==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 03-OCT-11 3VIO . COMPND 2 MOLECULE: BETA-GLUCOSIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: NEOTERMES KOSHUNENSIS; . AUTHOR W.Y.JENG,C.I.LIU,A.H.J.WANG . 472 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17419.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 338 71.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 51 10.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 16 3.4 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 29 6.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 51 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 156 33.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 2.5 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 5 1 0 1 2 0 0 0 1 1 1 2 1 1 0 1 0 0 0 1 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 3 3 3 0 0 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 . 4 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 2 0 0 0 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 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 27 A T > 0 0 139 0, 0.0 3,-1.8 0, 0.0 405,-0.0 0.000 360.0 360.0 360.0 -45.4 -6.2 96.5 32.9 2 28 A V T 3 + 0 0 36 1,-0.3 404,-0.2 404,-0.1 403,-0.1 0.611 360.0 51.9 -67.7 -11.7 -6.7 95.1 29.4 3 29 A Y T 3 S+ 0 0 51 2,-0.1 463,-2.1 399,-0.1 2,-0.4 0.335 94.4 88.3-102.6 2.4 -7.9 91.9 31.1 4 30 A T B < S-A 465 0A 45 -3,-1.8 461,-0.2 461,-0.2 460,-0.1 -0.857 74.0-126.3-109.3 136.0 -10.5 93.5 33.3 5 31 A F - 0 0 3 459,-2.5 -2,-0.1 -2,-0.4 -3,-0.0 -0.561 35.9-102.4 -75.1 139.4 -14.2 94.3 32.4 6 32 A P > - 0 0 45 0, 0.0 3,-1.3 0, 0.0 -1,-0.1 -0.290 36.0-111.6 -55.8 148.9 -15.4 97.8 32.9 7 33 A D T 3 S+ 0 0 152 1,-0.3 -2,-0.1 -3,-0.1 457,-0.0 0.826 115.1 41.9 -55.1 -39.8 -17.5 98.2 36.0 8 34 A E T 3 S+ 0 0 181 2,-0.1 -1,-0.3 406,-0.0 2,-0.1 0.481 85.2 121.6 -89.0 -4.4 -20.8 98.8 34.3 9 35 A F < - 0 0 4 -3,-1.3 2,-0.5 1,-0.1 405,-0.2 -0.378 58.0-136.2 -63.7 134.0 -20.2 96.2 31.5 10 36 A K E -b 414 0B 59 403,-1.9 405,-2.5 -2,-0.1 2,-0.4 -0.841 19.3-170.1-101.8 125.4 -23.0 93.5 31.5 11 37 A L E +b 415 0B 2 -2,-0.5 63,-3.2 403,-0.2 64,-1.0 -0.897 27.3 111.0-111.8 140.1 -22.2 89.8 31.1 12 38 A G E -bc 416 75B 0 403,-2.2 405,-2.3 -2,-0.4 2,-0.3 -0.832 51.3 -87.0-170.0-150.0 -24.7 87.0 30.4 13 39 A A E -bc 417 76B 0 62,-1.3 64,-2.3 403,-0.3 2,-0.3 -0.926 28.0-141.2-145.4 165.3 -26.0 84.4 28.0 14 40 A A E +bc 418 77B 0 403,-2.4 406,-1.8 -2,-0.3 405,-0.7 -0.936 17.1 168.1-137.0 152.7 -28.6 84.2 25.3 15 41 A T - 0 0 0 62,-2.2 2,-0.3 -2,-0.3 408,-0.0 -0.848 23.4-130.9-144.9 179.2 -31.3 82.0 23.7 16 42 A A > - 0 0 0 -2,-0.3 4,-1.1 62,-0.2 5,-0.2 -0.987 24.0-117.6-139.5 149.1 -34.2 82.2 21.2 17 43 A S H >> S+ 0 0 0 -2,-0.3 4,-2.9 1,-0.3 3,-0.9 0.871 109.1 42.1 -58.0 -54.0 -37.8 81.1 21.6 18 44 A Y H 34 S+ 0 0 12 104,-0.3 4,-0.3 1,-0.2 -1,-0.3 0.853 112.5 57.4 -65.7 -30.7 -38.1 78.5 18.8 19 45 A Q H 34 S+ 0 0 1 -3,-0.2 405,-2.5 1,-0.1 -1,-0.2 0.780 126.2 11.8 -70.9 -22.6 -34.7 77.1 19.7 20 46 A I H << S+ 0 0 7 -4,-1.1 37,-2.6 -3,-0.9 35,-0.3 0.668 108.2 71.9-125.4 -28.7 -35.6 76.4 23.4 21 47 A E < + 0 0 7 -4,-2.9 37,-2.4 -5,-0.2 38,-0.4 0.850 54.3 179.1 -75.2 -40.2 -39.3 76.6 24.3 22 48 A G + 0 0 5 29,-0.4 31,-0.3 -5,-0.3 -1,-0.2 -0.408 45.4 108.2 64.3-146.9 -41.1 73.7 22.8 23 49 A A > + 0 0 8 29,-0.6 3,-1.2 1,-0.1 6,-0.2 0.891 46.5 172.0 46.3 45.5 -44.8 73.7 23.7 24 50 A W T 3 S+ 0 0 66 28,-1.1 -1,-0.1 1,-0.3 8,-0.1 0.708 74.6 18.0 -66.6 -23.6 -45.3 74.6 20.0 25 51 A D T 3 S+ 0 0 100 27,-0.2 3,-0.5 6,-0.1 -1,-0.3 0.089 96.8 129.2-130.7 22.6 -49.1 74.2 20.1 26 52 A E S X S- 0 0 64 -3,-1.2 3,-1.8 1,-0.2 4,-0.0 -0.559 72.2 -5.7 -87.4 142.7 -49.8 74.4 23.8 27 53 A N T 3 S- 0 0 87 1,-0.3 -1,-0.2 -2,-0.2 70,-0.2 0.835 132.5 -41.7 47.9 49.3 -52.3 76.7 25.5 28 54 A G T 3 S+ 0 0 47 -3,-0.5 -1,-0.3 1,-0.3 -2,-0.1 0.347 88.4 151.6 90.7 -5.8 -53.4 78.7 22.5 29 55 A K < - 0 0 15 -3,-1.8 -1,-0.3 -6,-0.2 55,-0.3 -0.387 37.2-138.0 -62.1 134.2 -50.0 79.3 20.7 30 56 A G - 0 0 7 53,-2.5 2,-0.2 1,-0.1 53,-0.1 -0.424 26.8 -86.6 -87.3 166.3 -50.5 79.6 17.0 31 57 A P - 0 0 66 0, 0.0 96,-2.6 0, 0.0 97,-0.5 -0.457 40.5-163.8 -76.7 143.9 -48.3 78.1 14.3 32 58 A N B > -J 126 0C 0 94,-0.3 4,-2.3 -2,-0.2 3,-0.2 -0.662 38.6 -94.0-116.7 176.6 -45.2 79.8 13.1 33 59 A I H > S+ 0 0 4 92,-2.3 4,-2.2 1,-0.2 91,-0.1 0.695 124.0 54.0 -66.3 -23.1 -43.0 79.3 10.0 34 60 A W H > S+ 0 0 2 2,-0.2 4,-2.6 91,-0.2 5,-0.3 0.827 105.6 52.3 -81.4 -35.5 -40.6 77.0 11.9 35 61 A D H > S+ 0 0 2 -3,-0.2 4,-2.1 2,-0.2 5,-0.3 0.955 113.7 46.6 -52.9 -49.0 -43.5 74.8 13.0 36 62 A T H X S+ 0 0 29 -4,-2.3 4,-2.8 2,-0.2 5,-0.5 0.946 113.5 46.4 -61.4 -49.2 -44.4 74.7 9.3 37 63 A L H X S+ 0 0 3 -4,-2.2 4,-2.6 1,-0.2 7,-0.2 0.947 116.1 43.1 -60.3 -49.9 -40.9 74.0 8.1 38 64 A T H < S+ 0 0 3 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.806 120.1 43.1 -73.4 -26.2 -40.1 71.2 10.5 39 65 A H H < S+ 0 0 72 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.879 126.0 29.3 -81.7 -40.4 -43.5 69.6 10.2 40 66 A E H < S+ 0 0 130 -4,-2.8 -3,-0.2 -5,-0.3 -2,-0.2 0.735 129.5 35.1 -92.3 -27.0 -43.8 69.8 6.4 41 67 A H >< + 0 0 61 -4,-2.6 