==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=25-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 22-SEP-98 1BVZ . COMPND 2 MOLECULE: PROTEIN (ALPHA-AMYLASE II); . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOACTINOMYCES VULGARIS; . AUTHOR S.KAMITORI,S.KONDO,K.OKUYAMA,T.YOKOTA,Y.SHIMURA,T.TONOZUKA, . 1170 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 43002.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 819 70.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 68 5.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 195 16.7 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 6 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 10 0.9 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 . 2 0.2 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 . 116 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 142 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 228 19.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 17 1.5 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 9 0 1 1 0 2 0 3 3 2 3 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 3 7 5 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 PARALLEL BRIDGES PER LADDER . 14 4 5 6 4 2 3 2 2 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 3 3 0 0 2 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 1 A M 0 0 45 0, 0.0 2,-1.0 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0 160.3 21.5 34.1 22.6 2 2 A L > - 0 0 68 1,-0.2 3,-1.5 28,-0.1 28,-0.3 -0.857 360.0-171.6-102.7 96.7 25.0 34.8 24.0 3 3 A L G > S+ 0 0 21 -2,-1.0 3,-0.9 1,-0.3 -1,-0.2 0.724 75.6 66.7 -69.9 -20.9 25.1 31.7 26.2 4 4 A E G 3 S+ 0 0 27 1,-0.2 -1,-0.3 -3,-0.1 612,-0.1 0.181 97.9 55.6 -90.5 11.5 28.3 32.8 27.9 5 5 A A G < S+ 0 0 4 -3,-1.5 -1,-0.2 25,-0.1 2,-0.2 0.361 85.2 95.9 -98.6 -17.8 26.5 35.7 29.5 6 6 A I < - 0 0 8 -3,-0.9 2,-0.3 -4,-0.3 23,-0.2 -0.653 56.2-178.4 -81.3 147.0 23.6 33.7 31.2 7 7 A F B +A 28 0A 20 21,-2.2 21,-1.8 -2,-0.2 2,-0.3 -0.995 19.8 159.7-153.5 143.3 24.2 32.8 34.9 8 8 A H - 0 0 13 -2,-0.3 2,-0.3 19,-0.2 19,-0.1 -0.844 15.8-163.6-157.6 130.4 22.8 31.0 37.9 9 9 A E - 0 0 29 2,-0.3 17,-0.2 -2,-0.3 102,-0.0 -0.822 26.9-133.4 -85.1 154.5 24.2 29.6 41.1 10 10 A A S S+ 0 0 19 -2,-0.3 2,-0.2 102,-0.1 5,-0.0 -0.062 90.6 34.1 -92.1 36.1 21.9 27.1 42.9 11 11 A K S >> S+ 0 0 60 102,-0.1 4,-1.2 5,-0.1 3,-1.2 -0.750 95.3 43.4-156.2-165.5 