==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 19-OCT-07 3B3B . COMPND 2 MOLECULE: AMINOPEPTIDASE N; . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI K12; . AUTHOR A.ADDLAGATTA . 867 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33011.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 625 72.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 30 3.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 129 14.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 60 6.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 82 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 300 34.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 1.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 3 2 0 2 1 0 2 1 4 1 3 1 2 1 2 1 0 0 0 0 1 0 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 1 0 2 0 2 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 3 5 0 5 1 3 0 0 3 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 3 2 3 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 5 A P 0 0 89 0, 0.0 2,-0.4 0, 0.0 366,-0.1 0.000 360.0 360.0 360.0 137.0 -51.4 58.2 29.1 2 6 A Q - 0 0 162 364,-0.2 2,-0.1 1,-0.0 363,-0.0 -0.787 360.0-124.0-106.8 137.2 -49.1 55.6 30.7 3 7 A A - 0 0 24 -2,-0.4 2,-0.4 361,-0.0 363,-0.3 -0.463 19.1-147.4 -74.7 145.6 -45.9 54.1 29.1 4 8 A K E -A 365 0A 137 361,-3.2 361,-2.6 -2,-0.1 2,-0.4 -0.912 12.4-144.1-112.5 148.9 -45.6 50.4 28.8 5 9 A Y E > -A 364 0A 89 -2,-0.4 3,-1.5 359,-0.2 359,-0.2 -0.912 16.1-139.9-123.2 137.0 -42.2 48.7 29.1 6 10 A R G > S+ 0 0 67 357,-2.2 3,-1.8 -2,-0.4 -1,-0.1 0.867 104.3 60.3 -58.1 -41.1 -40.7 45.7 27.3 7 11 A H G 3 S+ 0 0 147 356,-0.4 -1,-0.3 1,-0.3 357,-0.1 0.618 94.2 67.2 -65.9 -11.5 -39.1 44.4 30.5 8 12 A D G < + 0 0 108 -3,-1.5 -1,-0.3 2,-0.0 -2,-0.2 0.437 69.6 134.9 -87.3 1.0 -42.6 44.2 32.1 9 13 A Y < + 0 0 73 -3,-1.8 2,-0.3 -4,-0.1 299,-0.0 -0.233 27.3 172.7 -51.8 130.0 -43.7 41.3 29.8 10 14 A R - 0 0 156 0, 0.0 3,-0.1 0, 0.0 -2,-0.0 -0.996 38.4-102.9-139.0 138.2 -45.5 38.5 31.7 11 15 A A - 0 0 62 -2,-0.3 2,-0.1 1,-0.1 30,-0.0 -0.229 54.5 -92.9 -50.6 145.2 -47.3 35.5 30.4 12 16 A P - 0 0 14 0, 0.0 -1,-0.1 0, 0.0 29,-0.1 -0.381 19.0-136.3 -69.3 143.6 -51.1 36.0 30.6 13 17 A D S S+ 0 0 36 28,-0.1 28,-3.5 1,-0.1 29,-2.8 0.779 92.4 31.0 -63.1 -29.9 -53.0 34.8 33.6 14 18 A Y E -B 40 0B 5 26,-0.3 2,-0.3 27,-0.2 26,-0.2 -0.981 69.4-154.4-131.5 143.6 -55.7 33.4 31.3 15 19 A Q E -B 39 0B 38 24,-3.1 24,-2.6 -2,-0.4 2,-0.5 -0.857 7.9-148.1-105.9 150.4 -55.7 31.9 27.8 16 20 A I E +B 38 0B 0 -2,-0.3 22,-0.2 22,-0.2 3,-0.1 -0.993 15.7 178.7-111.9 128.9 -58.6 31.9 25.3 17 21 A T E + 0 0 45 20,-2.7 119,-2.4 -2,-0.5 2,-0.3 0.714 65.7 15.2 -98.8 -28.1 -58.5 28.8 23.0 18 22 A D E -Bc 37 136B 44 19,-0.8 19,-2.7 117,-0.3 2,-0.4 -0.991 59.7-169.1-152.2 135.0 -61.6 29.3 20.9 19 23 A I E -Bc 36 137B 0 117,-2.5 119,-2.0 -2,-0.3 2,-0.6 -0.997 6.2-162.5-134.5 132.5 -63.9 32.2 20.2 20 24 A D E -Bc 35 138B 63 15,-2.7 15,-2.7 -2,-0.4 2,-0.4 -0.963 17.6-166.2-112.4 113.9 -67.2 32.2 18.4 21 25 A L E -Bc 34 139B 1 117,-3.2 119,-3.2 -2,-0.6 2,-0.4 -0.798 11.7-170.6-101.7 141.4 -68.3 35.6 17.3 22 26 A T E -Bc 33 140B 42 11,-2.5 11,-2.8 -2,-0.4 2,-0.5 -0.998 5.0-166.9-125.4 128.3 -71.7 36.8 16.1 23 27 A F E -Bc 32 141B 0 117,-2.7 119,-3.0 -2,-0.4 2,-1.0 -0.968 12.0-164.5-112.0 120.3 -72.2 40.2 14.5 24 28 A D E -Bc 31 142B 67 7,-2.9 7,-2.0 -2,-0.5 2,-0.2 -0.867 36.5-146.1 -95.3 96.1 -75.7 41.6 14.0 25 29 A L + 0 0 1 117,-3.0 119,-0.4 -2,-1.0 2,-0.3 -0.483 38.7 142.3 -82.3 135.8 -74.4 44.2 11.6 26 30 A D - 0 0 68 -2,-0.2 71,-0.2 117,-0.1 -2,-0.1 -0.907 48.9-127.8-161.5 140.6 -75.7 47.7 11.2 27 31 A A S S+ 0 0 10 -2,-0.3 70,-3.2 1,-0.2 71,-0.3 0.858 110.3 38.2 -60.2 -37.5 -73.8 51.0 10.5 28 32 A Q S S+ 0 0 129 