3,-2.5 -5,-0.5 4,-0.3 -0.415 56.8 150.8-130.1 59.0 -40.2 69.6 5.3 42 68 A P G > S+ 0 0 59 0, 0.0 3,-1.6 0, 0.0 6,-0.5 0.768 71.5 72.6 -63.0 -20.0 -38.3 67.4 7.7 43 69 A D G 3 S+ 0 0 130 1,-0.3 4,-0.1 -3,-0.1 -5,-0.1 0.607 90.4 59.4 -65.0 -14.7 -36.0 66.7 4.7 44 70 A Y G < S+ 0 0 39 -3,-2.5 2,-0.4 -7,-0.2 -1,-0.3 0.573 100.3 66.7 -84.7 -11.8 -34.6 70.2 5.1 45 71 A V S X S- 0 0 9 -3,-1.6 3,-2.4 -4,-0.3 383,-0.2 -0.910 92.0-104.0-119.4 136.1 -33.4 69.5 8.7 46 72 A V G > S+ 0 0 38 381,-2.7 3,-1.8 -2,-0.4 384,-0.3 -0.326 108.3 0.4 -54.3 133.2 -30.7 67.2 10.0 47 73 A D G 3 S- 0 0 139 1,-0.3 -1,-0.3 382,-0.1 3,-0.1 0.537 115.8 -86.5 65.5 6.8 -32.3 64.1 11.5 48 74 A G G < S+ 0 0 32 -3,-2.4 -1,-0.3 -6,-0.5 -2,-0.2 0.846 76.9 177.3 60.4 29.8 -35.8 65.5 10.6 49 75 A A < - 0 0 13 -3,-1.8 2,-0.3 -7,-0.2 -1,-0.1 -0.258 13.5-164.7 -67.1 154.6 -35.6 67.3 14.0 50 76 A T - 0 0 38 -3,-0.1 4,-0.5 -11,-0.0 3,-0.4 -0.930 30.8-127.9-130.6 163.9 -38.3 69.7 15.2 51 77 A G S S+ 0 0 2 -2,-0.3 -29,-0.4 1,-0.2 -27,-0.1 0.109 71.9 119.5 -89.8 22.9 -38.6 72.3 17.9 52 78 A D S S- 0 0 49 1,-0.1 -28,-1.1 -30,-0.1 -29,-0.6 0.864 99.6 -2.5 -58.4 -38.8 -41.8 70.7 19.2 53 79 A I S > S+ 0 0 85 -3,-0.4 3,-2.7 -31,-0.3 4,-0.2 0.669 85.4 156.8-115.3 -49.8 -40.1 70.1 22.6 54 80 A A T 3 S- 0 0 1 -4,-0.5 -34,-0.2 1,-0.3 -33,-0.1 -0.285 84.5 -19.6 55.1-131.6 -36.6 71.4 22.2 55 81 A D T 3 S- 0 0 0 -35,-0.3 -1,-0.3 -36,-0.2 -34,-0.2 0.437 86.3-126.5 -82.8 -0.5 -35.3 72.3 25.7 56 82 A D X> + 0 0 28 -3,-2.7 4,-2.6 -36,-0.1 3,-1.2 0.805 53.7 156.6 58.5 33.1 -38.9 72.5 27.0 57 83 A S H 3> + 0 0 0 -37,-2.6 4,-0.8 1,-0.3 -36,-0.2 0.690 61.6 71.5 -66.1 -17.9 -38.2 76.0 28.3 58 84 A Y H 34 S+ 0 0 20 -37,-2.4 -1,-0.3 -38,-0.2 3,-0.2 0.925 116.6 22.9 -58.2 -41.5 -41.9 76.8 28.2 59 85 A H H <4 S+ 0 0 85 -3,-1.2 3,-0.3 -38,-0.4 -2,-0.2 0.812 129.2 47.3 -89.1 -30.6 -42.3 74.4 31.1 60 86 A L H >X + 0 0 37 -4,-2.6 4,-1.4 1,-0.2 3,-1.4 0.106 65.9 122.5-106.5 21.2 -38.7 74.5 32.5 61 87 A Y H 3X S+ 0 0 32 -4,-0.8 4,-2.2 1,-0.3 -1,-0.2 0.809 73.0 59.9 -55.5 -32.6 -38.1 78.3 32.6 62 88 A K H 3> S+ 0 0 111 -3,-0.3 4,-2.1 1,-0.2 -1,-0.3 0.863 103.1 52.3 -65.2 -31.2 -37.3 78.2 36.3 63 89 A E H <> S+ 0 0 85 -3,-1.4 4,-2.1 2,-0.2 -1,-0.2 0.860 106.4 53.7 -70.0 -35.1 -34.5 75.7 35.5 64 90 A D H X S+ 0 0 2 -4,-1.4 4,-2.3 2,-0.2 -2,-0.2 0.919 109.4 47.9 -62.7 -43.3 -33.1 78.2 33.0 65 91 A V H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.905 108.1 56.0 -64.4 -40.0 -33.1 80.9 35.7 66 92 A K H X S+ 0 0 113 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.911 110.2 43.8 -56.9 -46.1 -31.4 78.5 38.1 67 93 A I H X S+ 0 0 12 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.865 111.5 54.0 -72.7 -33.0 -28.5 77.9 35.7 68 94 A L H X>S+ 0 0 0 -4,-2.3 5,-2.2 2,-0.2 4,-1.4 0.904 109.9 48.2 -60.7 -40.5 -28.3 81.6 34.9 69 95 A K H <5S+ 0 0 116 -4,-2.6 -2,-0.2 2,-0.2 -1,-0.2 0.910 111.1 50.1 -65.7 -43.5 -28.0 82.3 38.6 70 96 A E H <5S+ 0 0 120 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.902 111.2 49.4 -58.2 -43.4 -25.3 79.5 38.9 71 97 A L H <5S- 0 0 2 -4,-2.5 -1,-0.2 -5,-0.1 -2,-0.2 0.802 110.6-125.9 -64.4 -30.1 -23.4 81.1 36.0 72 98 A G T <5 + 0 0 40 -4,-1.4 -3,-0.2 1,-0.2 -61,-0.1 0.705 42.2 177.9 83.1 25.5 -23.7 84.5 37.6 73 99 A A < - 0 0 6 -5,-2.2 -61,-0.2 -6,-0.2 -1,-0.2 -0.360 24.1-165.1 -59.6 135.4 -25.3 86.1 34.5 74 100 A Q S S+ 0 0 76 -63,-3.2 41,-2.7 1,-0.2 2,-0.3 0.687 78.4 27.9 -87.1 -24.3 -26.2 89.8 35.0 75 101 A V E -cd 12 115B 0 -64,-1.0 -62,-1.3 39,-0.2 2,-0.5 -0.991 62.8-158.1-141.0 141.6 -28.4 89.7 31.8 76 102 A Y E -cd 13 116B 0 39,-2.5 41,-2.5 -2,-0.3 2,-0.6 -0.986 10.8-157.8-122.1 115.2 -30.4 87.0 30.0 77 103 A R E +cd 14 117B 0 -64,-2.3 -62,-2.2 -2,-0.5 2,-0.3 -0.859 27.7 154.2 -91.7 120.7 -31.1 87.7 26.4 78 104 A F E - d 0 118B 3 39,-2.3 41,-2.8 -2,-0.6 2,-0.3 -0.908 33.4-124.0-137.1 166.8 -34.2 85.7 25.2 79 105 A S E - d 0 119B 2 -2,-0.3 2,-0.4 39,-0.2 41,-0.2 -0.805 14.4-127.1-113.2 160.0 -36.8 86.1 22.5 80 106 A I - 0 0 0 39,-2.1 2,-0.8 -2,-0.3 42,-0.4 -0.856 22.9-125.4-103.0 133.9 -40.6 86.3 22.6 81 107 A S >> - 0 0 2 -2,-0.4 4,-1.3 1,-0.2 3,-1.2 -0.724 14.9-154.1 -79.2 111.1 -42.5 84.0 20.3 82 108 A W H >> S+ 0 0 1 -2,-0.8 4,-3.4 1,-0.3 3,-0.7 0.896 94.0 49.1 -52.1 -48.6 -44.8 86.2 18.3 83 109 A A H 34 S+ 0 0 0 41,-0.5 -53,-2.5 1,-0.3 -1,-0.3 0.665 104.4 59.4 -74.2 -14.6 -47.4 83.4 17.7 84 110 A R H <4 S+ 0 0 1 -3,-1.2 14,-0.5 -55,-0.3 -1,-0.3 0.794 117.9 31.4 -73.6 -31.5 -47.4 82.5 21.4 85 111 A V H << S+ 0 0 0 -4,-1.3 10,-3.0 -3,-0.7 -2,-0.2 0.861 136.7 23.4 -90.2 -47.0 -48.6 86.1 22.2 86 112 A L S >< S- 0 0 1 -4,-3.4 3,-2.3 8,-0.2 -1,-0.3 -0.851 71.0-173.3-121.2 88.8 -50.6 86.9 19.1 87 113 A P T 3 S+ 0 0 18 0, 0.0 41,-0.3 0, 0.0 -1,-0.1 0.768 86.5 44.5 -62.7 -23.9 -51.7 83.5 17.7 88 114 A E T 3 S- 0 0 99 2,-0.4 2,-1.6 5,-0.4 3,-0.1 0.306 107.5-124.7 -97.1 2.3 -53.2 85.0 14.6 89 115 A G S < S+ 0 0 1 -3,-2.3 -1,-0.1 1,-0.2 58,-0.0 -0.304 87.5 88.0 85.6 -55.4 -50.2 87.3 14.0 90 116 A H S > S- 0 0 66 -2,-1.6 3,-0.6 1,-0.1 -2,-0.4 -0.305 91.9-112.4 -67.0 162.1 -52.5 90.4 14.0 91 117 A D T 3 S+ 0 0 69 1,-0.2 -1,-0.1 -3,-0.1 3,-0.1 0.257 90.2 100.3 -89.7 