS . . . . . . . . . . . . . . . -111.19 -5.33 14.74 Favored 'General case' 0 C--O 1.236 0.387 0 N-CA-C 113.684 0.994 . . . . 90.85 113.684 -179.776 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 714' ' ' LEU . . . . . . . . . . . . . . . -64.13 129.69 40.97 Favored 'General case' 0 C--O 1.234 0.246 0 CA-C-N 118.714 0.688 . . . . 90.96 110.854 -175.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 715' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -80.95 153.0 27.74 Favored 'General case' 0 C--O 1.235 0.309 0 CA-C-O 121.378 0.609 . . . . 103.64 110.669 -177.901 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 716' ' ' ILE . . . . . . . . . . . . . . . -63.93 -28.05 44.11 Favored 'Isoleucine or valine' 0 C--O 1.238 0.451 0 CA-C-N 115.449 -0.796 . . . . 93.64 110.87 179.582 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 717' ' ' SER . . . . . . . . . . . . . . . -70.42 -39.56 74.35 Favored 'General case' 0 C--O 1.237 0.424 0 C-N-CA 120.446 -0.501 . . . . 94.14 111.341 178.675 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 718' ' ' ALA . . . . . . . . . . . . . . . -81.28 13.69 2.77 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 113.172 0.804 . . . . 84.88 113.172 -179.225 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 719' ' ' MET . . . . . . . . . . . . . 9.0 tpt -77.48 108.61 10.77 Favored 'General case' 0 C--O 1.236 0.348 0 N-CA-C 108.624 -0.88 . . . . 97.25 108.624 176.798 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 720' ' ' ARG . . . . . . . . . . . . . 23.1 ptt85 -73.95 151.46 40.35 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-O 121.739 0.78 . . . . 71.87 110.903 -177.218 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 721' ' ' ALA . . . . . . . . . . . . . . . -77.95 156.84 29.99 Favored 'General case' 0 C--O 1.236 0.364 0 CA-C-O 121.842 0.83 . . . . 76.82 110.691 -178.447 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 722' ' ' ILE . . . . . . . . . . . . . 18.6 mt -67.06 137.65 24.4 Favored 'Isoleucine or valine' 0 C--O 1.238 0.452 0 CA-C-N 115.248 -0.887 . . . . 71.67 109.401 176.443 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 723' ' ' THR . . . . . . . . . . . . . 24.7 p -108.19 165.78 11.23 Favored 'General case' 0 C--N 1.327 -0.406 0 CA-C-O 121.733 0.778 . . . . 69.43 110.576 179.551 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 724' ' ' GLU . . . . . . . . . . . . . 82.1 tt0 -64.53 -29.87 70.9 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.007 -0.997 . . . . 64.4 111.093 173.003 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 725' ' ' GLN . . . . . . . . . . . . . 32.5 tp60 -70.78 -27.27 63.79 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 120.549 -0.46 . . . . 92.99 111.8 177.934 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 726' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -58.75 -41.72 87.2 Favored 'General case' 0 C--O 1.237 0.432 0 C-N-CA 120.133 -0.627 . . . . 66.18 110.952 174.966 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 727' ' ' PHE . . . . . . . . . . . . . 42.5 m-85 -65.39 -35.79 82.01 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 120.506 -0.478 . . . . 63.88 111.48 176.767 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 728' ' ' HIS . . . . . . . . . . . . . 0.3 OUTLIER -63.05 -38.7 92.23 Favored 'General case' 0 C--O 1.237 0.397 0 C-N-CA 120.162 -0.615 . . . . 71.58 111.24 -177.578 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 729' ' ' SER . . . . . . . . . . . . . 13.2 p -74.37 -32.39 62.73 Favored 'General case' 0 C--O 1.237 0.403 0 C-N-CA 119.951 -0.699 . . . . 75.97 111.605 175.183 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 730' ' ' SER . . . . . . . . . . . . . 41.2 m -68.67 -29.5 67.97 Favored 'General case' 0 C--O 1.235 0.331 0 C-N-CA 120.674 -0.41 . . . . 75.02 111.75 177.958 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 731' ' ' LEU . . . . . . . . . . . . . 22.1 mt -64.09 -19.59 65.36 Favored 'General case' 0 C--O 1.236 0.346 0 N-CA-C 112.152 0.427 . . . . 81.51 112.152 178.339 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 732' ' ' LYS . . . . . . . . . . . . . . . -73.84 -37.22 64.88 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 120.24 -0.584 . . . . 88.74 111.132 174.246 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 733' ' ' ARG . . . . . . . . . . . . . 1.4 mpp_? -79.23 -39.75 32.41 Favored 'General case' 0 C--O 1.236 0.378 0 N-CA-C 112.016 0.376 . . . . 87.01 112.016 -177.535 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 734' ' ' ILE . . . . . . . . . . . . . 82.0 mt -115.43 114.31 45.98 Favored 'Isoleucine or valine' 0 C--O 1.237 0.442 0 N-CA-C 108.138 -1.06 . . . . 88.07 108.138 -170.495 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 735' ' ' ARG . . . . . . . . . . . . . . . -110.09 167.98 9.77 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 121.761 0.791 . . . . 88.55 110.623 -177.705 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 736' ' ' ARG . . . . . . . . . . . . . . . -56.96 138.34 54.27 Favored 'General case' 0 C--O 1.234 0.269 0 CA-C-N 115.041 -0.982 . . . . 81.47 110.356 177.567 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 737' ' ' SER . . . . . 0.445 ' O ' ' O ' ' B' ' 901' ' ' HOH . 67.1 p -94.31 -20.53 19.7 Favored 'General case' 0 C--O 1.235 0.329 0 N-CA-C 113.613 0.968 . . . . 75.96 113.613 -173.308 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 738' ' ' VAL . . . . . . . . . . . . . 17.0 t -114.98 120.23 64.0 Favored 'Isoleucine or valine' 0 C--O 1.238 0.489 0 N-CA-C 108.611 -0.885 . . . . 