1,-0.3 2,-0.3 68,-0.2 -1,-0.2 0.871 133.8 10.3 -79.6 -40.9 -75.5 52.8 13.5 29 33 A K - 0 0 112 66,-0.1 2,-0.5 68,-0.0 -1,-0.3 -0.875 64.1-175.4-149.1 108.4 -75.6 49.9 16.0 30 34 A T E - D 0 94B 0 64,-2.8 64,-2.1 -2,-0.3 2,-0.5 -0.897 15.9-147.3-103.1 131.1 -73.9 46.6 15.6 31 35 A V E -BD 24 93B 36 -7,-2.0 -7,-2.9 -2,-0.5 2,-0.5 -0.899 12.5-162.1-101.2 123.3 -74.5 44.0 18.3 32 36 A V E -BD 23 92B 0 60,-3.2 60,-2.3 -2,-0.5 2,-0.5 -0.921 7.1-170.7-107.1 125.9 -71.5 41.7 19.0 33 37 A T E -BD 22 91B 34 -11,-2.8 -11,-2.5 -2,-0.5 2,-0.5 -0.977 9.4-174.2-112.8 123.8 -71.9 38.3 20.8 34 38 A A E -BD 21 90B 3 56,-3.0 56,-2.5 -2,-0.5 2,-0.6 -0.967 10.0-173.0-126.4 117.7 -68.6 36.7 21.7 35 39 A V E -BD 20 89B 34 -15,-2.7 -15,-2.7 -2,-0.5 2,-0.4 -0.930 15.2-177.8-113.2 108.5 -68.4 33.2 23.2 36 40 A S E -BD 19 88B 3 52,-2.8 52,-3.1 -2,-0.6 2,-0.7 -0.872 25.5-140.3-111.9 137.5 -64.9 32.4 24.4 37 41 A Q E -BD 18 87B 60 -19,-2.7 -20,-2.7 -2,-0.4 -19,-0.8 -0.877 33.3-168.9 -93.9 115.1 -63.5 29.2 25.9 38 42 A A E -BD 16 86B 2 48,-3.0 48,-1.8 -2,-0.7 2,-0.4 -0.777 17.1-166.6-112.2 153.2 -61.0 30.3 28.6 39 43 A V E -BD 15 85B 16 -24,-2.6 -24,-3.1 -2,-0.3 2,-0.4 -0.997 20.6-131.0-138.1 127.4 -58.4 28.5 30.7 40 44 A R E +B 14 0B 34 44,-3.3 -26,-0.3 -2,-0.4 -27,-0.1 -0.688 30.3 165.2 -81.2 130.1 -56.7 29.9 33.8 41 45 A H + 0 0 123 -28,-3.5 -27,-0.2 -2,-0.4 -1,-0.2 0.654 59.8 63.6-109.4 -29.2 -52.9 29.6 33.8 42 46 A G S S- 0 0 28 -29,-2.8 -29,-0.0 1,-0.2 -2,-0.0 0.161 103.1 -35.4 -84.0-161.3 -52.2 32.1 36.6 43 47 A A > - 0 0 55 1,-0.1 3,-2.9 2,-0.1 -1,-0.2 -0.297 55.4-119.5 -62.4 139.7 -53.0 32.2 40.3 44 48 A S T 3 S+ 0 0 97 1,-0.3 38,-0.2 -3,-0.1 -1,-0.1 0.734 115.2 49.5 -53.7 -23.3 -56.4 30.8 41.3 45 49 A D T 3 S+ 0 0 135 36,-0.1 -1,-0.3 2,-0.1 36,-0.1 0.313 82.9 117.0 -98.5 8.0 -57.3 34.2 42.7 46 50 A A < - 0 0 10 -3,-2.9 36,-0.3 -33,-0.1 2,-0.1 -0.583 60.9-134.3 -77.8 133.9 -56.2 36.2 39.6 47 51 A P - 0 0 27 0, 0.0 2,-0.6 0, 0.0 33,-0.2 -0.498 19.8-109.8 -83.3 161.3 -59.1 38.0 37.9 48 52 A L E -I 79 0C 1 31,-3.0 31,-3.1 -2,-0.1 2,-0.7 -0.830 32.0-159.9 -87.7 121.6 -59.6 38.0 34.2 49 53 A R E -I 78 0C 142 -2,-0.6 2,-0.4 29,-0.2 29,-0.2 -0.897 7.9-169.0-110.2 108.8 -58.8 41.4 32.8 50 54 A L E -I 77 0C 0 27,-3.1 27,-2.3 -2,-0.7 2,-0.3 -0.805 18.0-129.4-100.1 135.5 -60.3 42.1 29.4 51 55 A N E +IJ 76 127C 41 76,-3.0 76,-2.2 -2,-0.4 2,-0.3 -0.626 36.0 162.5 -77.9 139.3 -59.4 45.1 27.2 52 56 A G - 0 0 3 23,-1.9 2,-0.4 -2,-0.3 71,-0.2 -0.954 17.6-170.7-158.0 140.7 -62.2 47.1 25.8 53 57 A E S S- 0 0 55 69,-2.5 21,-0.0 -2,-0.3 -2,-0.0 -0.993 72.7 -10.4-135.8 127.3 -62.6 50.6 24.4 54 58 A D S S+ 0 0 142 -2,-0.4 2,-0.4 1,-0.2 -1,-0.1 0.910 90.1 146.4 54.8 47.8 -65.8 52.5 23.5 55 59 A L - 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0 0 32 1,-0.2 4,-2.4 336,-0.1 5,-0.2 -0.822 43.3-163.4 -88.8 113.2 -33.9 45.4 -11.1 333 337 A R H > S+ 0 0 84 -2,-0.8 4,-2.9 -5,-0.3 5,-0.2 0.908 90.7 52.9 -60.5 -42.1 -32.0 44.5 -7.9 334 338 A A H > S+ 0 0 16 2,-0.2 4,-2.9 1,-0.2 -1,-0.2 0.927 110.0 46.2 -59.9 -46.6 -29.8 47.6 -8.3 335 339 A V H > S+ 0 0 27 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.914 113.8 49.3 -66.6 -42.6 -32.7 50.0 -8.6 336 340 A N H X S+ 0 0 38 -4,-2.4 4,-2.5 2,-0.2 5,-0.2 0.957 113.2 46.0 -57.1 -51.2 -34.4 48.4 -5.6 337 341 A R H X S+ 0 0 14 -4,-2.9 4,-2.5 2,-0.2 5,-0.2 0.943 112.7 51.0 -58.0 -49.5 -31.3 48.5 -3.5 338 342 A I H X S+ 0 0 0 -4,-2.9 4,-2.5 1,-0.2 -1,-0.2 0.941 112.4 45.9 -52.3 -51.6 -30.6 52.2 -4.5 339 343 A N H X S+ 0 0 61 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.875 111.8 50.6 -64.6 -36.1 -34.2 53.2 -3.6 340 344 A N H X S+ 0 0 30 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.864 110.8 49.7 -69.0 -33.4 -34.1 51.4 -0.3 341 345 A V H X S+ 0 