17.4 -53.3 92.0 17.3 92 118 A N T 3 S+ 0 0 110 1,-0.2 2,-0.5 -6,-0.1 -1,-0.2 0.832 86.4 40.1 -69.6 -32.3 -57.0 91.1 17.5 93 119 A I < - 0 0 87 -3,-0.6 2,-0.5 2,-0.0 -5,-0.4 -0.979 66.6-167.2-123.1 122.3 -56.3 88.2 19.8 94 120 A V - 0 0 64 -2,-0.5 2,-0.9 -8,-0.2 -8,-0.2 -0.939 21.1-136.3-106.3 124.8 -53.9 88.3 22.7 95 121 A N >> - 0 0 25 -10,-3.0 4,-1.9 -2,-0.5 3,-0.8 -0.718 10.4-161.0 -84.5 106.0 -53.1 84.9 24.2 96 122 A Q H 3> S+ 0 0 116 -2,-0.9 4,-3.0 1,-0.3 5,-0.2 0.817 89.5 62.2 -57.1 -33.9 -53.1 85.4 28.0 97 123 A D H 3> S+ 0 0 40 -70,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.905 105.6 46.4 -58.8 -42.0 -51.2 82.2 28.4 98 124 A G H <> S+ 0 0 0 -3,-0.8 4,-2.3 -14,-0.5 5,-0.3 0.915 111.5 50.6 -66.2 -42.7 -48.3 83.7 26.4 99 125 A I H X S+ 0 0 2 -4,-1.9 4,-2.5 1,-0.2 5,-0.2 0.942 112.5 47.7 -56.6 -49.1 -48.5 87.0 28.4 100 126 A D H X S+ 0 0 71 -4,-3.0 4,-2.6 2,-0.2 -2,-0.2 0.885 109.3 54.0 -61.2 -41.1 -48.4 84.9 31.7 101 127 A Y H X S+ 0 0 10 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.956 112.2 41.3 -60.9 -52.3 -45.5 82.8 30.5 102 128 A Y H X S+ 0 0 0 -4,-2.3 4,-2.9 1,-0.2 5,-0.2 0.891 114.5 52.6 -68.5 -34.8 -43.2 85.8 29.6 103 129 A N H X S+ 0 0 30 -4,-2.5 4,-2.9 -5,-0.3 5,-0.3 0.919 108.9 51.5 -60.7 -43.1 -44.3 87.6 32.8 104 130 A N H X S+ 0 0 74 -4,-2.6 4,-2.2 -5,-0.2 -2,-0.2 0.925 112.9 44.5 -59.2 -43.4 -43.4 84.5 34.8 105 131 A L H X S+ 0 0 5 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.948 114.4 48.3 -67.8 -47.4 -39.9 84.3 33.2 106 132 A I H X S+ 0 0 0 -4,-2.9 4,-2.6 1,-0.2 -2,-0.2 0.923 114.0 46.8 -57.4 -45.8 -39.3 88.1 33.6 107 133 A N H X S+ 0 0 73 -4,-2.9 4,-2.2 -5,-0.2 -1,-0.2 0.887 111.2 51.2 -67.6 -37.9 -40.4 88.0 37.2 108 134 A E H X S+ 0 0 53 -4,-2.2 4,-0.8 -5,-0.3 -1,-0.2 0.906 110.8 49.4 -63.8 -43.5 -38.3 84.9 38.0 109 135 A L H ><>S+ 0 0 0 -4,-2.5 5,-2.5 1,-0.2 3,-1.2 0.969 112.6 46.5 -58.0 -52.4 -35.2 86.6 36.4 110 136 A L H ><5S+ 0 0 74 -4,-2.6 3,-1.6 1,-0.3 -2,-0.2 0.868 107.7 56.3 -61.6 -36.9 -35.7 89.8 38.4 111 137 A A H 3<5S+ 0 0 80 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.711 110.7 46.4 -66.0 -21.6 -36.3 87.8 41.7 112 138 A N T <<5S- 0 0 38 -3,-1.2 -1,-0.3 -4,-0.8 -2,-0.2 0.197 122.2-106.8-106.4 13.5 -32.9 86.2 41.1 113 139 A G T < 5S+ 0 0 64 -3,-1.6 2,-0.4 1,-0.2 -3,-0.2 0.727 76.0 133.1 70.0 28.1 -31.2 89.5 40.2 114 140 A I < - 0 0 4 -5,-2.5 -39,-0.2 -6,-0.1 -1,-0.2 -0.930 51.7-132.9-113.5 130.1 -30.9 88.9 36.5 115 141 A E E -d 75 0B 46 -41,-2.7 -39,-2.5 -2,-0.4 2,-0.3 -0.671 18.8-130.0 -83.2 130.6 -31.9 91.6 34.0 116 142 A P E -d 76 0B 0 0, 0.0 44,-0.5 0, 0.0 45,-0.5 -0.585 19.0-171.0 -78.4 137.5 -34.1 90.6 31.0 117 143 A M E -d 77 0B 0 -41,-2.5 -39,-2.3 -2,-0.3 2,-0.5 -0.993 17.0-154.2-125.2 119.5 -33.0 91.6 27.5 118 144 A V E -de 78 162B 0 43,-2.5 45,-2.7 -2,-0.4 2,-0.6 -0.874 15.6-160.6-112.1 122.5 -35.8 90.8 25.0 119 145 A T E -de 79 163B 0 -41,-2.8 -39,-2.1 -2,-0.5 3,-0.2 -0.850 7.5-161.9 -88.1 121.6 -35.6 90.2 21.4 120 146 A M E S+ 0 0 2 43,-3.1 2,-0.5 -2,-0.6 -38,-0.2 0.906 78.0 27.8 -70.2 -43.1 -39.0 90.7 19.8 121 147 A Y E + e 0 165B 3 43,-1.2 45,-2.5 42,-0.3 -1,-0.3 -0.913 54.6 161.2-130.1 108.6 -38.3 88.8 16.6 122 148 A H S S- 0 0 3 -2,-0.5 -104,-0.3 -42,-0.4 -43,-0.1 -0.432 77.4 -71.1-123.7 54.6 -35.9 85.9 16.4 123 149 A W S S+ 0 0 18 43,-0.1 2,-0.9 1,-0.1 -90,-0.1 0.288 98.7 115.4 95.1 -2.8 -37.1 84.2 13.2 124 150 A D + 0 0 1 -91,-0.1 -41,-0.5 -92,-0.1 -42,-0.2 -0.467 41.2 179.2-104.1 62.8 -40.4 82.7 14.2 125 151 A L - 0 0 0 -2,-0.9 -92,-2.3 1,-0.1 -91,-0.2 -0.328 38.1-103.5 -62.3 134.6 -43.0 84.6 12.1 126 152 A P B >> -J 32 0C 0 0, 0.0 4,-1.8 0, 0.0 3,-1.3 -0.362 25.3-129.0 -54.5 136.9 -46.6 83.6 12.6 127 153 A Q H 3> S+ 0 0 33 -96,-2.6 4,-2.2 1,-0.3 -95,-0.1 0.839 106.4 64.9 -59.0 -34.3 -47.8 81.4 9.6 128 154 A A H 34 S+ 0 0 31 -97,-0.5 -1,-0.3 -41,-0.3 4,-0.2 0.804 106.3 43.8 -60.6 -28.0 -50.8 83.6 9.2 129 155 A L H X4>S+ 0 0 0 -3,-1.3 5,-1.9 2,-0.2 3,-1.2 0.829 108.8 55.5 -85.8 -34.4 -48.5 86.5 8.3 130 156 A Q H ><5S+ 0 0 16 -4,-1.8 3,-2.2 1,-0.2 -2,-0.2 0.855 97.9 66.1 -60.7 -32.5 -46.3 84.4 6.1 131 157 A D T 3<5S+ 0 0 117 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.721 96.0 54.7 -66.1 -17.1 -49.5 83.5 4.2 132 158 A L T < 5S- 0 0 77 -3,-1.2 -1,-0.3 -4,-0.2 -2,-0.2 0.388 140.2 -82.7 -85.2 -2.7 -49.7 87.2 3.1 133 159 A G T < 5 - 0 0 31 -3,-2.2 -3,-0.2 -4,-0.1 -2,-0.2 0.150 60.0-130.8 117.6 -14.7 -46.1 86.8 1.7 134 160 A G S > > S+ 0 0 83 -2,-0.7 3,-2.1 1,-0.3 4,-0.5 0.665 85.8 81.9 -61.2 -17.6 -44.5 95.7 3.5 139 165 A V H 3> S+ 0 0 63 1,-0.3 4,-1.5 2,-0.2 3,-0.4 0.764 78.1 72.8 -57.3 -24.4 -47.8 95.4 5.3 140 166 A L H <> S+ 0 0 0 -3,-2.3 4,-2.4 -6,-0.3 -1,-0.3 0.707 81.1 70.9 -64.0 -19.4 -45.8 93.5 8.0 141 167 A A H <> S+ 0 0 2 -3,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.957 102.8 41.0 -64.3 -45.0 -44.2 96.7 9.2 142 168 A K H X S+ 0 0 83 -4,-0.5 4,-2.3 -3,-0.4 -1,-0.2 0.896 113.4 54.1 -66.7 -39.1 -47.5 97.9 10.7 143 169 A Y H X S+ 0 0 50 -4,-1.5 4,-2.1 1,-0.2 -1,-0.2 0.896 108.2 51.0 -60.7 -37.2 -48.2 94.4 12.0 144 170 A S H X S+ 0 0 1 -4,-2.4 4,-2.8 2,-0.2 -2,-0.2 0.896 107.2 52.5 -65.3 -43.3 -44.7 94.5 