92.3 108.611 -175.383 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 739' ' ' ALA . . . . . . . . . . . . . . . -77.92 147.96 74.72 Favored Pre-proline 0 C--O 1.234 0.272 0 CA-C-N 116.155 -0.475 . . . . 93.96 110.816 -171.807 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 740' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo -59.77 -23.8 73.37 Favored 'Trans proline' 0 C--O 1.238 0.516 0 N-CA-C 113.863 0.678 . . . . 93.63 113.863 -179.57 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 741' ' ' GLN . . . . . . . . . . . . . . . -64.12 -36.49 84.2 Favored 'General case' 0 C--O 1.238 0.475 0 C-N-CA 120.115 -0.634 . . . . 93.33 110.943 172.768 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 742' ' ' SER . . . . . . . . . . . . . 2.1 m -69.18 -36.65 77.55 Favored 'General case' 0 C--O 1.237 0.411 0 C-N-CA 120.972 -0.291 . . . . 93.97 111.602 -174.771 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 743' ' ' LEU . . . . . . . . . . . . . 2.2 mp -64.68 -37.69 88.44 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 120.001 -0.679 . . . . 89.5 112.134 -176.142 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 744' ' ' ASN . . . . . . . . . . . . . . . -58.54 -35.87 72.99 Favored 'General case' 0 C--O 1.237 0.428 0 C-N-CA 120.018 -0.673 . . . . 89.27 110.931 -178.991 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 745' ' ' SER . . . . . . . . . . . . . 2.6 m -64.9 -49.2 71.39 Favored 'General case' 0 C--O 1.237 0.444 0 C-N-CA 120.609 -0.436 . . . . 82.87 110.985 176.103 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 746' ' ' TYR . . . . . . . . . . . . . 49.2 m-85 -57.42 -43.01 83.43 Favored 'General case' 0 C--O 1.236 0.39 0 C-N-CA 120.57 -0.452 . . . . 74.59 111.091 177.317 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 747' ' ' GLU . . . . . . . . . . . . . . . -64.63 -46.79 81.07 Favored 'General case' 0 C--O 1.236 0.394 0 C-N-CA 120.625 -0.43 . . . . 84.43 110.83 177.456 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 748' ' ' LYS . . . . . . . . . . . . . . . -63.81 -47.24 81.65 Favored 'General case' 0 C--O 1.237 0.435 0 C-N-CA 120.507 -0.477 . . . . 83.49 110.942 178.845 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 749' ' ' TRP . . . . . . . . . . . . . 12.3 t90 -60.77 -39.3 88.29 Favored 'General case' 0 C--O 1.236 0.358 0 C-N-CA 120.491 -0.484 . . . . 87.66 111.147 179.571 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 750' ' ' SER . . . . . . . . . . . . . 31.3 t -64.34 -42.61 96.19 Favored 'General case' 0 C--O 1.237 0.395 0 C-N-CA 120.487 -0.485 . . . . 88.12 111.483 -179.362 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 751' ' ' GLN . . . . . . . . . . . . . . . -72.7 -42.57 64.08 Favored 'General case' 0 C--O 1.236 0.382 0 C-N-CA 120.15 -0.62 . . . . 95.87 111.453 -175.638 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 752' ' ' ASP . . . . . . . . . . . . . 48.6 m-20 -87.42 -26.5 23.25 Favored 'General case' 0 C--O 1.237 0.406 0 N-CA-C 113.475 0.917 . . . . 106.42 113.475 -172.014 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 753' ' ' TYR . . . . . 0.548 ' O ' ' NH1' ' B' ' 645' ' ' ARG . . . -129.46 -12.46 4.44 Favored 'General case' 0 C--O 1.236 0.39 0 N-CA-C 114.333 1.235 . . . . 95.72 114.333 -177.232 . . . . . . . . 2 2 . 1 . 001 ecloud nobuild full ' B' B ' 754' ' ' GLY . . . . . . . . . . . . . . . -77.74 -137.13 0.99 Allowed Glycine 0 N--CA 1.45 -0.383 0 CA-C-N 119.303 0.956 . . . . 95.4 113.567 -179.387 . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 755' ' ' ASP . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.273 0 O-C-N 122.656 -0.32 . . . . 97.35 111.09 179.615 . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 801' ' ' SO4 . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 802' ' ' SKE . . . . . 0.582 ' C1 ' HD21 ' B' ' 659' ' ' LEU . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 ecloud nobuild full ' B' B ' 803' ' ' MPD . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 901' ' ' HOH . . . . . 0.445 ' O ' ' O ' ' B' ' 737' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 0 . 1 . 001 ecloud nobuild full ' B' B ' 905' ' ' HOH . . . . . 0.557 ' O ' ' N ' ' B' ' 599' ' ' SER . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 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 0 . 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 0 . 1 . 001 ecloud nobuild full ' B' B ' 917' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 918' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 919' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 920' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 921' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 922' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 923' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 924' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 925' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 926' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 927' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 928' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 929' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 930' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 931' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 932' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 933' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 934' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 935' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 ecloud nobuild full ' B' B ' 936' ' ' HOH . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_