0 0 -4,-2.5 4,-3.1 2,-0.2 5,-0.4 0.898 107.1 54.8 -70.8 -40.1 -30.8 53.0 0.6 342 346 A R H X S+ 0 0 21 -4,-2.5 4,-2.5 1,-0.2 5,-0.3 0.921 109.8 48.2 -55.6 -44.7 -32.3 56.5 -0.3 343 347 A T H X>S+ 0 0 42 -4,-2.0 5,-2.1 3,-0.2 4,-1.8 0.909 113.3 47.3 -62.5 -43.4 -35.1 55.7 2.1 344 348 A M H <>S+ 0 0 0 -4,-2.1 5,-2.7 3,-0.2 6,-0.2 0.961 120.2 35.4 -63.3 -53.3 -32.6 54.7 4.9 345 349 A R H <5S+ 0 0 56 -4,-3.1 -2,-0.2 3,-0.2 -1,-0.2 0.851 126.0 38.3 -70.9 -36.6 -30.3 57.6 4.5 346 350 A G H <5S+ 0 0 3 -4,-2.5 -3,-0.2 -5,-0.4 -1,-0.2 0.740 134.6 11.4 -89.7 -25.7 -32.8 60.3 3.7 347 351 A L T X5S+ 0 0 72 -4,-1.8 4,-1.5 -5,-0.3 -3,-0.2 0.730 125.9 46.0-120.7 -48.8 -35.8 59.3 6.0 348 352 A Q H >4 S+ 0 0 3 -6,-0.2 3,-0.6 1,-0.2 -1,-0.2 0.903 108.1 48.0 -60.5 -42.7 -33.6 61.5 10.3 351 355 A E H >< S+ 0 0 10 -4,-1.5 3,-1.8 1,-0.2 -2,-0.2 0.923 108.6 53.4 -64.1 -41.9 -35.9 59.5 12.6 352 356 A D H 3< S+ 0 0 3 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.656 109.6 50.1 -66.8 -15.3 -32.9 58.0 14.4 353 357 A A T << S+ 0 0 56 -4,-0.8 -1,-0.3 -3,-0.6 -2,-0.2 0.271 102.2 86.8 -99.7 6.2 -31.6 61.6 15.0 354 358 A S S X S- 0 0 4 -3,-1.8 3,-1.8 -5,-0.1 474,-0.1 -0.492 94.5-100.4-107.5 169.4 -35.0 62.7 16.3 355 359 A P T 3 S+ 0 0 19 0, 0.0 473,-0.1 0, 0.0 -4,-0.1 0.734 120.5 60.5 -57.5 -22.9 -36.8 62.8 19.7 356 360 A M T 3 S+ 0 0 3 -5,-0.2 -4,-0.1 471,-0.1 -5,-0.1 0.347 75.3 142.3 -89.6 8.5 -38.7 59.7 18.6 357 361 A A < + 0 0 7 -3,-1.8 -5,-0.1 -6,-0.1 82,-0.1 -0.158 20.6 161.0 -51.7 139.2 -35.6 57.6 18.2 358 362 A H - 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0 0 143 -3,-1.5 2,-0.4 -4,-0.1 -3,-0.0 -0.330 36.5-166.7 -54.4 136.7 -38.8 57.1 -26.7 661 665 A Q - 0 0 28 1,-0.1 -2,-0.1 13,-0.0 -1,-0.0 -0.976 16.4-167.9-132.5 118.4 -41.1 54.0 -26.6 662 666 A S S S+ 0 0 77 -2,-0.4 2,-0.3 2,-0.0 -1,-0.1 0.895 77.2 62.7 -73.9 -38.1 -44.3 53.9 -28.6 663 667 A E S S- 0 0 113 2,-0.0 2,-0.6 1,-0.0 41,-0.0 -0.697 79.5-140.2 -83.5 137.5 -45.7 50.9 -26.8 664 668 A Y + 0 0 30 -2,-0.3 2,-0.4 40,-0.1 -388,-0.1 -0.900 29.3 169.8 -96.2 121.1 -46.4 51.1 -23.1 665 669 A R - 0 0 98 -2,-0.6 2,-1.5 2,-0.1 -2,-0.0 -0.995 39.8-138.7-129.8 138.8 -45.4 48.0 -21.1 666 670 A V + 0 0 37 -2,-0.4 2,-0.3 4,-0.1 3,-0.1 -0.638 66.3 125.6 -87.7 72.9 -45.2 47.3 -17.4 667 671 A E S > S- 0 0 109 -2,-1.5 4,-2.7 1,-0.1 3,-0.4 -0.992 70.2-119.5-138.8 141.1 -41.9 45.4 -18.0 668 672 A H H > S+ 0 0 70 -2,-0.3 4,-2.3 1,-0.3 5,-0.1 0.842 110.5 49.3 -61.0 -39.7 -38.6 46.1 -16.3 669 673 A E H > S+ 0 0 163 1,-0.2 4,-2.0 2,-0.2 -1,-0.3 0.913 115.9 44.5 -61.9 -42.7 -36.5 46.9 -19.4 670 674 A D H > S+ 0 0 15 -3,-0.4 4,-2.3 2,-0.2 -2,-0.2 0.871 111.7 52.4 -66.5 -41.6 -39.2 49.4 -20.6 671 675 A I H X S+ 0 0 13 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.914 108.3 52.6 -60.9 -41.8 -39.6 50.9 -17.1 672 676 A A H X S+ 0 0 11 -4,-2.3 4,-2.3 -5,-0.2 -2,-0.2 0.928 110.4 45.9 -61.1 -48.9 -35.9 51.5 -17.0 673 677 A K H X S+ 0 0 73 -4,-2.0 4,-2.6 1,-0.2 -1,-0.2 0.886 114.6 48.5 -58.9 -41.0 -35.8 53.3 -20.4 674 678 A R H X S+ 0 0 4 -4,-2.3 4,-2.7 2,-0.2 -2,-0.2 0.877 108.7 53.0 -68.5 -38.3 -38.8 55.4 -19.4 675 679 A T H X S+ 0 0 45 -4,-2.6 4,-1.7 2,-0.2 -2,-0.2 0.921 113.0 45.4 -64.4 -41.1 -37.3 56.3 -16.0 676 680 A L H X S+ 0 0 12 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.925 111.5 51.1 -65.1 -46.6 -34.1 57.5 -17.8 677 681 A R H X S+ 0 0 29 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.927 113.5 45.3 -58.6 -44.9 -36.1 59.4 -20.4 678 682 A N H X S+ 0 0 21 -4,-2.7 4,-1.9 2,-0.2 -1,-0.2 0.791 107.6 56.9 -72.2 -26.1 -38.1 61.2 -17.7 679 683 A A H X S+ 0 0 9 -4,-1.7 4,-1.3 2,-0.2 -1,-0.2 0.926 110.1 46.6 -66.1 -42.7 -34.9 61.8 -15.6 680 684 A C H X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.918 108.8 