13.7 145 171 A E H X S+ 0 0 23 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.928 109.9 48.9 -55.2 -46.1 -45.5 97.8 15.3 146 172 A N H X S+ 0 0 24 -4,-2.3 4,-1.6 2,-0.2 -2,-0.2 0.886 110.8 49.9 -66.4 -37.0 -48.7 96.4 16.7 147 173 A Y H X S+ 0 0 3 -4,-2.1 4,-2.0 1,-0.2 -1,-0.2 0.950 110.3 50.6 -62.4 -48.5 -46.9 93.3 18.0 148 174 A A H X S+ 0 0 0 -4,-2.8 4,-3.1 1,-0.2 5,-0.2 0.866 104.8 57.9 -58.1 -40.9 -44.3 95.6 19.7 149 175 A R H X S+ 0 0 60 -4,-2.3 4,-2.7 1,-0.2 -1,-0.2 0.927 105.4 49.9 -56.9 -43.3 -47.1 97.7 21.3 150 176 A V H X S+ 0 0 15 -4,-1.6 4,-2.2 1,-0.2 5,-0.2 0.920 113.0 47.5 -59.7 -42.9 -48.4 94.5 23.0 151 177 A L H X>S+ 0 0 0 -4,-2.0 4,-2.7 2,-0.2 5,-0.6 0.937 113.6 45.6 -64.6 -47.9 -44.9 93.7 24.2 152 178 A F H X5S+ 0 0 0 -4,-3.1 4,-1.8 3,-0.2 5,-0.2 0.926 114.5 49.1 -61.6 -44.5 -44.1 97.2 25.5 153 179 A K H <5S+ 0 0 151 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.904 120.8 34.2 -62.2 -43.3 -47.5 97.5 27.2 154 180 A N H <5S+ 0 0 41 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.817 135.8 16.1 -83.9 -32.7 -47.3 94.1 29.0 155 181 A F H >X5S+ 0 0 0 -4,-2.7 3,-2.0 -5,-0.2 4,-1.8 0.581 95.5 91.2-120.5 -14.7 -43.6 93.8 29.8 156 182 A G T 3<> + 0 0 8 58,-2.5 4,-2.2 -2,-0.6 3,-0.7 0.849 56.3 179.1 45.8 66.7 -30.1 89.0 12.4 168 194 A P H 3> S+ 0 0 0 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.750 77.5 73.3 -66.8 -20.5 -32.3 89.9 9.4 169 195 A L H 34 S+ 0 0 19 1,-0.2 4,-0.4 2,-0.2 -2,-0.1 0.922 107.8 34.0 -56.4 -42.9 -29.2 89.3 7.2 170 196 A T H X4 S+ 0 0 34 -3,-0.7 3,-1.6 2,-0.1 4,-0.3 0.937 118.6 49.2 -75.5 -50.6 -29.8 85.6 7.9 171 197 A F H >< S+ 0 0 7 -4,-2.2 3,-1.8 1,-0.3 -2,-0.2 0.833 101.0 63.7 -69.8 -22.8 -33.6 85.5 8.1 172 198 A M G >< S+ 0 0 2 -4,-2.7 3,-2.0 1,-0.3 -1,-0.3 0.812 90.9 69.7 -61.1 -26.3 -33.9 87.5 4.8 173 199 A D G X S+ 0 0 75 -3,-1.6 3,-2.0 -4,-0.4 -1,-0.3 0.635 76.2 80.1 -70.4 -10.7 -32.2 84.4 3.2 174 200 A G G < S+ 0 0 0 -3,-1.8 11,-2.8 -4,-0.3 -1,-0.3 0.637 94.3 49.7 -64.2 -11.7 -35.4 82.5 4.0 175 201 A Y G < S+ 0 0 3 -3,-2.0 12,-1.5 9,-0.2 17,-0.4 0.124 102.9 63.2-108.9 16.7 -36.6 84.2 0.8 176 202 A A B < S+K 186 0D 15 -3,-2.0 2,-0.3 10,-0.2 10,-0.3 0.180 100.8 40.6-127.4 17.4 -33.5 83.2 -1.2 177 203 A S > - 0 0 31 8,-1.7 3,-0.6 -3,-0.2 -1,-0.2 -0.908 59.4-142.5-162.2 140.1 -33.7 79.4 -1.3 178 204 A E T 3 S+ 0 0 125 -2,-0.3 8,-0.1 1,-0.2 -1,-0.1 0.709 107.0 34.8 -74.2 -17.4 -36.3 76.7 -1.7 179 205 A I T 3 S+ 0 0 114 6,-0.1 -1,-0.2 3,-0.0 3,-0.1 0.260 105.9 79.8-119.5 12.2 -34.6 74.4 0.8 180 206 A G S < S- 0 0 12 -3,-0.6 -6,-0.1 1,-0.3 -136,-0.0 0.123 85.5 -13.6-103.5-148.5 -33.2 76.8 3.4 181 207 A M S > S- 0 0 37 1,-0.1 3,-2.5 -11,-0.1 4,-0.3 -0.117 96.2 -48.4 -49.9 146.0 -34.3 78.9 6.4 182 208 A A T 3 S+ 0 0 4 1,-0.3 -8,-0.2 2,-0.1 -1,-0.1 -0.280 129.0 29.7 -56.2 139.9 -38.0 79.3 6.9 183 209 A P T 3 S- 0 0 26 0, 0.0 -1,-0.3 0, 0.0 -8,-0.1 -0.946 88.0-150.9 -93.8 17.1 -40.1 80.1 4.9 184 210 A S < + 0 0 13 -3,-2.5 2,-0.4 1,-0.2 -9,-0.2 0.923 32.8 160.2 59.9 52.7 -37.8 78.4 2.3 185 211 A I - 0 0 59 -11,-2.8 -8,-1.7 -4,-0.3 2,-1.4 -0.897 39.6-134.9-111.4 135.7 -38.8 80.5 -0.7 186 212 A N B +K 176 0D 96 -2,-0.4 -10,-0.2 -10,-0.3 -8,-0.1 -0.553 60.9 120.1 -94.1 74.2 -36.7 80.8 -3.7 187 213 A T >>> + 0 0 54 -12,-1.5 4,-2.1 -2,-1.4 3,-1.8 -0.312 38.8 177.2-125.4 52.0 -36.6 84.5 -4.6 188 214 A P T 345 + 0 0 35 0, 0.0 -12,-0.1 0, 0.0 138,-0.1 -0.221 68.8 12.1 -58.4 142.6 -32.9 85.3 -4.4 189 215 A G T 345S+ 0 0 0 1,-0.2 137,-0.2 135,-0.0 -13,-0.1 0.466 135.1 45.1 73.7 2.7 -31.8 88.8 -5.3 190 216 A I T <>5S+ 0 0 68 -3,-1.8 4,-1.7 -15,-0.2 -1,-0.2 0.495 113.2 33.8-137.5 -67.8 -35.5 89.9 -5.3 191 217 A G H X5S+ 0 0 4 -4,-2.1 4,-2.4 -16,-0.3 -15,-0.1 0.806 114.7 57.1 -73.3 -32.1 -37.5 88.7 -2.3 192 218 A D H > S+ 0 0 0 1,-0.2 4,-2.2 2,-0.2 -2,-0.2 0.909 110.8 50.9 -62.5 -40.4 -34.2 92.5 -0.6 194 220 A L H X S+ 0 0 69 -4,-1.7 4,-2.3 1,-0.2 -1,-0.2 0.909 109.0 51.9 -61.0 -41.1 -37.9 93.2 -0.2 195 221 A A H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.927 108.8 49.7 -58.8 -46.5 -37.7 91.4 3.2 196 222 A A H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.911 109.0 53.4 -57.4 -43.1 -34.8 93.6 4.3 197 223 A H H X S+ 0 0 14 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.930 110.4 45.9 -60.5 -46.8 -36.8 96.7 3.3 198 224 A T H X S+ 0 0 3 -4,-2.3 4,-2.7 -63,-0.2 -1,-0.2 0.901 111.0 53.1 -63.4 -42.5 -39.8 95.7 5.3 199 225 A V H X S+ 0 0 0 -4,-2.5 4,-3.0 2,-0.2 -1,-0.2 0.903 108.6 49.3 -58.9 -45.0 -37.7 94.8 8.3 200 226 A I H X S+ 0 0 1 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.933 113.2 47.0 -60.9 -47.0 -36.0 98.2 8.3 201 227 A H H X S+ 0 0 19 -4,-2.2 4,-2.3 -5,-0.2 -2,-0.2 0.899 113.3 49.3 -57.5 -43.0 -39.3 99.9 8.1 202 228 A A H X S+ 0 0 0 -4,-2.7 4,-2.4 2,-0.2 -2,-0.2 0.923 109.2 51.2 -64.0 -47.6 -40.7 97.7 10.9 203 229 A H H X S+ 0 0 0 -4,-3.0 4,-2.4 1,-0.2 -1,-0.2 0.925 111.0 49.1 -54.5 -47.3 -37.7 98.4 13.1 204 230 A A H X S+ 0 0 0 -4,-2.3 4,-2.6 1,-0.2 5,-0.2 0.914 109.8 50.7 -64.0 -42.1 -38.2 102.2 12.6 205 231 A R H X S+ 0 0 88 -4,-2.3 4,-2.4 1,-0.2 -1,-0.2 0.898 110.7 50.0 -59.3 -41.6 -41.9 102.0 13.4 206 232 A I H X S+ 0 0 3 -4,-2.4 4,-2.3 2,-0.2 -2,-0.2 0.917 111.1 48.4 -65.0 -43.0 -41.1 100.1 16.6 207 233 A Y H X S+ 0 0 22 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.943 113.2 46.7 -62.9 -47.7 -38.5 102.6 17.7 208 234 A H H X S+ 0 0 48 -4,-2.6 4,-2.7 1,-0.2 5,-0.2 0.894 109.7 55.4 -61.2 -38.5 -40.8 105.6 17.0 209 235 A L H X S+ 0 0 7 -4,-2.4 4,-3.0 -5,-0.2 5,-0.5 0.924 107.1 49.7 -57.0 -46.7 -43.6 103.7 18.8 210 236 A Y H X>S+ 0 0 0 -4,-2.3 5,-3.0 1,-0.2 4,-2.1 0.959 112.1 48.3 -59.0 -48.8 -41.4 103.4 21.9 211 237 A D H <5S+ 0 0 60 -4,-2.5 5,-0.4 3,-0.2 -2,-0.2 0.906 119.8 37.6 -54.8 -44.6 -40.5 107.1 21.7 212 238 A Q H <5S+ 0 0 156 -4,-2.7 -2,-0.2 -5,-0.1 -1,-0.2 0.876 131.0 20.8 -80.1 -38.4 -44.2 108.1 21.4 213 239 A E H <5S+ 0 0 88 -4,-3.0 -3,-0.2 -5,-0.2 -2,-0.2 0.607 132.1 12.9-110.8 -16.2 -46.0 105.7 23.6 214 240 A F T X5S+ 0 0 24 -4,-2.1 4,-2.9 -5,-0.5 3,-0.4 0.661 92.5 83.0-138.4 -30.8 -43.6 104.2 26.2 215 241 A R H > - 0 0 37 1,-0.1 4,-2.5 4,-0.0 5,-0.2 -0.298 69.4-123.9 -71.6 153.6 -4.0 94.8 -2.6 238 264 A A H > S+ 0 0 58 1,-0.2 4,-2.6 2,-0.2 5,-0.1 0.884 113.4 56.2 -56.6 -38.9 -6.3 97.8 -2.9 239 265 A E H > S+ 0 0 116 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.896 108.2 45.3 -64.8 -40.3 -8.6 95.7 -5.0 240 266 A D H > S+ 0 0 16 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.894 111.4 53.2 -72.2 -36.3 -9.0 93.0 -2.3 241 267 A R H X S+ 0 0 112 -4,-2.5 4,-2.0 1,-0.2 -2,-0.2 0.930 106.6 53.5 -60.1 -41.3 -9.5 95.7 0.3 242 268 A A H X S+ 0 0 51 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.906 106.3 53.0 -58.6 -39.9 -12.3 97.1 -1.9 243 269 A S H X S+ 0 0 2 -4,-1.7 4,-1.9 1,-0.2 -1,-0.2 0.859 107.9 50.2 -66.4 -35.5 -14.0 93.7 -2.0 244 270 A C H X S+ 0 0 10 -4,-1.7 4,-2.4 2,-0.2 -1,-0.2 0.854 108.6 51.5 -71.5 -35.8 -13.9 93.5 1.8 245 271 A E H X S+ 0 0 74 -4,-2.0 4,-2.5 2,-0.2 5,-0.2 0.917 108.2 53.1 -63.8 -42.4 -15.5 96.9 2.1 246 272 A N H X S+ 0 0 25 -4,-2.5 4,-2.7 1,-0.2 -2,-0.2 0.927 107.9 51.7 -53.5 -46.0 -18.2 95.7 -0.4 247 273 A Y H X S+ 0 0 12 -4,-1.9 4,-1.3 1,-0.2 5,-0.4 0.945 109.2 48.2 -58.5 -51.6 -18.7 92.7 2.0 248 274 A Q H X>S+ 0 0 2 -4,-2.4 5,-2.6 1,-0.2 4,-2.0 0.932 115.0 45.4 -56.7 -43.4 -19.2 94.9 5.0 249 275 A Q H <>S+ 0 0 14 -4,-2.5 5,-0.8 1,-0.2 -1,-0.2 0.865 114.5 47.4 -70.7 -34.6 -21.6 97.2 3.2 250 276 A F H <5S+ 0 0 0 -4,-2.7 -1,-0.2 -5,-0.2 -2,-0.2 0.596 125.8 28.2 -79.7 -13.3 -23.6 94.3 1.7 251 277 A N H <5S+ 0 0 5 -4,-1.3 4,-0.2 -3,-0.5 -3,-0.2 0.770 139.3 13.6-115.4 -53.7 -23.9 92.4 5.0 252 278 A L T >X5S+ 0 0 0 -4,-2.0 4,-2.9 -5,-0.4 3,-1.3 0.878 125.8 53.6 -89.7 -49.0 -23.8 94.9 7.9 253 279 A G H 3> S+ 0 0 1 -3,-1.3 4,-0.9 -4,-0.2 -2,-0.2 0.770 129.0 49.8 -98.5 -40.0 -29.2 97.3 7.8 256 282 A A H X S+ 0 0 0 -4,-2.9 4,-3.0 1,-0.2 5,-0.4 0.807 100.8 60.5 -80.4 -29.5 -26.8 99.6 9.7 257 283 A H H X S+ 0 0 28 -4,-2.2 4,-0.9 -5,-0.2 7,-0.4 0.938 106.1 47.6 -64.8 -42.1 -26.4 102.4 7.1 258 284 A P H 4 S+ 0 0 0 0, 0.0 7,-0.4 0, 0.0 -1,-0.2 0.869 126.7 27.3 -63.3 -33.0 -30.1 103.2 7.1 259 285 A I H < S+ 0 0 0 -4,-0.9 42,-2.7 41,-0.2 43,-0.2 0.873 124.3 38.5 -95.5 -44.5 -30.3 103.3 10.9 260 286 A F H < S+ 0 0 11 -4,-3.0 2,-0.2 40,-0.2 -3,-0.2 0.454 97.2 79.2-101.9 -3.6 -26.9 104.2 12.4 261 287 A T S < S- 0 0 9 -4,-0.9 40,-0.2 -5,-0.4 4,-0.1 -0.666 76.3-127.0-100.1 161.6 -25.5 106.8 10.1 262 288 A E S S+ 0 0 172 -2,-0.2 -1,-0.1 1,-0.2 38,-0.1 0.828 111.6 48.9 -70.2 -32.2 -26.3 110.5 9.9 263 289 A E S S- 0 0 126 1,-0.1 -1,-0.2 2,-0.1 37,-0.1 0.836 90.5-169.7 -75.2 -36.3 -27.0 110.2 6.2 264 290 A G + 0 0 2 -7,-0.4 -5,-0.1 1,-0.1 -1,-0.1 -0.251 36.3 95.9 68.3-166.3 -29.3 107.2 6.4 265 291 A D S S- 0 0 33 -7,-0.4 -1,-0.1 31,-0.2 -4,-0.1 0.122 87.5 -53.2 69.6 170.7 -30.4 105.2 3.3 266 292 A Y S S- 0 0 4 -9,-0.1 -12,-0.1 1,-0.1 -11,-0.1 -0.387 74.8 -82.2 -64.2 156.3 -28.8 102.1 2.0 267 293 A P >> - 0 0 3 0, 0.0 4,-2.1 0, 0.0 3,-0.6 -0.351 37.8-121.8 -56.7 143.4 -25.0 102.3 1.3 268 294 A A H 3> S+ 0 0 60 1,-0.2 4,-3.0 2,-0.2 5,-0.3 0.880 111.7 56.0 -55.5 -40.9 -24.2 103.8 -2.0 269 295 A V H 3> S+ 0 0 40 1,-0.2 4,-2.4 2,-0.2 5,-0.3 0.857 107.2 49.9 -65.3 -33.0 -22.3 100.7 -3.2 270 296 A L H <> S+ 0 0 1 -3,-0.6 4,-2.0 2,-0.2 5,-0.3 0.961 114.5 43.2 -67.0 -51.5 -25.4 98.6 -2.5 271 297 A K H X S+ 0 0 76 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.928 118.2 45.4 -58.4 -46.3 -27.7 100.9 -4.4 272 298 A D H X S+ 0 0 103 -4,-3.0 4,-2.4 -5,-0.2 5,-0.2 0.910 112.9 46.6 -70.9 -44.3 -25.2 101.3 -7.3 273 299 A R H X S+ 0 0 65 -4,-2.4 4,-2.5 -5,-0.3 5,-0.2 0.916 116.0 45.3 -65.6 -41.1 -24.1 97.7 -7.8 274 300 A V H X S+ 0 0 0 -4,-2.0 4,-2.7 -5,-0.3 13,-0.4 0.902 112.5 51.9 -69.2 -39.2 -27.7 96.4 -7.7 275 301 A S H X S+ 0 0 64 -4,-2.2 4,-2.4 -5,-0.3 -2,-0.2 0.945 113.1 44.6 -59.8 -48.6 -28.9 99.2 -10.1 276 302 A R H X S+ 0 0 174 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.936 114.8 47.3 -62.6 -48.3 -26.2 98.4 -12.6 277 303 A N H X S+ 0 0 31 -4,-2.5 4,-1.6 -5,-0.2 -1,-0.2 0.901 111.7 51.1 -63.1 -40.5 -26.7 94.7 -12.4 278 304 A S H <>S+ 0 0 1 -4,-2.7 5,-2.0 2,-0.2 4,-0.4 0.934 111.6 47.4 -62.5 -43.9 -30.4 95.0 -12.8 279 305 A A H ><5S+ 0 0 64 -4,-2.4 3,-1.6 -5,-0.2 -2,-0.2 0.934 109.9 