22.6 29.0 46.1 12 12 A G T 34 S- 0 0 16 1,-0.2 3,-0.2 -2,-0.2 393,-0.1 -0.114 119.8 -20.3 63.1-138.0 23.2 32.6 47.2 13 13 A S T 34 S+ 0 0 10 1,-0.2 -1,-0.2 391,-0.2 3,-0.2 0.584 136.7 58.1 -83.9 -12.9 21.2 35.4 45.8 14 14 A Y T <4 S+ 0 0 17 -3,-1.2 12,-2.6 1,-0.3 2,-0.3 0.518 117.4 17.8-103.7 -14.0 20.2 33.3 42.8 15 15 A A E < S+B 25 0A 1 -4,-1.2 -1,-0.3 10,-0.2 10,-0.2 -0.818 78.8 135.7-153.4 122.6 18.5 30.4 44.5 16 16 A Y E -B 24 0A 10 8,-2.6 8,-2.9 -2,-0.3 2,-0.2 -0.969 47.6 -96.6-156.6 160.0 17.3 30.5 48.1 17 17 A P E -B 23 0A 7 0, 0.0 105,-0.4 0, 0.0 6,-0.2 -0.580 18.8-177.4 -85.3 147.3 14.1 29.5 50.2 18 18 A I E S- 0 0 54 4,-2.5 2,-0.3 1,-0.4 5,-0.1 0.314 84.3 -7.1-115.8 -1.6 11.2 31.7 51.2 19 19 A S E > S-B 22 0A 35 3,-0.9 3,-0.8 1,-0.0 -1,-0.4 -0.916 87.0 -88.7-165.8 175.7 9.6 28.9 53.3 20 20 A E T 3 S+ 0 0 57 -2,-0.3 96,-0.2 1,-0.2 -1,-0.0 0.836 130.9 44.4 -58.3 -27.2 10.4 25.1 53.7 21 21 A T T 3 S+ 0 0 61 1,-0.1 54,-3.3 56,-0.1 2,-0.5 0.586 106.0 68.1 -89.3 -13.0 8.1 24.6 50.6 22 22 A Q E < -BC 19 74A 50 -3,-0.8 -4,-2.5 52,-0.2 -3,-0.9 -0.916 51.5-166.7-134.0 125.3 9.3 27.4 48.3 23 23 A L E -BC 17 73A 0 50,-2.5 50,-2.8 -2,-0.5 2,-0.5 -0.871 11.4-152.8-107.2 122.2 12.4 28.2 46.3 24 24 A R E -BC 16 72A 51 -8,-2.9 -8,-2.6 -2,-0.6 2,-0.4 -0.846 18.5-173.0 -83.1 134.1 13.0 31.6 44.8 25 25 A V E -BC 15 71A 1 46,-2.3 46,-2.8 -2,-0.5 2,-0.3 -1.000 1.9-169.4-131.7 122.4 15.2 31.0 41.8 26 26 A R E - C 0 70A 8 -12,-2.6 2,-0.3 -2,-0.4 44,-0.3 -0.874 1.6-166.6-112.1 146.5 16.5 34.1 40.1 27 27 A L E - C 0 69A 1 42,-3.5 42,-3.0 -2,-0.3 2,-0.4 -0.997 5.2-153.2-138.9 142.4 18.4 34.0 36.6 28 28 A R E +AC 7 68A 33 -21,-1.8 -21,-2.2 -2,-0.3 2,-0.3 -0.947 17.4 167.4-124.4 137.9 20.4 36.6 34.9 29 29 A A E - C 0 67A 0 38,-2.4 38,-2.5 -2,-0.4 -23,-0.2 -0.897 45.4 -83.8-138.4 156.0 21.0 37.0 31.1 30 30 A K E > - C 0 66A 45 -28,-0.3 3,-2.1 -2,-0.3 4,-0.5 -0.462 64.8 -82.3 -63.3 147.5 22.4 39.9 29.0 31 31 A K T 3 S+ 0 0 103 34,-3.1 -1,-0.1 1,-0.3 35,-0.1 -0.327 111.7 6.7 -69.7 111.1 19.9 42.6 28.2 32 32 A G T 3 S+ 0 0 43 -2,-0.4 -1,-0.3 2,-0.3 34,-0.1 0.151 99.8 98.2 109.7 -11.9 17.8 41.6 25.3 33 33 A D S < S+ 0 0 25 -3,-2.1 2,-0.4 55,-0.1 -2,-0.1 0.734 81.2 43.4 -82.0 -21.6 18.9 38.0 24.7 34 34 A V + 0 0 2 -4,-0.5 -2,-0.3 54,-0.2 54,-0.3 -0.970 47.7 172.6-131.0 139.0 16.2 36.1 26.4 35 35 A V S S+ 0 0 90 52,-2.9 2,-0.3 1,-0.4 53,-0.2 0.489 75.7 28.9-122.9 -11.0 12.4 36.8 26.3 36 36 A R E -E 87 0B 104 51,-1.3 51,-1.7 22,-0.1 -1,-0.4 -0.964 59.4-175.6-144.4 134.8 11.0 33.8 28.2 37 37 A C E -EF 86 57B 0 20,-0.5 20,-1.8 -2,-0.3 2,-0.4 -0.988 15.0-173.8-128.8 122.0 12.8 31.9 30.9 38 38 A E E -EF 85 56B 26 47,-3.0 47,-2.8 -2,-0.4 2,-0.5 -0.918 15.2-146.0-124.5 146.4 10.8 28.9 32.1 39 39 A V E -EF 84 55B 0 16,-2.2 16,-1.7 -2,-0.4 2,-0.5 -0.952 10.5-172.7-118.1 125.5 11.6 26.6 35.0 40 40 A L E +EF 83 54B 5 43,-2.4 43,-1.9 -2,-0.5 2,-0.3 -0.976 25.0 163.7-118.0 127.5 10.7 22.9 34.7 41 41 A Y E +EF 82 53B 22 12,-2.6 12,-2.6 -2,-0.5 2,-0.3 -0.980 18.7 172.1-148.4 147.5 11.2 21.2 38.0 42 42 A A E -E 81 0B 18 39,-2.4 39,-2.2 -2,-0.3 10,-0.1 -0.977 47.0 -60.0-148.9 177.0 10.5 18.1 40.2 43 43 A D > - 0 0 27 -2,-0.3 3,-1.1 37,-0.2 37,-0.2 -0.214 52.8-115.5 -54.1 148.6 11.4 16.3 43.4 44 44 A R T 3 S+ 0 0 31 1,-0.3 -1,-0.1 69,-0.1 36,-0.1 0.753 115.0 38.9 -64.0 -26.4 15.0 15.4 43.6 45 45 A Y T 3 S+ 0 0 74 828,-0.2 -1,-0.3 34,-0.1 829,-0.1 0.582 84.5 129.3 -95.9 -9.5 14.1 11.6 43.6 46 46 A A < - 0 0 15 -3,-1.1 -4,-0.1 1,-0.1 4,-0.0 -0.092 61.2-106.7 -65.4 150.0 11.2 11.6 41.0 47 47 A S > - 0 0 61 1,-0.1 3,-2.0 2,-0.1 -1,-0.1 -0.098 22.0-112.5 -80.5 157.2 11.3 9.1 38.2 48 48 A P T 3 S+ 0 0 113 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.857 112.9 69.9 -63.8 -25.7 12.0 10.0 34.5 49 49 A E T 3 S+ 0 0 170 2,-0.1 2,-0.5 0, 0.0 -2,-0.1 0.395 83.0 87.8 -66.9 0.1 8.5 9.0 33.6 50 50 A E S < S- 0 0 97 -3,-2.0 2,-0.5 -4,-0.0 -8,-0.0 -0.877 76.2-134.6-100.6 132.3 7.2 12.1 35.5 51 51 A E - 0 0 112 -2,-0.5 -2,-0.1 1,-0.1 -10,-0.0 -0.793 32.7-109.3 -87.5 132.0 6.9 15.3 33.5 52 52 A L - 0 0 24 -2,-0.5 -10,-0.2 1,-0.1 2,-0.1 -0.079 26.2-111.0 -57.7 147.6 8.2 18.2 35.5 53 53 A A E -F 41 0B 47 -12,-2.6 -12,-2.6 21,-0.1 2,-0.3 -0.468 38.1-127.2 -75.8 157.7 6.0 20.9 37.0 54 54 A H E +F 40 0B 103 -14,-0.2 2,-0.2 -2,-0.1 -14,-0.2 -0.757 27.6 176.5-111.7 156.0 6.4 24.3 35.3 55 55 A A E -F 39 0B 14 -16,-1.7 -16,-2.2 -2,-0.3 2,-0.6 -0.779 24.9-137.2-153.6 111.5 7.2 27.8 36.7 56 56 A L E -F 38 0B 88 -2,-0.2 2,-1.6 -18,-0.2 -18,-0.2 -0.569 12.0-142.5 -78.5 120.3 7.6 30.9 34.4 57 57 A A E -F 37 0B 3 -20,-1.8 -20,-0.5 -2,-0.6 14,-0.3 -0.647 24.9-156.5 -74.9 93.9 10.5 33.0 35.5 58 58 A G E -D 70 0A 35 -2,-1.6 12,-2.6 12,-1.0 2,-0.6 -0.237 28.2 -91.7 -63.8 165.4 9.1 36.4 34.7 59 59 A K E +D 69 0A 113 10,-0.3 10,-0.3 1,-0.2 -1,-0.1 -0.697 47.0 173.6 -86.7 120.8 11.4 39.4 34.1 60 60 A A E - 0 0 4 8,-2.4 2,-0.3 -2,-0.6 9,-0.2 0.596 57.9 -10.1-103.8 -20.7 12.0 41.1 37.5 61 61 A G E -D 68 0A 8 7,-1.6 7,-2.5 445,-0.1 2,-0.3 -0.971 50.7-153.0-166.0 164.0 14.6 43.8 36.8 62 62 A S E -D 67 0A 38 -2,-0.3 5,-0.3 5,-0.2 337,-0.2 -0.976 17.3-174.8-144.2 154.7 17.1 44.9 34.1 63 63 A D - 0 0 6 3,-2.5 333,-0.2 -2,-0.3 334,-0.1 -0.511 50.0 -60.8-132.1 177.0 20.4 46.8 34.7 64 64 A E S S- 0 0 82 332,-0.3 332,-0.1 -2,-0.2 333,-0.1 0.967 131.8 -2.0 -17.3 -72.8 23.2 48.5 32.7 65 65 A R S S+ 0 0 49 331,-0.1 -34,-3.1 -35,-0.1 -1,-0.1 0.698 121.2 73.0-106.8 -26.0 24.1 45.2 31.0 66 66 A F E -C 30 0A 26 -36,-0.3 -3,-2.5 330,-0.1 2,-0.3 -0.368 52.4-151.8-109.4 176.1 21.7 42.5 32.4 67 67 A D E -CD 29 62A 0 -38,-2.5 -38,-2.4 -5,-0.3 2,-0.5 -0.972 20.8-153.0-141.0 134.0 18.2 41.2 32.4 68 68 A Y E -CD 28 61A 9 -7,-2.5 -8,-2.4 -2,-0.3 -7,-1.6 -0.988 10.1-173.0-131.1 128.9 17.0 39.4 35.5 69 69 A F E -CD 27 59A 5 -42,-3.0 -42,-3.5 -2,-0.5 2,-0.3 -0.887 6.4-170.8-121.1 149.4 14.2 36.8 35.6 70 70 A E E +CD 26 58A 34 -12,-2.6 -12,-1.0 -2,-0.3 2,-0.3 -0.994 7.1 173.5-155.9 129.1 12.8 35.3 38.7 71 71 A A E -C 25 0A 7 -46,-2.8 -46,-2.3 -2,-0.3 2,-0.5 -0.842 25.4-128.0-134.1 165.8 10.4 32.4 39.5 72 72 A L E -C 24 0A 42 -2,-0.3 2,-0.6 -48,-0.2 -48,-0.2 -0.984 18.4-154.4-127.9 118.6 9.0 30.6 42.5 73 73 A L E -C 23 0A 0 -50,-2.8 -50,-2.5 -2,-0.5 2,-0.5 -0.847 10.1-141.1 -95.9 117.9 9.3 26.8 42.7 74 74 A E E +C 22 0A 91 -2,-0.6 2,-0.2 -52,-0.2 -52,-0.2 -0.719 25.4 177.1 -73.2 128.4 6.7 24.9 44.8 75 75 A C > + 0 0 3 -54,-3.3 3,-2.2 -2,-0.5 41,-0.1 -0.637 14.7 169.7-137.6 74.2 8.7 22.2 46.5 76 76 A S T 3 S+ 0 0 106 1,-0.3 -1,-0.1 -2,-0.2 -54,-0.1 0.778 87.4 52.0 -62.0 -21.8 6.5 20.1 48.9 77 77 A T T 3 S- 0 0 50 2,-0.3 -1,-0.3 -56,-0.1 39,-0.1 0.559 109.7-129.3 -83.4 -4.9 9.3 17.5 49.3 78 78 A K S < S+ 0 0 17 -3,-2.2 38,-2.2 1,-0.2 2,-0.3 0.764 83.3 95.0 55.5 32.1 11.6 20.5 50.1 79 79 A R + 0 0 15 36,-0.2 2,-0.3 -58,-0.1 -2,-0.3 -0.982 53.6 178.1-152.2 131.5 13.9 19.1 47.4 80 80 A V E - G 0 113B 1 33,-1.0 33,-1.6 -2,-0.3 2,-0.4 -0.988 22.7-164.5-145.7 140.1 13.9 20.2 43.8 81 81 A K E +EG 42 112B 43 -39,-2.2 -39,-2.4 -2,-0.3 2,-0.3 -0.998 29.7 177.3-116.5 128.3 15.8 19.5 40.7 82 82 A Y E -EG 41 111B 1 29,-3.1 29,-2.5 -2,-0.4 2,-0.3 -0.875 21.0-164.4-130.4 166.6 15.1 22.2 38.0 83 83 A V E -E 40 0B 4 -43,-1.9 -43,-2.4 -2,-0.3 2,-0.5 -0.978 21.4-128.7-144.3 141.1 16.2 23.1 34.5 84 84 A F E -EH 39 96B 0 12,-2.9 12,-2.4 -2,-0.3 2,-0.5 -0.820 10.0-158.0 -89.1 127.0 15.8 26.4 32.7 85 85 A L E -EH 38 95B 29 -47,-2.8 -47,-3.0 -2,-0.5 2,-0.5 -0.939 16.2-167.7 -92.4 132.3 14.2 26.7 29.2 86 86 A L E -EH 37 94B 0 8,-3.4 8,-1.5 -2,-0.5 2,-0.4 -0.937 6.3-168.4-129.2 105.3 15.4 30.0 27.6 87 87 A T E -EH 36 93B 33 -51,-1.7 -52,-2.9 -2,-0.5 -51,-1.3 -0.806 13.6-147.4 -93.2 138.3 13.7 31.3 24.5 88 88 A G - 0 0 3 4,-1.9 -54,-0.2 -2,-0.4 -55,-0.1 -0.415 33.1 -87.9-100.0 174.9 15.3 34.2 22.6 89 89 A P S S+ 0 0 84 0, 0.0 -55,-0.1 0, 0.0 -56,-0.1 0.715 125.4 40.3 -56.4 -26.3 13.8 37.1 20.6 90 90 A Q S S- 0 0 170 2,-0.0 -3,-0.0 0, 0.0 0, 0.0 0.869 127.2 -91.1 -88.5 -45.5 13.8 35.2 17.2 91 91 A G S S+ 0 0 49 1,-0.1 2,-0.0 0, 0.0 -4,-0.0 0.491 71.7 147.7 142.2 18.7 12.6 31.9 18.7 92 92 A E - 0 0 53 -5,-0.0 -4,-1.9 2,-0.0 2,-0.4 -0.372 30.9-159.2 -64.1 159.3 15.7 29.9 19.6 93 93 A A E +H 87 0B 50 -6,-0.2 2,-0.3 2,-0.0 -6,-0.2 -0.984 14.3 174.2-144.5 130.4 15.0 27.8 22.7 94 94 A V E -H 86 0B 20 -8,-1.5 -8,-3.4 -2,-0.4 2,-0.4 -0.965 23.7-133.9-138.1 156.1 17.8 26.4 24.9 95 95 A Y E -HI 85 102B 48 7,-3.0 7,-1.7 -2,-0.3 2,-0.4 -0.913 16.7-164.2-109.4 139.7 18.0 24.5 28.2 96 96 A F E +HI 84 101B 17 -12,-2.4 -12,-2.9 -2,-0.4 2,-0.2 -0.996 24.8 137.5-127.0 127.7 20.4 25.5 31.0 97 97 A G E > - I 0 100B 0 3,-2.0 3,-0.6 11,-0.6 14,-0.2 -0.807 68.6 -68.4-144.8-168.0 21.3 23.2 33.9 98 98 A E T 3 S+ 0 0 32 12,-1.6 11,-0.2 1,-0.2 13,-0.1 0.877 129.1 52.0 -63.7 -36.5 24.4 22.3 35.8 99 99 A T T 3 S- 0 0 74 9,-0.5 2,-0.4 1,-0.2 -1,-0.2 0.799 118.1-110.2 -75.1 -18.1 26.0 20.3 33.0 100 100 A G E < -I 97 0B 10 8,-2.2 -3,-2.0 -3,-0.6 2,-0.4 -0.993 51.5 -22.9 136.2-137.8 25.5 23.3 30.7 101 101 A F E +I 96 0B 45 -2,-0.4 2,-0.3 -5,-0.2 -5,-0.2 -0.912 52.0 154.7-122.7 137.9 23.3 24.3 27.7 102 102 A S E -I 95 0B 21 -7,-1.7 -7,-3.0 -2,-0.4 6,-0.1 -0.987 47.9-135.2-146.7 155.2 21.6 22.2 25.1 103 103 A A S S+ 0 0 84 -2,-0.3 2,-0.6 -9,-0.2 -1,-0.1 0.672 103.2 70.9 -71.6 -21.4 18.6 22.3 22.7 104 104 A E S >> S- 0 0 76 1,-0.2 3,-1.6 -9,-0.1 4,-0.8 -0.877 87.1-139.3 -96.9 124.7 18.1 18.8 24.2 105 105 A R H >> S+ 0 0 66 -2,-0.6 3,-2.3 1,-0.3 4,-1.1 0.893 93.6 53.3 -44.2 -58.3 16.9 18.9 27.8 106 106 A S H 34 S+ 0 0 87 1,-0.3 -1,-0.3 2,-0.2 4,-0.1 0.590 102.7 58.0 -71.9 -8.8 18.8 16.1 29.3 107 107 A K H <4 S+ 0 0 130 -3,-1.6 -1,-0.3 1,-0.1 -2,-0.2 0.691 99.0 60.1 -89.4 -19.7 22.2 17.4 28.1 108 108 A A H << S- 0 0 0 -3,-2.3 -8,-2.2 -4,-0.8 -11,-0.6 0.929 99.7-149.4 -74.2 -40.5 21.8 20.7 29.9 109 109 A G < - 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0 0 16 -2,-0.5 2,-0.4 -105,-0.4 243,-0.1 -0.405 39.8-169.6 -62.0 111.4 16.2 33.7 56.2 123 123 A T - 0 0 90 -2,-0.4 -1,-0.0 242,-0.3 -105,-0.0 -0.951 4.8-170.5-114.9 133.7 13.8 35.1 58.9 124 124 A T - 0 0 16 -2,-0.4 5,-0.1 226,-0.0 226,-0.1 -0.904 36.2 -87.6-128.3 140.4 13.7 38.8 59.8 125 125 A P >> - 0 0 6 0, 0.0 3,-1.1 0, 0.0 4,-0.6 -0.249 32.2-137.0 -51.7 126.3 11.8 40.6 62.7 126 126 A E G >4 S+ 0 0 93 1,-0.3 3,-2.3 2,-0.2 4,-0.4 0.946 104.1 55.6 -52.2 -48.3 8.2 41.5 61.6 127 127 A W G >4 S+ 0 0 28 1,-0.3 3,-1.1 2,-0.2 4,-0.3 0.730 96.3 65.5 -50.9 -34.5 8.6 44.9 63.1 128 128 A A G X4 S+ 0 0 8 -3,-1.1 3,-0.6 1,-0.3 -1,-0.3 0.727 90.0 67.6 -68.1 -21.0 11.7 45.6 61.0 129 129 A K G << S+ 0 0 60 -3,-2.3 -1,-0.3 -4,-0.6 -2,-0.2 0.800 109.2 32.7 -74.9 -31.1 9.6 45.5 57.9 130 130 A E G < S+ 0 0 61 -3,-1.1 -1,-0.2 -4,-0.4 -2,-0.2 0.266 92.8 131.4-107.5 27.5 7.6 48.6 58.8 131 131 A A < - 0 0 1 -3,-0.6 2,-0.4 -4,-0.3 56,-0.1 -0.211 39.6-167.9 -82.8 154.8 10.3 50.6 60.6 132 132 A V - 0 0 0 317,-0.2 56,-2.6 54,-0.1 57,-0.8 -0.956 24.1-157.0-132.5 115.1 11.4 54.2 60.2 133 133 A I E -jk 189 451C 1 317,-2.7 319,-2.8 -2,-0.4 2,-0.5 -0.706 6.1-152.1-102.2 150.7 14.7 54.5 62.2 134 134 A Y E -jk 190 452C 0 55,-1.6 57,-2.0 -2,-0.3 2,-0.9 -0.932 11.9-140.2-129.1 107.2 16.1 57.8 63.5 135 135 A Q E -jk 191 453C 5 317,-2.4 319,-1.7 -2,-0.5 2,-0.6 -0.557 19.0-168.0 -71.4 105.9 19.9 58.1 63.9 136 136 A I E -j 192 0C 0 55,-2.0 57,-1.1 -2,-0.9 3,-0.1 -0.867 11.6-160.3 -93.4 125.1 20.4 60.0 67.1 137 137 A F >> - 0 0 26 -2,-0.6 3,-1.7 55,-0.2 4,-0.6 -0.932 21.4-148.1 -96.4 102.1 24.0 61.0 67.4 138 138 A P H >> S+ 0 0 4 0, 0.0 3,-1.0 0, 0.0 4,-0.7 0.778 84.7 56.5 -65.1 -41.1 23.8 61.5 71.3 139 139 A E H 34 S+ 0 0 8 1,-0.2 31,-2.4 2,-0.1 29,-0.3 0.744 118.4 36.3 -52.2 -26.7 26.2 64.4 72.1 140 140 A R H <4 S+ 0 0 15 -3,-1.7 332,-1.8 29,-0.1 -1,-0.2 0.516 100.3 75.0-111.3 -2.4 24.3 66.6 69.6 141 141 A F H << S- 0 0 0 -3,-1.0 2,-0.3 -4,-0.6 -2,-0.1 0.967 108.2 -24.3 -82.7 -51.5 20.7 65.7 70.0 142 142 A A < - 0 0 2 -4,-0.7 29,-2.7 29,-0.1 2,-0.7 -0.926 45.5-144.6-162.1 131.5 19.4 67.2 73.3 143 143 A N + 0 0 47 27,-0.3 27,-0.2 -2,-0.3 