55.0 -61.3 -44.0 -33.7 63.7 -18.8 681 685 A L H X S+ 0 0 1 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.885 101.0 59.5 -57.0 -40.2 -37.0 65.5 -19.1 682 686 A R H < S+ 0 0 84 -4,-1.9 4,-0.4 2,-0.2 -1,-0.2 0.920 110.7 40.2 -57.0 -47.0 -36.7 66.8 -15.5 683 687 A F H >< S+ 0 0 8 -4,-1.3 3,-2.0 -3,-0.2 -1,-0.2 0.939 112.2 56.5 -65.5 -47.1 -33.4 68.6 -16.4 684 688 A L H >< S+ 0 0 13 -4,-2.7 3,-1.4 1,-0.3 -2,-0.2 0.803 99.3 60.8 -56.2 -31.4 -34.8 69.7 -19.8 685 689 A A T 3< S+ 0 0 2 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.737 104.1 51.0 -64.4 -25.0 -37.7 71.4 -18.0 686 690 A F T < S+ 0 0 13 -3,-2.0 -1,-0.3 -4,-0.4 -2,-0.2 0.155 100.7 79.7-101.5 13.9 -35.1 73.6 -16.2 687 691 A G S < S- 0 0 21 -3,-1.4 -41,-0.1 1,-0.3 -3,-0.1 -0.008 99.3 -13.1 -97.9-153.2 -33.3 74.6 -19.4 688 692 A E S > S- 0 0 125 1,-0.1 4,-2.8 -43,-0.1 -1,-0.3 -0.263 70.7-131.2 -52.8 129.1 -34.2 77.2 -22.0 689 693 A T H > S+ 0 0 78 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.813 97.8 47.0 -61.0 -45.5 -37.8 78.2 -21.3 690 694 A H H > S+ 0 0 132 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.942 116.6 43.6 -65.4 -47.3 -39.5 78.0 -24.7 691 695 A L H > S+ 0 0 78 2,-0.2 4,-2.9 1,-0.2 5,-0.2 0.916 115.2 51.5 -61.7 -43.8 -38.0 74.6 -25.6 692 696 A A H X S+ 0 0 1 -4,-2.8 4,-2.6 1,-0.2 5,-0.2 0.936 110.2 47.7 -55.1 -51.3 -38.8 73.4 -22.0 693 697 A D H X S+ 0 0 33 -4,-2.8 4,-2.2 1,-0.2 5,-0.3 0.865 114.3 47.1 -61.6 -37.6 -42.4 74.5 -22.3 694 698 A V H X S+ 0 0 68 -4,-2.0 4,-2.2 2,-0.2 5,-0.2 0.940 113.4 46.7 -70.6 -47.3 -42.8 72.8 -25.7 695 699 A L H X S+ 0 0 17 -4,-2.9 4,-2.4 2,-0.2 -2,-0.2 0.933 116.8 43.9 -59.6 -49.0 -41.2 69.5 -24.6 696 700 A V H X S+ 0 0 0 -4,-2.6 4,-2.5 -5,-0.2 -2,-0.2 0.938 115.2 45.4 -66.4 -50.3 -43.2 69.3 -21.4 697 701 A S H X S+ 0 0 30 -4,-2.2 4,-2.3 -5,-0.2 5,-0.2 0.900 113.6 51.7 -60.2 -42.3 -46.6 70.3 -22.9 698 702 A K H X S+ 0 0 110 -4,-2.2 4,-2.7 -5,-0.3 5,-0.3 0.942 110.7 47.1 -60.9 -47.9 -46.1 68.0 -25.8 699 703 A Q H X S+ 0 0 8 -4,-2.4 4,-1.9 -5,-0.2 -2,-0.2 0.928 111.0 51.6 -62.6 -42.7 -45.3 65.0 -23.5 700 704 A F H < S+ 0 0 27 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.927 117.5 39.3 -56.8 -46.1 -48.3 65.7 -21.3 701 705 A H H < S+ 0 0 101 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.809 120.9 41.7 -77.6 -31.0 -50.6 65.8 -24.3 702 706 A E H < S+ 0 0 133 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.584 83.6 123.2 -93.9 -11.5 -49.1 62.9 -26.3 703 707 A A < - 0 0 30 -4,-1.9 3,-0.0 -5,-0.3 -3,-0.0 -0.221 43.8-165.5 -51.6 133.5 -48.5 60.6 -23.3 704 708 A N S S+ 0 0 87 -42,-0.0 2,-0.3 1,-0.0 -1,-0.1 0.142 74.1 37.5-103.4 17.7 -50.2 57.2 -23.7 705 709 A N S > S- 0 0 7 -428,-0.1 4,-1.8 1,-0.0 -428,-0.2 -0.976 84.7-112.3-161.7 155.7 -49.7 56.3 -20.1 706 710 A M H > S+ 0 0 4 -430,-2.8 4,-2.8 -427,-0.5 5,-0.3 0.760 109.0 66.0 -68.6 -25.3 -49.9 58.1 -16.7 707 711 A T H > S+ 0 0 19 -428,-0.4 4,-2.0 -431,-0.3 -1,-0.2 0.961 109.8 36.7 -60.2 -49.4 -46.1 57.7 -16.0 708 712 A D H > S+ 0 0 15 -3,-0.2 4,-1.9 2,-0.2 -2,-0.2 0.876 117.5 51.6 -72.4 -38.0 -45.3 60.0 -18.9 709 713 A A H X S+ 0 0 16 -4,-1.8 4,-2.6 1,-0.2 -2,-0.2 0.937 113.7 43.7 -63.5 -47.5 -48.2 62.3 -18.4 710 714 A L H X S+ 0 0 30 -4,-2.8 4,-3.1 2,-0.2 5,-0.2 0.870 109.2 56.5 -68.6 -35.8 -47.4 62.8 -14.7 711 715 A A H X S+ 0 0 24 -4,-2.0 4,-2.1 -5,-0.3 -1,-0.2 0.923 111.6 44.7 -60.7 -42.9 -43.6 63.2 -15.3 712 716 A A H X S+ 0 0 0 -4,-1.9 4,-2.3 2,-0.2 -2,-0.2 0.946 114.9 46.9 -63.2 -49.9 -44.5 66.1 -17.7 713 717 A L H X S+ 0 0 0 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.917 112.1 50.6 -60.3 -44.5 -47.0 67.7 -15.3 714 718 A S H X S+ 0 0 24 -4,-3.1 4,-2.7 1,-0.2 -1,-0.2 0.899 110.4 49.6 -58.3 -43.9 -44.6 67.4 -12.4 715 719 A A H X S+ 0 0 1 -4,-2.1 4,-2.5 -5,-0.2 6,-0.2 0.871 107.9 54.2 -63.8 -38.9 -41.8 69.1 -14.5 716 720 A A H <>S+ 0 0 0 -4,-2.3 5,-2.1 2,-0.2 4,-0.3 0.908 113.4 42.3 -61.3 -43.6 -44.2 71.9 -15.4 717 721 A V H ><5S+ 0 0 6 -4,-2.1 3,-0.9 3,-0.2 -2,-0.2 0.940 115.0 49.9 -66.7 -46.9 -44.9 72.6 -11.7 718 722 A A H 3<5S+ 0 0 14 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.875 119.2 35.8 -63.4 -40.8 -41.3 72.2 -10.6 719 723 A A T 3<5S- 0 0 9 -4,-2.5 -1,-0.3 -5,-0.2 -2,-0.2 0.365 104.8-127.3 -95.7 4.2 -39.9 74.5 -13.2 720 724 A Q T < 5 - 0 0 87 -3,-0.9 -3,-0.2 -4,-0.3 -4,-0.1 0.906 42.0-172.9 50.1 49.1 -42.9 76.9 -13.0 721 725 A L > < - 0 0 9 -5,-2.1 3,-2.0 -6,-0.2 4,-0.3 -0.298 36.4-109.8 -74.3 155.0 -43.3 76.7 -16.8 722 726 A P T 3 S+ 0 0 92 0, 0.0 3,-0.5 0, 0.0 4,-0.4 0.876 117.6 54.2 -48.7 -43.3 -45.8 78.8 -18.8 723 727 A C T 3> S+ 0 0 13 1,-0.2 4,-2.6 2,-0.1 5,-0.3 0.531 82.1 99.1 -70.0 -8.4 -48.0 75.7 -19.6 724 728 A R H <> S+ 0 0 53 -3,-2.0 4,-2.6 -8,-0.2 5,-0.2 0.896 81.0 43.1 -51.3 -56.7 -48.3 74.8 -15.9 725 729 A D H > S+ 0 0 104 -3,-0.5 4,-2.1 -4,-0.3 -1,-0.2 0.882 115.0 50.2 -61.5 -39.4 -51.7 76.3 -15.0 726 730 A A H > S+ 0 0 53 -4,-0.4 4,-2.4 2,-0.2 -1,-0.2 0.944 113.6 44.9 -63.2 -49.1 -53.3 75.0 -18.2 727 731 A L H X S+ 0 0 2 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.888 112.8 50.8 -62.8 -40.0 -52.0 71.4 -17.7 728 732 A M H X S+ 0 0 10 -4,-2.6 4,-2.2 -5,-0.3 -1,-0.2 0.890 112.0 47.4 -66.0 -40.2 -53.0 71.4 -14.0 729 733 A Q H X S+ 0 0 98 -4,-2.1 4,-2.9 -5,-0.2 -2,-0.2 0.904 109.8 53.7 -66.4 -41.6 -56.5 72.6 -14.9 730 734 A E H X S+ 0 0 79 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.906 110.0 47.4 -57.4 -44.5 -56.7 69.9 -17.7 731 735 A Y H X S+ 0 0 4 -4,-2.2 4,-3.0 2,-0.2 5,-0.2 0.935 111.8 49.8 -64.0 -48.5 -55.8 67.2 -15.2 732 736 A D H X S+ 0 0 12 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.959 112.2 48.1 -52.7 -55.0 -58.4 68.4 -12.6 733 737 A D H < S+ 0 0 86 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.871 118.2 40.8 -56.9 -39.0 -61.2 68.6 -15.3 734 738 A K H < S+ 0 0 134 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.883 129.4 24.2 -74.5 -40.2 -60.3 65.1 -16.5 735 739 A W H >< S+ 0 0 18 -4,-3.0 3,-2.9 -5,-0.2 7,-0.3 0.422 78.0 111.4-115.9 0.4 -59.7 63.3 -13.2 736 740 A H T 3< S+ 0 0 62 -4,-2.3 -1,-0.1 1,-0.3 -3,-0.1 0.734 79.3 59.1 -53.3 -27.7 -61.5 65.1 -10.3 737 741 A Q T 3 S+ 0 0 120 -3,-0.2 2,-0.7 -5,-0.2 -1,-0.3 0.578 94.5 75.6 -73.5 -13.4 -64.0 62.2 -9.9 738 742 A N <> - 0 0 22 -3,-2.9 4,-2.7 1,-0.2 3,-0.4 -0.847 61.3-170.2-110.8 100.3 -61.0 59.8 -9.2 739 743 A G H > S+ 0 0 19 -2,-0.7 4,-1.9 1,-0.2 -1,-0.2 0.865 85.9 51.2 -59.2 -42.7 -59.5 60.3 -5.7 740 744 A L H > S+ 0 0 25 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.868 113.5 44.7 -64.1 -37.9 -56.4 58.1 -6.3 741 745 A V H >> S+ 0 0 1 -3,-0.4 3,-0.8 -6,-0.2 4,-0.8 0.895 111.7 53.5 -71.9 -39.0 -55.5 59.9 -9.5 742 746 A M H 3X S+ 0 0 0 -4,-2.7 4,-2.8 -7,-0.3 5,-0.2 0.782 94.0 70.9 -67.2 -27.0 -56.2 63.3 -7.8 743 747 A D H 3X S+ 0 0 9 -4,-1.9 4,-2.3 1,-0.2 -1,-0.2 0.895 95.6 54.0 -53.5 -39.4 -53.8 62.4 -5.0 744 748 A K H < S+ 0 0 34 -4,-2.5 3,-1.1 1,-0.2 -2,-0.2 0.941 113.7 47.4 -60.7 -47.9 -49.8 71.3 -5.6 750 754 A A H 3< S+ 0 0 0 -4,-3.0 -1,-0.2 30,-0.3 -2,-0.2 0.757 115.7 43.1 -65.8 -30.1 -48.4 70.7 -2.0 751 755 A T T 3< S+ 0 0 45 -4,-1.8 -1,-0.2 -5,-0.2 -2,-0.2 0.188 84.3 133.8-102.9 13.4 -44.8 70.4 -3.2 752 756 A S < - 0 0 7 -3,-1.1 5,-0.1 -4,-0.2 -34,-0.1 -0.361 54.9-143.3 -67.9 140.5 -44.9 73.3 -5.6 753 757 A P + 0 0 55 0, 0.0 -1,-0.1 0, 0.0 -35,-0.1 0.469 59.7 129.3 -78.3 -1.5 -42.0 75.8 -5.5 754 758 A A > - 0 0 7 1,-0.1 3,-1.6 -37,-0.1 4,-0.2 -0.217 68.4-125.9 -56.8 142.6 -44.5 78.7 -6.2 755 759 A A T 3 S+ 0 0 112 1,-0.3 3,-0.3 2,-0.1 -1,-0.1 0.814 110.6 49.2 -57.0 -32.8 -44.3 81.7 -3.8 756 760 A N T 3> S+ 0 0 76 1,-0.2 4,-2.1 2,-0.1 -1,-0.3 0.080 72.5 123.7 -97.3 23.4 -48.0 81.3 -3.1 757 761 A V H <> S+ 0 0 8 -3,-1.6 4,-2.8 1,-0.2 -1,-0.2 0.882 72.4 49.9 -54.8 -44.7 -48.0 77.5 -2.4 758 762 A L H > S+ 0 0 26 -3,-0.3 4,-3.1 1,-0.2 5,-0.2 0.920 109.7 51.6 -63.0 -44.3 -49.5 77.8 1.1 759 763 A E H > S+ 0 0 136 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.926 112.4 46.7 -52.0 -47.7 -52.3 80.0 -0.1 760 764 A T H X S+ 0 0 41 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.931 112.1 50.1 -63.4 -46.5 -53.1 77.4 -2.8 761 765 A V H X S+ 0 0 0 -4,-2.8 4,-0.6 1,-0.2 -2,-0.2 0.924 110.6 49.2 -59.0 -49.1 -52.9 74.5 -0.4 762 766 A R H >< S+ 0 0 83 -4,-3.1 3,-1.3 1,-0.2 4,-0.2 0.916 110.3 51.5 -55.7 -44.8 -55.3 76.2 2.1 763 767 A G H >< S+ 0 0 46 -4,-2.2 3,-1.9 1,-0.2 -1,-0.2 0.867 100.6 63.6 -60.3 -36.0 -57.7 76.9 -0.8 764 768 A L H >< S+ 0 0 16 -4,-1.9 3,-1.5 1,-0.3 -1,-0.2 0.601 79.8 80.5 -68.9 -11.9 -57.6 73.2 -1.8 765 769 A L T << S+ 0 0 34 -3,-1.3 -1,-0.3 -4,-0.6 -2,-0.2 0.734 98.1 46.0 -60.3 -20.9 -59.1 72.2 1.5 766 770 A Q T < S+ 0 0 163 -3,-1.9 -1,-0.3 -4,-0.2 -2,-0.2 0.306 86.9 130.1 -99.9 3.8 -62.3 73.3 -0.3 767 771 A H X - 0 0 28 -3,-1.5 3,-1.8 1,-0.1 -3,-0.0 -0.325 68.1-122.3 -66.6 142.7 -61.5 71.4 -3.5 768 772 A R T 3 S+ 0 0 136 1,-0.3 -1,-0.1 3,-0.0 -3,-0.0 0.741 113.3 46.0 -51.3 -29.1 -64.2 69.1 -5.0 769 773 A S T 3 S+ 0 0 14 -5,-0.1 2,-0.3 -27,-0.1 -1,-0.3 0.450 98.9 87.0 -97.7 -4.2 -61.8 66.1 -4.8 770 774 A F < + 0 0 16 -3,-1.8 2,-0.3 -6,-0.2 3,-0.0 -0.769 46.1 167.0 -98.1 143.7 -60.5 66.8 -1.2 771 775 A T > - 0 0 57 -2,-0.3 3,-1.4 3,-0.2 7,-0.3 -0.949 36.6-143.9-152.4 138.5 -62.0 65.6 2.1 772 776 A M T 3 S+ 0 0 28 -2,-0.3 -1,-0.1 1,-0.3 6,-0.0 0.594 100.0 71.0 -68.3 -12.2 -60.8 65.6 5.7 773 777 A S T 3 S+ 0 0 52 1,-0.1 -1,-0.3 2,-0.0 -3,-0.0 0.533 88.3 71.3 -81.2 -6.6 -62.6 62.3 6.0 774 778 A N <> - 0 0 3 -3,-1.4 4,-2.3 1,-0.1 3,-0.3 -0.934 65.2-156.2-120.5 113.9 -60.2 60.4 3.8 775 779 A P H > S+ 0 0 0 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.832 95.6 56.1 -53.5 -37.1 -56.6 59.6 5.0 776 780 A N H > S+ 0 0 4 -524,-0.4 4,-2.1 2,-0.2 5,-0.2 0.935 110.1 44.5 -63.8 -44.4 -55.3 59.3 1.4 777 781 A R H > S+ 0 0 22 -3,-0.3 4,-1.9 2,-0.2 5,-0.4 0.924 113.4 51.4 -63.3 -43.6 -56.5 62.9 0.6 778 782 A I H X>S+ 0 0 1 -4,-2.3 5,-2.1 -7,-0.3 4,-1.4 0.919 113.2 44.5 -59.3 -45.9 -55.1 64.2 3.9 779 783 A R H <>S+ 0 0 59 -4,-2.7 5,-1.2 3,-0.2 -1,-0.2 0.860 112.6 52.0 -69.4 -34.3 -51.7 62.7 3.3 780 784 A S H <5S+ 0 0 13 -4,-2.1 -30,-0.3 -5,-0.2 -1,-0.2 0.781 125.2 22.4 -75.0 -29.4 -51.6 63.8 -0.4 781 785 A L H X5S+ 0 0 0 -4,-1.9 4,-1.3 -5,-0.2 -3,-0.2 0.868 136.7 23.6-100.6 -61.6 -52.4 67.5 0.4 782 786 A I H X5S+ 0 0 0 -4,-1.4 4,-2.3 -5,-0.4 5,-0.3 0.941 125.5 47.1 -76.7 -49.5 -51.5 68.3 4.0 783 787 A G H >X + 0 0 15 -4,-1.3 4,-3.2 -5,-0.3 3,-0.8 -0.457 59.2 156.4-122.7 58.7 -42.2 70.8 1.0 790 794 A P H 3> S+ 0 0 14 0, 0.0 4,-2.8 0, 0.0 -159,-0.1 0.847 70.5 61.8 -56.5 -31.9 -39.8 71.7 3.9 791 795 A A H 34 S+ 0 0 25 -161,-0.3 -160,-0.1 1,-0.2 -2,-0.1 0.904 115.2 32.4 -58.2 -42.1 -38.9 75.1 2.2 792 796 A A H X4 S+ 0 0 17 -3,-0.8 3,-1.8 -7,-0.2 8,-0.3 0.869 117.5 54.4 -81.0 -40.7 -42.5 76.2 2.4 793 797 A F H 3< S+ 0 0 0 -4,-3.2 8,-0.3 -8,-0.4 7,-0.3 0.895 113.1 45.3 -58.6 -37.4 -43.4 74.4 5.6 794 798 A H T 3< S+ 0 0 2 -4,-2.8 -1,-0.3 -5,-0.3 -2,-0.2 -0.025 81.0 157.5 -98.4 27.1 -40.4 76.2 7.2 795 799 A A X - 0 0 25 -3,-1.8 3,-2.0 1,-0.1 5,-0.2 -0.234 52.6-119.1 -46.5 139.5 -41.3 79.6 5.7 796 800 A E T 3 S+ 0 0 105 1,-0.3 -1,-0.1 2,-0.1 -4,-0.0 0.763 109.6 63.6 -65.7 -23.3 -39.6 82.2 8.0 797 801 A D T 3 S- 0 0 115 1,-0.1 -1,-0.3 42,-0.0 -2,-0.1 0.488 108.5-121.3 -76.7 -3.0 -43.0 83.8 9.0 798 802 A G S <> S+ 0 