52.7 -61.4 -44.7 -30.1 97.2 -15.8 280 306 A D H 3<5S+ 0 0 117 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.808 108.3 51.7 -64.7 -27.6 -27.5 94.8 -17.4 281 307 A E T 3<5S- 0 0 109 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.429 121.9-105.0 -91.1 0.5 -30.0 92.0 -17.0 282 308 A G T < 5 + 0 0 63 -3,-1.6 2,-0.2 -4,-0.4 -3,-0.2 0.459 66.7 148.0 98.7 0.6 -32.8 93.8 -18.6 283 309 A Y < - 0 0 90 -5,-2.0 -1,-0.3 -6,-0.2 -2,-0.1 -0.502 43.4-146.9 -67.2 138.0 -35.0 94.8 -15.7 284 310 A T S S+ 0 0 137 -2,-0.2 2,-0.4 1,-0.1 -1,-0.2 0.876 87.2 39.5 -62.7 -41.0 -36.9 98.0 -16.1 285 311 A D S S- 0 0 123 -7,-0.1 -1,-0.1 -3,-0.0 -2,-0.0 -0.884 95.2-102.6-115.1 145.2 -36.6 98.6 -12.3 286 312 A S - 0 0 47 -2,-0.4 -11,-0.1 1,-0.1 4,-0.1 -0.331 24.6-131.2 -58.1 143.0 -33.7 98.0 -9.9 287 313 A R S S+ 0 0 16 -13,-0.4 -1,-0.1 2,-0.1 -94,-0.1 0.642 88.8 86.8 -68.6 -14.6 -34.1 94.9 -7.8 288 314 A L S S- 0 0 10 -17,-0.2 -2,-0.1 -18,-0.1 -98,-0.0 -0.775 82.6-129.3 -89.2 122.5 -33.2 97.0 -4.8 289 315 A P - 0 0 23 0, 0.0 2,-0.3 0, 0.0 -2,-0.1 -0.247 24.7-128.2 -65.5 159.7 -36.3 98.7 -3.3 290 316 A Q - 0 0 167 -4,-0.1 2,-0.4 -25,-0.0 -25,-0.0 -0.851 6.1-142.6-114.0 146.0 -36.0 102.5 -2.6 291 317 A F - 0 0 15 -2,-0.3 2,-0.1 -25,-0.0 -25,-0.1 -0.866 22.6-130.4 -96.9 139.5 -36.6 104.7 0.4 292 318 A T > - 0 0 77 -2,-0.4 4,-2.6 1,-0.1 5,-0.2 -0.400 31.5-102.9 -73.4 168.0 -38.1 108.1 -0.2 293 319 A A H > S+ 0 0 89 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.903 124.7 52.3 -59.9 -39.9 -36.4 111.1 1.4 294 320 A E H > S+ 0 0 162 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.904 110.1 48.3 -63.4 -41.2 -39.1 111.2 4.1 295 321 A E H > S+ 0 0 58 2,-0.2 4,-2.5 1,-0.2 5,-0.3 0.897 107.6 55.3 -65.5 -41.0 -38.5 107.5 4.8 296 322 A V H X S+ 0 0 14 -4,-2.6 4,-2.3 1,-0.2 -31,-0.2 0.929 111.0 45.3 -55.3 -47.1 -34.7 108.0 5.0 297 323 A E H < S+ 0 0 111 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.884 112.4 51.0 -65.1 -37.5 -35.3 110.7 7.7 298 324 A Y H < S+ 0 0 79 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.892 115.3 41.8 -65.0 -40.4 -37.8 108.6 9.6 299 325 A I H >< S+ 0 0 2 -4,-2.5 3,-1.6 -5,-0.1 -2,-0.2 0.874 94.0 88.7 -81.0 -39.5 -35.5 105.5 9.7 300 326 A R T 3< S+ 0 0 89 -4,-2.3 -41,-0.2 -5,-0.3 -40,-0.2 -0.369 92.8 22.1 -66.9 138.5 -32.1 107.2 10.5 301 327 A G T 3 S+ 0 0 40 -42,-2.7 2,-2.1 -40,-0.2 -1,-0.2 0.443 77.5 136.7 87.8 5.0 -31.4 107.6 14.2 302 328 A T < + 0 0 3 -3,-1.6 2,-0.3 -43,-0.2 -1,-0.1 -0.364 48.1 88.7 -84.6 67.2 -33.8 104.9 15.3 303 329 A H - 0 0 48 -2,-2.1 -80,-0.2 -44,-0.1 3,-0.1 -0.978 46.4-174.4-161.6 144.5 -31.4 103.3 17.9 304 330 A D S S- 0 0 36 -82,-2.2 2,-0.3 1,-0.5 -81,-0.2 0.483 88.2 -11.0-109.6 -14.8 -30.2 103.5 21.4 305 331 A F E -g 223 0B 1 -83,-0.5 -81,-0.5 65,-0.1 2,-0.5 -0.935 68.8-111.0-167.7 168.8 -27.4 100.9 20.9 306 332 A L E -gh 224 372B 0 65,-2.9 67,-2.7 -2,-0.3 2,-0.4 -0.952 22.9-150.1-110.9 122.1 -26.2 98.4 18.3 307 333 A G E -gh 225 373B 0 -83,-2.9 -81,-2.7 -2,-0.5 2,-0.4 -0.809 15.5-163.3 -87.6 135.2 -26.5 94.7 19.0 308 334 A I E -gh 226 374B 1 65,-2.4 67,-1.7 -2,-0.4 68,-1.3 -0.982 14.5-162.9-123.0 131.3 -23.8 92.6 17.3 309 335 A N E +gh 227 376B 0 -83,-2.4 -81,-1.8 -2,-0.4 2,-0.4 -0.963 21.7 179.9-105.3 117.0 -23.8 88.9 16.7 310 336 A F + 0 0 0 66,-2.5 68,-0.4 -2,-0.6 -81,-0.1 -0.983 21.8 141.5-125.6 132.1 -20.2 87.8 15.9 311 337 A Y - 0 0 15 -2,-0.4 41,-0.3 -83,-0.3 2,-0.3 0.620 60.1 -16.5-131.1 -38.2 -18.9 84.3 15.2 312 338 A T - 0 0 0 -84,-0.2 -82,-1.8 39,-0.1 -1,-0.3 -0.871 51.1-109.8-162.0-176.9 -16.3 84.1 12.5 313 339 A A E -l 230 0E 0 37,-0.3 2,-0.3 -2,-0.3 37,-0.2 -0.912 15.0-158.9-133.1 160.5 -14.3 85.6 9.6 314 340 A L E -l 231 0E 24 -84,-2.4 -82,-3.1 -2,-0.3 2,-0.4 -0.878 22.8-119.0-127.7 162.4 -14.0 85.1 5.8 315 341 A L E -lM 232 336E 28 21,-3.1 21,-2.2 -2,-0.3 2,-0.4 -0.884 30.9-160.1 -96.5 137.8 -11.3 85.9 3.3 316 342 A G E +lM 233 335E 0 -84,-2.4 -82,-2.7 -2,-0.4 -81,-0.3 -0.970 11.7 178.0-121.5 138.5 -12.4 88.3 0.5 317 343 A K E - M 0 334E 75 17,-1.8 17,-2.6 -2,-0.4 -77,-0.1 -0.942 40.1 -84.3-132.9 158.5 -10.9 88.9 -2.9 318 344 A S S S+ 0 0 64 -2,-0.3 2,-0.3 15,-0.2 15,-0.2 -0.320 82.3 68.1 -59.7 135.6 -11.7 91.1 -5.8 319 345 A G S S- 0 0 26 13,-0.4 2,-0.4 -80,-0.1 -2,-0.0 -0.863 70.9 -94.4 144.1-177.0 -14.2 89.5 -8.2 320 346 A V + 0 0 62 -2,-0.3 2,-0.3 12,-0.2 14,-0.1 -1.000 40.3 154.5-135.5 131.9 -17.8 88.4 -8.6 321 347 A E + 0 0 82 12,-0.4 11,-0.2 -2,-0.4 12,-0.2 -0.968 25.9 71.7-150.9 172.7 -19.4 85.0 -8.2 322 348 A G S S- 0 0 29 -2,-0.3 2,-0.2 7,-0.1 4,-0.1 -0.455 80.4 -47.5 109.2 171.6 -22.7 83.5 -7.3 323 349 A Y - 0 0 201 -2,-0.2 6,-0.4 2,-0.1 -2,-0.1 -0.488 66.0 -89.1 -81.0 150.7 -25.9 83.0 -9.2 324 350 A E S S+ 0 0 61 1,-0.2 2,-0.1 -2,-0.2 -135,-0.0 -0.894 112.1 26.4 -99.8 119.9 -27.7 85.8 -11.1 325 351 A P S S+ 0 0 27 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 0.567 92.8 117.2 -93.8 150.4 -29.6 87.3 -9.4 326 352 A S > - 0 0 16 -137,-0.2 4,-2.7 1,-0.1 5,-0.2 -0.957 65.6-118.7-163.0 156.1 -28.4 87.0 -5.8 327 353 A R H > S+ 0 0 47 -2,-0.3 4,-1.8 2,-0.2 -1,-0.1 0.889 115.5 53.6 -62.1 -41.2 -27.1 89.2 -3.0 328 354 A Y H >>S+ 0 0 57 