0 4 -3,-2.0 4,-2.0 1,-0.1 3,-0.3 0.510 72.9 132.3 76.4 6.0 -44.0 80.5 10.7 799 803 A S H > + 0 0 30 1,-0.2 4,-2.0 2,-0.2 5,-0.1 0.795 66.9 56.9 -60.9 -32.1 -47.1 80.3 8.5 800 804 A G H > S+ 0 0 0 -8,-0.3 4,-2.2 -7,-0.3 -1,-0.2 0.914 107.7 47.1 -66.2 -41.8 -46.4 76.6 7.7 801 805 A Y H > S+ 0 0 3 -8,-0.3 4,-2.5 -3,-0.3 -2,-0.2 0.911 111.2 51.5 -65.5 -41.4 -46.4 75.6 11.4 802 806 A L H X S+ 0 0 96 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.890 109.1 51.2 -63.5 -40.4 -49.6 77.6 12.0 803 807 A F H X S+ 0 0 1 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.931 110.8 47.7 -60.6 -47.1 -51.3 75.8 9.1 804 808 A L H X S+ 0 0 1 -4,-2.2 4,-3.1 1,-0.2 5,-0.3 0.907 108.1 54.9 -64.8 -40.0 -50.3 72.4 10.4 805 809 A V H X S+ 0 0 4 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.935 108.2 50.2 -56.6 -46.0 -51.5 73.2 14.0 806 810 A E H X S+ 0 0 94 -4,-2.0 4,-1.3 1,-0.2 -1,-0.2 0.930 113.3 45.2 -55.8 -48.5 -54.9 74.1 12.5 807 811 A M H X S+ 0 0 18 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.909 113.6 49.1 -65.3 -41.9 -55.0 70.7 10.6 808 812 A L H X S+ 0 0 0 -4,-3.1 4,-2.5 1,-0.2 -1,-0.2 0.771 101.7 63.0 -70.7 -26.8 -53.8 68.7 13.6 809 813 A T H X S+ 0 0 54 -4,-2.0 4,-0.6 -5,-0.3 -1,-0.2 0.904 111.6 39.0 -62.2 -40.5 -56.4 70.4 15.9 810 814 A D H >X S+ 0 0 54 -4,-1.3 4,-2.1 -3,-0.2 3,-1.3 0.970 118.2 47.3 -67.6 -55.1 -59.0 68.8 13.7 811 815 A L H 3X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.3 8,-0.4 0.773 98.1 68.4 -67.7 -27.1 -57.2 65.5 13.2 812 816 A N H 3< S+ 0 0 5 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.1 0.874 114.1 31.6 -54.8 -37.2 -56.4 65.0 16.9 813 817 A S H << S+ 0 0 86 -3,-1.3 -2,-0.2 -4,-0.6 -1,-0.2 0.849 126.2 42.0 -86.9 -40.2 -60.1 64.5 17.4 814 818 A R H < S- 0 0 78 -4,-2.1 -3,-0.2 1,-0.2 -2,-0.2 0.925 135.2 -5.7 -75.8 -48.1 -61.1 62.9 14.0 815 819 A N X - 0 0 6 -4,-2.4 4,-2.4 -5,-0.2 3,-0.5 -0.650 57.8-175.2-158.5 80.7 -58.2 60.4 13.4 816 820 A P H > S+ 0 0 26 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.791 84.4 59.6 -56.9 -33.9 -55.3 60.5 15.8 817 821 A Q H > S+ 0 0 19 2,-0.2 4,-1.6 -716,-0.2 5,-0.1 0.932 110.7 40.4 -61.7 -45.0 -53.3 57.9 13.8 818 822 A V H > S+ 0 0 0 -3,-0.5 4,-2.2 2,-0.2 -1,-0.2 0.888 113.5 56.0 -69.9 -37.6 -53.2 60.2 10.8 819 823 A A H X S+ 0 0 0 -4,-2.4 4,-1.4 -8,-0.4 -2,-0.2 0.919 107.4 49.5 -55.9 -45.2 -52.7 63.2 13.1 820 824 A S H < S+ 0 0 2 -4,-2.6 4,-0.5 1,-0.2 -1,-0.2 0.831 108.3 52.3 -71.0 -32.9 -49.6 61.5 14.5 821 825 A R H >< S+ 0 0 104 -4,-1.6 3,-0.8 1,-0.2 -1,-0.2 0.929 112.6 46.8 -60.0 -45.4 -48.2 60.7 11.0 822 826 A L H 3< S+ 0 0 9 -4,-2.2 -2,-0.2 1,-0.2 4,-0.2 0.665 101.5 63.0 -76.8 -19.1 -48.6 64.4 10.1 823 827 A I T >X S+ 0 0 0 -4,-1.4 3,-1.7 1,-0.2 4,-1.1 0.651 77.2 94.0 -77.7 -13.9 -47.0 65.9 13.3 824 828 A E H X> S+ 0 0 27 -3,-0.8 3,-0.8 -4,-0.5 4,-0.5 0.864 77.2 56.1 -51.4 -45.6 -43.7 64.3 12.5 825 829 A P H >4 S+ 0 0 24 0, 0.0 3,-0.5 0, 0.0 -1,-0.3 0.808 106.3 53.3 -57.9 -26.4 -42.2 67.3 10.6 826 830 A L H X4 S+ 0 0 0 -3,-1.7 3,-1.0 -4,-0.2 -2,-0.2 0.774 98.6 60.8 -79.1 -28.3 -42.8 69.5 13.7 827 831 A I H << S+ 0 0 0 -4,-1.1 3,-0.4 -3,-0.8 -1,-0.2 0.559 88.7 74.9 -80.1 -2.0 -41.0 67.2 16.1 828 832 A R T X< + 0 0 48 -4,-0.5 3,-2.4 -3,-0.5 -1,-0.3 0.231 59.8 122.4 -85.8 14.9 -37.8 67.7 14.1 829 833 A L G X + 0 0 0 -3,-1.0 3,-2.0 1,-0.3 -1,-0.2 0.756 59.8 65.1 -54.8 -34.1 -37.4 71.2 15.6 830 834 A K G 3 S+ 0 0 103 -3,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.627 92.9 64.2 -68.1 -11.2 -33.9 70.7 17.1 831 835 A R G < S+ 0 0 31 -3,-2.4 -203,-3.2 -204,-0.1 -1,-0.3 0.465 97.3 74.7 -82.8 -4.9 -32.5 70.3 13.6 832 836 A Y S < S- 0 0 18 -3,-2.0 -203,-0.1 -205,-0.2 5,-0.0 -0.604 91.5 -82.0-112.5 169.1 -33.4 73.9 12.7 833 837 A D > - 0 0 50 -205,-0.4 4,-3.0 -2,-0.2 3,-0.3 -0.166 48.8-100.3 -65.5 161.8 -32.1 77.4 13.5 834 838 A A H > S+ 0 0 77 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.850 120.4 51.2 -52.1 -44.2 -33.0 79.1 16.8 835 839 A K H > S+ 0 0 117 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.903 113.8 44.0 -65.5 -43.0 -35.8 81.3 15.3 836 840 A R H > S+ 0 0 8 -3,-0.3 4,-2.6 2,-0.2 5,-0.2 0.926 110.5 56.4 -66.6 -44.2 -37.5 78.4 13.7 837 841 A Q H X S+ 0 0 37 -4,-3.0 4,-2.7 1,-0.2 -2,-0.2 0.881 105.7 51.0 -52.1 -45.5 -37.1 76.2 16.8 838 842 A E H X S+ 0 0 112 -4,-2.2 4,-2.1 -5,-0.2 -1,-0.2 0.913 111.7 45.8 -66.4 -37.7 -38.9 78.8 18.9 839 843 A K H X S+ 0 0 79 -4,-1.5 4,-2.0 2,-0.2 -2,-0.2 0.879 115.2 47.9 -66.2 -39.0 -41.9 79.0 16.5 840 844 A M H X S+ 0 0 0 -4,-2.6 4,-2.4 2,-0.2 -2,-0.2 0.890 110.5 51.5 -70.1 -38.7 -42.0 75.2 16.2 841 845 A R H X S+ 0 0 54 -4,-2.7 4,-2.6 -5,-0.2 -2,-0.2 0.920 109.0 51.1 -60.3 -45.1 -41.9 74.9 20.0 842 846 A A H X S+ 0 0 61 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.887 109.9 50.3 -59.3 -41.7 -44.8 77.4 20.3 843 847 A A H X S+ 0 0 4 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.925 111.4 47.3 -61.8 -47.2 -46.8 75.3 17.8 844 848 A L H X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.881 109.7 53.5 -63.9 -39.2 -46.1 72.1 19.8 845 849 A E H X S+ 0 0 97 -4,-2.6 4,-1.1 2,-0.2 -1,-0.2 0.873 106.9 52.6 -64.2 -37.7 -47.1 73.9 23.1 846 850 A Q H < S+ 0 0 115 -4,-1.9 3,-0.4 1,-0.2 -2,-0.2 0.937 112.4 44.8 -60.0 -46.8 -50.4 74.9 21.5 847 851 A L H >< S+ 0 0 0 -4,-2.0 3,-1.9 1,-0.2 -2,-0.2 0.890 106.4 59.5 -65.5 -39.5 -51.1 71.3 20.5 848 852 A K H 3< S+ 0 0 96 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.800 103.7 54.0 -58.2 -29.8 -50.0 70.0 24.0 849 853 A G T 3< S+ 0 0 65 -4,-1.1 -1,-0.3 -3,-0.4 -2,-0.2 0.429 80.6 128.5 -86.4 2.0 -52.8 72.2 25.5 850 854 A L X - 0 0 39 -3,-1.9 3,-0.8 -4,-0.1 2,-0.2 -0.280 66.9-113.4 -61.8 138.2 -55.6 70.8 23.3 851 855 A E T 3 S+ 0 0 166 1,-0.2 -1,-0.1 2,-0.0 -2,-0.1 -0.540 103.4 14.1 -61.3 137.0 -58.7 69.6 25.1 852 856 A N T 3 S- 0 0 127 -2,-0.2 2,-0.3 1,-0.2 -1,-0.2 0.916 86.4-166.3 58.9 48.4 -58.8 65.8 24.6 853 857 A L < - 0 0 42 -3,-0.8 -1,-0.2 -5,-0.1 -5,-0.0 -0.509 20.5-120.9 -65.2 126.0 -55.2 65.4 23.4 854 858 A S > - 0 0 16 -2,-0.3 4,-2.7 1,-0.1 5,-0.1 -0.342 10.2-124.2 -66.7 150.0 -54.8 61.9 21.9 855 859 A G H > S+ 0 0 21 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.877 111.8 62.6 -55.2 -38.1 -52.2 59.5 23.4 856 860 A D H > S+ 0 0 15 1,-0.2 4,-1.1 2,-0.2 -1,-0.2 0.934 112.2 33.4 -56.3 -51.0 -50.8 59.3 19.8 857 861 A L H > S+ 0 0 0 1,-0.2 4,-3.1 2,-0.2 5,-0.3 0.871 112.5 62.1 -75.8 -36.9 -49.9 63.1 19.8 858 862 A Y H X S+ 0 0 79 -4,-2.7 4,-2.6 1,-0.2 5,-0.3 0.913 102.5 51.2 -53.0 -48.7 -49.1 63.3 23.5 859 863 A E H X S+ 0 0 0 -4,-2.4 4,-1.6 1,-0.2 -1,-0.2 0.920 115.4 40.7 -57.3 -47.7 -46.2 60.8 23.1 860 864 A K H X S+ 0 0 14 -4,-1.1 4,-2.4 -5,-0.2 -2,-0.2 0.913 115.2 50.5 -70.7 -41.6 -44.6 62.7 20.2 861 865 A I H X S+ 0 0 0 -4,-3.1 4,-2.3 2,-0.2 -2,-0.2 0.922 109.6 49.6 -64.6 -46.2 -45.2 66.2 21.7 862 866 A T H X S+ 0 0 40 -4,-2.6 4,-0.8 -5,-0.3 -1,-0.2 0.904 113.2 46.6 -62.4 -40.3 -43.7 65.4 25.1 863 867 A K H >< S+ 0 0 57 -4,-1.6 3,-0.5 -5,-0.3 -1,-0.2 0.899 113.4 50.3 -64.4 -41.6 -40.6 63.8 23.5 864 868 A A H 3< S+ 0 0 0 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.843 113.5 44.1 -64.8 -37.1 -40.3 66.8 21.2 865 869 A L H 3< 0 0 31 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.521 360.0 360.0 -87.5 -8.0 -40.6 69.4 24.0 866 870 A A << 0 0 120 -4,-0.8 -3,-0.0 -3,-0.5 -4,-0.0 -0.251 360.0 360.0 -68.5 360.0 -38.2 67.6 26.4 867 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 868 900 A W 0 0 9 0, 0.0 -609,-0.2 0, 0.0 -750,-0.0 0.000 360.0 360.0 360.0 360.0 -49.6 45.9 8.4