2,-0.2 4,-0.6 1,-0.2 5,-0.5 0.950 110.9 45.1 -62.0 -45.1 -23.8 87.4 -3.0 329 355 A R H >45S+ 0 0 83 -6,-0.4 3,-1.1 1,-0.2 -2,-0.2 0.938 112.9 51.2 -62.6 -44.0 -23.3 88.0 -6.7 330 356 A D H 3<5S+ 0 0 0 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.809 98.4 69.1 -60.1 -29.7 -24.4 91.7 -6.3 331 357 A S H 3<5S- 0 0 1 -4,-1.8 -1,-0.2 -3,-0.2 -2,-0.2 0.679 93.5-139.1 -72.0 -19.9 -21.9 92.2 -3.5 332 358 A G T <<5 + 0 0 5 -3,-1.1 -13,-0.4 -4,-0.6 2,-0.3 0.945 59.6 110.9 63.8 50.9 -18.8 91.9 -5.7 333 359 A V < - 0 0 0 -5,-0.5 2,-0.6 -12,-0.2 -12,-0.4 -0.976 59.6-138.9-148.8 144.8 -16.5 89.8 -3.5 334 360 A I E -M 317 0E 31 -17,-2.6 -17,-1.8 -2,-0.3 2,-0.4 -0.933 29.5-155.2-105.2 120.2 -15.2 86.2 -3.7 335 361 A L E +M 316 0E 36 -2,-0.6 2,-0.3 -19,-0.2 -19,-0.2 -0.794 24.4 149.6-105.9 135.4 -15.4 84.6 -0.3 336 362 A T E -M 315 0E 60 -21,-2.2 -21,-3.1 -2,-0.4 2,-0.3 -0.844 34.4-123.0-142.6 178.1 -13.3 81.8 1.1 337 363 A Q - 0 0 52 -2,-0.3 2,-0.5 -23,-0.2 -23,-0.1 -0.941 29.6-108.4-126.5 153.6 -11.9 80.6 4.4 338 364 A D > - 0 0 70 -2,-0.3 3,-1.7 1,-0.1 -2,-0.0 -0.719 17.6-141.8 -81.3 128.0 -8.3 79.9 5.4 339 365 A A T 3 S+ 0 0 105 -2,-0.5 -1,-0.1 1,-0.3 4,-0.1 0.710 98.5 63.9 -60.3 -23.5 -7.6 76.2 5.8 340 366 A A T 3 S+ 0 0 84 2,-0.1 -1,-0.3 3,-0.0 3,-0.1 0.674 78.2 101.5 -76.0 -18.7 -5.3 77.0 8.7 341 367 A W S < S- 0 0 27 -3,-1.7 11,-0.1 1,-0.1 -4,-0.0 -0.440 85.5-102.2 -69.2 139.7 -8.1 78.5 10.9 342 368 A P - 0 0 69 0, 0.0 9,-2.8 0, 0.0 2,-0.1 -0.306 41.5-132.7 -61.3 145.4 -9.3 76.1 13.6 343 369 A I - 0 0 117 7,-0.2 2,-0.2 1,-0.1 7,-0.2 -0.354 17.0-162.6 -95.5 171.9 -12.7 74.4 12.8 344 370 A S - 0 0 21 5,-0.5 37,-0.2 2,-0.4 -1,-0.1 -0.562 46.5 -85.9-128.5-162.5 -15.9 73.9 14.7 345 371 A A S S+ 0 0 4 35,-1.0 2,-0.5 -2,-0.2 36,-0.2 0.321 109.4 78.6 -89.7 5.8 -18.8 71.5 14.2 346 372 A S S > S- 0 0 2 3,-0.4 3,-1.8 34,-0.3 -2,-0.4 -0.975 76.1-142.8-120.2 124.8 -20.4 74.1 11.8 347 373 A S T 3 S+ 0 0 102 -2,-0.5 -1,-0.1 1,-0.3 -2,-0.0 0.777 102.0 47.5 -54.0 -33.9 -19.0 74.3 8.2 348 374 A W T 3 S+ 0 0 98 1,-0.1 2,-0.7 -3,-0.0 -1,-0.3 0.583 97.1 82.9 -83.8 -13.6 -19.4 78.1 8.2 349 375 A L < + 0 0 0 -3,-1.8 -5,-0.5 -37,-0.1 -3,-0.4 -0.854 48.7 166.4-110.6 108.7 -17.8 78.7 11.6 350 376 A K - 0 0 43 -2,-0.7 2,-0.8 -37,-0.2 -37,-0.3 -0.853 42.8-107.8-112.6 154.5 -14.0 79.0 11.9 351 377 A V + 0 0 6 -9,-2.8 -39,-0.1 -2,-0.3 28,-0.0 -0.734 52.8 149.1 -90.7 108.4 -12.1 80.3 14.9 352 378 A V >> + 0 0 0 -2,-0.8 3,-1.7 -41,-0.3 4,-0.6 -0.602 12.0 171.8-137.3 72.0 -10.7 83.7 14.0 353 379 A P H >> S+ 0 0 17 0, 0.0 3,-1.5 0, 0.0 4,-0.9 0.842 75.0 59.8 -64.9 -35.3 -10.7 85.7 17.3 354 380 A W H 3> S+ 0 0 90 1,-0.3 4,-2.1 2,-0.2 5,-0.1 0.764 94.0 68.3 -60.7 -24.1 -8.6 88.7 15.9 355 381 A G H <> S+ 0 0 0 -3,-1.7 4,-2.5 1,-0.2 -1,-0.3 0.808 92.8 59.4 -63.0 -28.1 -11.4 89.2 13.4 356 382 A F H S+ 0 0 56 -4,-2.4 5,-2.2 1,-0.2 4,-0.6 0.922 115.0 41.3 -53.9 -47.8 -16.5 102.2 15.5 365 391 A N H <5S+ 0 0 118 -4,-2.4 3,-0.2 3,-0.2 -2,-0.2 0.880 118.3 44.2 -73.0 -36.4 -15.2 104.0 12.5 366 392 A E H <5S+ 0 0 60 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.872 124.5 30.9 -77.1 -36.7 -18.2 103.6 10.2 367 393 A Y H <5S- 0 0 10 -4,-2.6 -1,-0.2 -5,-0.2 -2,-0.2 0.167 111.5-104.5-115.1 15.4 -20.9 104.4 12.8 368 394 A N T <5S- 0 0 148 -4,-0.6 -3,-0.2 -3,-0.2 -4,-0.2 0.924 73.1 -59.6 61.5 48.4 -19.1 106.9 15.0 369 395 A N S + 0 0 5 -2,-1.6 4,-2.5 1,-0.2 3,-0.3 -0.405 10.9 160.5 -89.2 66.5 -15.4 71.4 25.8 388 414 A T H > S+ 0 0 88 -2,-2.0 4,-2.6 1,-0.2 -1,-0.2 0.852 73.6 55.6 -55.7 -39.3 -11.8 72.7 25.5 389 415 A G H > S+ 0 0 35 -3,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.922 109.9 46.1 -61.5 -43.7 -12.5 74.2 22.0 390 416 A R H > S+ 0 0 0 -3,-0.3 4,-2.6 2,-0.2 -2,-0.2 0.901 110.9 52.1 -65.7 -42.4 -15.4 76.2 23.4 391 417 A V H X S+ 0 0 12 -4,-2.5 4,-2.7 1,-0.2 5,-0.2 0.946 112.5 45.9 -56.8 -49.6 -13.4 77.4 26.4 392 418 A H H X S+ 0 0 85 -4,-2.6 4,-2.5 1,-0.2 5,-0.3 0.887 110.4 54.1 -60.4 -42.5 -10.6 78.6 24.0 393 419 A Y H X S+ 0 0 0 -4,-2.4 4,-2.5 -5,-0.2 5,-0.2 0.948 113.0 42.5 -58.6 -48.7 -13.1 80.3 21.7 394 420 A Y H X S+ 0 0 1 -4,-2.6 4,-2.7 2,-0.2 5,-0.3 0.930 114.3 48.3 -67.3 -45.3 -14.6 82.3 24.6 395 421 A T H X S+ 0 0 3 -4,-2.7 4,-2.1 -5,-0.2 -1,-0.2 0.929 115.6 45.0 -65.6 -39.7 -11.4 83.2 26.3 396 422 A E H X S+ 0 0 40 -4,-2.5 4,-2.3 -5,-0.2 -1,-0.2 0.918 114.6 47.3 -67.8 -44.0 -9.8 84.4 23.0 397 423 A H H X S+ 0 0 0 -4,-2.5 4,-2.5 -5,-0.3 -2,-0.2 0.912 112.7 49.4 -66.8 -38.6 -12.9 86.3 21.9 398 424 A L H X S+ 0 0 0 -4,-2.7 4,-2.5 -5,-0.2 -1,-0.2 0.907 110.1 51.4 -66.7 -37.3 -13.3 88.0 25.2 399 425 A K H X S+ 0 0 8 -4,-2.1 4,-2.0 -5,-0.3 -2,-0.2 0.916 111.0 48.0 -61.9 -43.1 -9.6 89.0 25.2 400 426 A E H X S+ 0 0 18 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.909 111.6 49.7 -65.8 -39.7 -10.0 90.5 21.7 401 427 A M H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.904 108.8 52.7 -62.6 -42.5 -13.1 92.4 22.8 402 428 A L H X S+ 0 0 0 -4,-2.5 4,-2.9 1,-0.2 5,-0.4 0.868 108.0 51.4 -64.7 -34.9 -11.3 93.7 25.9 403 429 A K H X>S+ 0 0 40 -4,-2.0 4,-2.2 2,-0.2 5,-1.5 0.916 107.9 52.7 -64.7 -42.1 -8.5 95.0 23.6 404 430 A A H <5S+ 0 0 0 -4,-2.2 6,-2.6 3,-0.2 4,-0.3 0.912 116.0 41.1 -57.6 -41.7 -11.1 96.7 21.4 405 431 A I H X5S+ 0 0 22 -4,-2.3 4,-0.8 4,-0.2 -2,-0.2 0.973 127.0 28.1 -68.3 -57.4 -12.4 98.4 24.5 406 432 A H H <5S+ 0 0 71 -4,-2.9 -3,-0.2 -404,-0.2 -2,-0.2 0.867 132.3 29.9 -81.5 -41.6 -9.3 99.3 26.4 407 433 A E T <5S+ 0 0 113 -4,-2.2 -3,-0.2 -5,-0.4 -1,-0.1 0.809 130.7 32.5 -86.0 -33.5 -6.7 99.7 23.6 408 434 A D T 4 - 0 0 21 4,-2.7 3,-2.5 -2,-0.9 4,-0.2 -0.384 31.6-116.4 -90.1 58.1 -29.9 74.7 15.8 426 452 A W G > S+ 0 0 8 -2,-1.5 3,-2.2 1,-0.3 -1,-0.2 -0.146 92.5 3.5 51.4-128.4 -32.3 75.5 13.0 427 453 A L G 3 S+ 0 0 31 1,-0.3 -381,-2.7 -382,-0.1 -1,-0.3 0.653 130.3 63.0 -66.8 -11.6 -31.6 73.3 9.9 428 454 A R G X S- 0 0 110 -3,-2.5 3,-2.0 1,-0.3 4,-0.3 0.456 89.3-162.0 -90.5 0.5 -28.9 71.5 11.8 429 455 A G T < - 0 0 0 -3,-2.2 -4,-2.7 1,-0.3 3,-0.4 -0.272 60.9 -32.5 57.5-139.0 -31.4 70.1 14.3 430 456 A Y T 3 S+ 0 0 39 -384,-0.3 -1,-0.3 -6,-0.2 11,-0.1 0.234 116.7 96.6 -96.6 14.0 -29.8 68.9 17.5 431 457 A S S < S+ 0 0 28 -3,-2.0 2,-0.5 -385,-0.1 -1,-0.2 0.774 76.5 56.8 -78.9 -27.1 -26.6 67.8 15.7 432 458 A E S S- 0 0 8 -3,-0.4 2,-0.5 -4,-0.3 -9,-0.3 -0.921 74.8-151.7-111.0 130.3 -24.6 71.0 16.5 433 459 A K B +N 381 0F 32 -52,-3.0 -52,-1.8 -2,-0.5 -50,-0.2 -0.900 26.8 161.6-108.0 121.4 -24.1 72.0 20.1 434 460 A F + 0 0 3 -2,-0.5 -55,-0.3 -54,-0.2 -1,-0.1 0.341 41.1 117.3-113.2 -1.7 -23.6 75.7 20.9 435 461 A G - 0 0 0 1,-0.1 -15,-0.2 2,-0.1 -14,-0.2 -0.310 56.3-155.4 -71.8 155.0 -24.5 75.5 24.7 436 462 A I S S+ 0 0 0 -17,-1.8 15,-2.5 -16,-0.2 18,-0.8 0.627 97.3 52.4 -90.2 -19.8 -22.4 76.3 27.7 437 463 A Y E S-oP 421 450G 3 -17,-1.1 -15,-2.1 -18,-0.3 2,-0.2 -0.951 89.7-133.7-106.5 136.9 -24.8 73.9 29.4 438 464 A A E - P 0 449G 15 11,-2.9 11,-2.4 -2,-0.4 2,-0.4 -0.611 16.8-159.2 -84.5 147.3 -25.4 70.5 27.9 439 465 A V E - P 0 448G 10 -2,-0.2 2,-1.0 9,-0.2 9,-0.2 -0.999 15.4-136.1-130.1 130.8 -29.0 69.2 27.5 440 466 A D > - 0 0 81 7,-1.1 3,-1.4 -2,-0.4 6,-0.4 -0.770 17.1-172.4 -87.4 103.2 -30.0 65.5 27.1 441 467 A F T 3 S+ 0 0 31 -2,-1.0 -1,-0.1 1,-0.3 -387,-0.1 0.469 83.2 59.7 -78.0 -1.8 -32.6 65.6 24.3 442 468 A E T 3 S+ 0 0 175 1,-0.0 -1,-0.3 -3,-0.0 -2,-0.1 0.431 90.8 80.4 -97.2 -6.1 -33.3 61.9 24.9 443 469 A D S X S- 0 0 56 -3,-1.4 3,-2.6 1,-0.1 -3,-0.1 -0.919 74.3-146.9-104.5 116.3 -34.4 62.6 28.6 444 470 A P T 3 S+ 0 0 112 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.773 99.6 59.9 -56.7 -22.5 -37.9 63.9 28.8 445 471 A A T 3 S- 0 0 63 -3,-0.0 -4,-0.1 2,-0.0 -390,-0.0 0.553 95.6-146.5 -78.6 -11.1 -36.8 66.0 31.8 446 472 A R < - 0 0 26 -3,-2.6 -5,-0.1 -6,-0.4 -386,-0.0 0.890 17.8-157.1 46.1 55.4 -34.2 67.9 29.6 447 473 A P - 0 0 50 0, 0.0 -7,-1.1 0, 0.0 2,-0.5 -0.354 4.9-142.0 -63.4 140.8 -31.7 68.3 32.4 448 474 A R E -P 439 0G 24 -9,-0.2 -9,-0.2 -27,-0.0 -27,-0.0 -0.913 22.1-177.5-101.9 127.7 -29.2 71.1 31.9 449 475 A I E -P 438 0G 80 -11,-2.4 -11,-2.9 -2,-0.5 2,-0.2 -0.980 28.3-107.8-130.9 138.3 -25.6 70.3 33.1 450 476 A P E -P 437 0G 42 0, 0.0 -13,-0.2 0, 0.0 2,-0.1 -0.429 25.8-153.9 -70.7 135.4 -22.6 72.6 33.1 451 477 A K >> - 0 0 1 -15,-2.5 4,-1.5 -2,-0.2 3,-0.5 -0.448 40.1 -95.7 -85.8 170.0 -19.8 72.1 30.6 452 478 A E H 3> S+ 0 0 67 -67,-2.9 4,-2.5 1,-0.2 5,-0.2 0.896 126.8 60.1 -52.9 -38.7 -16.3 73.3 31.3 453 479 A S H 3> S+ 0 0 1 -68,-0.3 4,-2.8 1,-0.2 -1,-0.2 0.872 101.5 52.4 -59.9 -37.9 -17.1 76.5 29.4 454 480 A A H <> S+ 0 0 2 -18,-0.8 4,-2.0 -3,-0.5 -1,-0.2 0.874 110.5 48.6 -63.4 -36.3 -19.9 77.3 31.8 455 481 A K H X S+ 0 0 121 -4,-1.5 4,-1.9 -3,-0.2 -2,-0.2 0.907 113.4 45.9 -70.0 -42.7 -17.5 76.9 34.7 456 482 A V H X S+ 0 0 3 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.916 113.1 49.5 -66.4 -44.3 -14.9 79.1 33.0 457 483 A L H X S+ 0 0 3 -4,-2.8 4,-3.0 -5,-0.2 5,-0.2 0.900 109.0 53.1 -62.9 -36.6 -17.5 81.8 32.1 458 484 A A H X S+ 0 0 25 -4,-2.0 4,-2.4 -5,-0.2 -1,-0.2 0.906 109.0 49.6 -62.5 -40.7 -18.8 81.7 35.7 459 485 A E H X S+ 0 0 63 -4,-1.9 4,-2.7 2,-0.2 6,-0.3 0.910 111.9 48.1 -63.1 -43.8 -15.2 82.3 36.8 460 486 A I H X>S+ 0 0 1 -4,-2.5 4,-2.0 1,-0.2 5,-0.5 0.919 113.7 47.0 -61.4 -45.7 -14.9 85.2 34.4 461 487 A M H <5S+ 0 0 17 -4,-3.0 -2,-0.2 -390,-0.2 -1,-0.2 0.878 115.4 45.7 -65.9 -35.4 -18.3 86.7 35.5 462 488 A N H <5S+ 0 0 138 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.927 122.4 34.0 -73.0 -45.6 -17.4 86.3 39.2 463 489 A T H <5S- 0 0 60 -4,-2.7 -2,-0.2 2,-0.2 -1,-0.2 0.635 95.8-138.1 -85.2 -18.2 -13.9 87.8 39.0 464 490 A R T <5S+ 0 0 43 -4,-2.0 -459,-2.5 -5,-0.3 2,-0.3 0.754 72.5 80.3 62.9 27.8 -14.7 90.3 36.2 465 491 A K B - 0 0 10 0, 0.0 3,-2.3 0, 0.0 4,-0.4 -0.215 22.7-114.7 -58.6 147.5 -8.0 84.4 34.5 468 494 A E G > S+ 0 0 153 1,-0.3 3,-1.8 2,-0.2 -2,-0.0 0.821 111.1 64.7 -54.1 -36.2 -4.2 84.5 34.3 469 495 A R G 3 S+ 0 0 143 1,-0.3 -1,-0.3 0, 0.0 -3,-0.0 0.670 104.1 48.0 -66.9 -13.4 -4.0 81.0 32.8 470 496 A F G < S+ 0 0 42 -3,-2.3 -1,-0.3 2,-0.1 -2,-0.2 0.399 89.4 107.1-103.2 0.3 -5.8 82.2 29.7 471 497 A R < 0 0 68 -3,-1.8 -75,-0.0 -4,-0.4 -76,-0.0 -0.425 360.0 360.0 -80.1 154.2 -3.7 85.3 29.2 472 498 A D 0 0 144 -2,-0.1 -1,-0.1 0, 0.0 -2,-0.1 -0.267 360.0 360.0 -57.3 360.0 -1.1 85.6 26.4