29,-0.1 -0.923 32.0 162.6 -97.7 97.4 21.2 68.2 76.5 144 144 A G + 0 0 25 -2,-0.7 -1,-0.1 1,-0.3 26,-0.1 0.361 67.1 37.6-102.9 4.4 18.6 67.3 79.1 145 145 A D > - 0 0 65 24,-0.3 3,-2.4 1,-0.0 4,-0.4 -0.628 62.5-167.6-157.9 83.8 20.8 67.3 82.2 146 146 A P T 3 S+ 0 0 91 0, 0.0 3,-0.2 0, 0.0 -2,-0.0 0.639 84.3 74.9 -59.0 -13.1 23.6 70.0 82.3 147 147 A S T 3 S+ 0 0 106 1,-0.2 0, 0.0 0, 0.0 0, 0.0 0.571 91.7 62.6 -67.2 -12.6 25.3 68.3 85.3 148 148 A N S < S+ 0 0 23 -3,-2.4 -1,-0.2 21,-0.1 69,-0.1 0.900 74.7 124.1 -71.5 -44.8 26.4 65.9 82.5 149 149 A D - 0 0 48 -4,-0.4 3,-0.1 -3,-0.2 67,-0.1 0.362 63.0-121.7 -47.1 133.4 28.4 68.3 80.4 150 150 A P > - 0 0 10 0, 0.0 3,-1.4 0, 0.0 2,-1.0 -0.435 48.3 -83.0 -70.5 146.6 32.1 67.6 79.6 151 151 A P T 3 S+ 0 0 141 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 -0.202 123.0 30.2 -62.4 98.5 34.5 70.3 80.9 152 152 A G T 3 S+ 0 0 53 -2,-1.0 15,-0.5 1,-0.1 2,-0.1 0.493 78.1 171.6 124.7 16.7 34.3 72.9 78.1 153 153 A T B < -r 167 0D 42 -3,-1.4 15,-0.2 13,-0.1 2,-0.2 -0.350 23.6-141.4 -52.2 124.5 30.8 72.4 76.8 154 154 A E - 0 0 71 13,-2.9 2,-0.2 1,-0.1 -1,-0.1 -0.531 27.4 -84.6 -84.3 168.7 29.8 75.1 74.3 155 155 A Q - 0 0 161 -2,-0.2 2,-1.1 1,-0.1 5,-0.1 -0.475 37.6-110.2 -86.4 137.3 26.5 76.8 74.1 156 156 A W + 0 0 78 -2,-0.2 2,-0.4 12,-0.2 -1,-0.1 -0.445 58.2 149.7 -74.5 97.4 23.5 75.4 72.1 157 157 A A > - 0 0 21 -2,-1.1 3,-0.5 1,-0.1 316,-0.0 -0.993 51.4-142.8-136.5 137.4 23.2 77.7 69.2 158 158 A K T 3 S+ 0 0 85 -2,-0.4 -1,-0.1 1,-0.3 315,-0.0 0.843 109.5 54.9 -63.1 -34.8 22.0 77.3 65.6 159 159 A D T 3 S+ 0 0 123 -3,-0.1 -1,-0.3 2,-0.1 -3,-0.1 0.843 86.7 106.1 -60.4 -35.5 24.7 79.7 64.6 160 160 A A < - 0 0 21 -3,-0.5 -4,-0.0 -5,-0.1 -6,-0.0 -0.078 54.6-160.7 -59.5 138.0 27.4 77.5 66.3 161 161 A R - 0 0 105 309,-0.1 2,-0.1 301,-0.0 306,-0.1 -0.993 23.5-125.0-119.1 120.7 29.6 75.5 64.0 162 162 A P - 0 0 12 0, 0.0 2,-0.2 0, 0.0 307,-0.1 -0.365 10.6-143.7 -76.3 142.5 31.3 72.6 65.9 163 163 A R > - 0 0 161 -2,-0.1 3,-0.7 1,-0.1 302,-0.0 -0.487 35.8-104.9 -83.4 167.7 35.0 71.9 66.1 164 164 A H T 3 S+ 0 0 116 1,-0.2 -1,-0.1 -2,-0.2 37,-0.0 0.812 125.6 40.5 -64.2 -26.7 36.1 68.3 66.1 165 165 A D T 3 S+ 0 0 108 2,-0.1 -1,-0.2 36,-0.0 0, 0.0 0.381 89.7 122.4-101.4 5.6 36.7 68.7 69.8 166 166 A S < - 0 0 5 -3,-0.7 2,-0.4 -13,-0.1 -13,-0.1 -0.264 44.6-155.8 -65.8 155.5 33.6 70.7 70.7 167 167 A F B +r 153 0D 34 -15,-0.5 -13,-2.9 1,-0.1 -4,-0.1 -0.934 20.9 174.4-126.9 141.9 31.1 69.6 73.3 168 168 A Y - 0 0 5 -2,-0.4 -12,-0.2 -29,-0.3 -19,-0.1 0.382 48.9-120.1-120.7 -12.9 27.5 70.6 73.4 169 169 A G + 0 0 0 1,-0.2 -24,-0.3 -21,-0.1 -20,-0.2 0.675 46.2 168.9 92.0 17.4 26.5 68.3 76.2 170 170 A G + 0 0 0 -31,-2.4 -27,-0.3 -27,-0.2 2,-0.3 -0.368 12.8 164.3 -66.6 157.8 23.8 66.1 74.6 171 171 A D > - 0 0 2 -29,-2.7 4,-1.5 -32,-0.1 3,-0.2 -0.902 51.8 -87.6-165.3 169.1 22.7 63.1 76.5 172 172 A L H > S+ 0 0 0 44,-1.6 4,-2.3 -2,-0.3 5,-0.1 0.879 119.1 58.2 -60.7 -38.8 20.3 60.2 77.2 173 173 A K H > S+ 0 0 71 43,-0.7 4,-1.5 1,-0.2 -1,-0.2 0.910 104.0 53.4 -65.9 -32.6 18.2 62.3 79.6 174 174 A G H > S+ 0 0 0 -32,-0.4 4,-2.1 1,-0.2 -1,-0.2 0.835 106.0 51.3 -71.7 -36.9 17.6 64.8 76.7 175 175 A V H X S+ 0 0 0 -4,-1.5 4,-1.2 -33,-0.3 -1,-0.2 0.938 105.4 57.7 -59.7 -45.1 16.4 62.0 74.4 176 176 A I H < S+ 0 0 27 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.846 111.1 43.3 -52.9 -37.6 14.0 61.1 77.3 177 177 A D H < S+ 0 0 74 -4,-1.5 -1,-0.2 1,-0.2 -2,-0.2 0.836 112.7 51.4 -75.4 -37.7 12.6 64.6 77.1 178 178 A R H >X S+ 0 0 86 -4,-2.1 3,-1.6 1,-0.2 4,-1.5 0.540 79.1 102.3 -80.0 -4.5 12.5 64.7 73.3 179 179 A L H 3X S+ 0 0 0 -4,-1.2 4,-2.2 1,-0.3 -1,-0.2 0.732 72.4 59.2 -53.1 -32.5 10.6 61.5 73.0 180 180 A P H 3> S+ 0 0 68 0, 0.0 4,-1.5 0, 0.0 -1,-0.3 0.795 106.3 51.4 -69.7 -21.6 7.1 63.1 72.3 181 181 A Y H <> S+ 0 0 16 -3,-1.6 4,-2.9 2,-0.2 -2,-0.2 0.876 109.4 48.7 -73.0 -41.7 8.8 64.7 69.2 182 182 A L H X>S+ 0 0 0 -4,-1.5 4,-2.0 1,-0.2 5,-1.3 0.919 113.7 46.4 -62.3 -43.1 10.1 61.3 68.1 183 183 A E H <5S+ 0 0 83 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.868 111.6 53.6 -62.3 -36.8 6.6 59.9 68.6 184 184 A E H <5S+ 0 0 73 -4,-1.5 -2,-0.2 1,-0.2 -3,-0.2 0.968 109.2 46.9 -59.3 -54.7 5.2 63.1 66.7 185 185 A L H <5S- 0 0 1 -4,-2.9 -1,-0.2 1,-0.1 -2,-0.2 0.869 114.0-127.4 -54.2 -42.2 7.4 62.5 63.8 186 186 A G T <5 + 0 0 21 -4,-2.0 -3,-0.2 -5,-0.2 -4,-0.1 0.553 46.3 161.9 106.5 14.5 6.3 58.9 63.9 187 187 A V < - 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0 0 14 -105,-0.5 2,-0.4 -2,-0.5 -1,-0.1 -0.342 38.6-171.6 -63.7 111.8 41.0 26.1 54.5 709 123 B T - 0 0 96 242,-0.4 -1,-0.1 -2,-0.3 242,-0.0 -0.868 7.2-176.7-109.3 143.7 43.1 23.4 56.1 710 124 B T - 0 0 9 -2,-0.4 5,-0.1 226,-0.0 226,-0.1 -0.992 41.2 -86.9-142.3 135.3 43.0 19.8 55.1 711 125 B P > - 0 0 7 0, 0.0 4,-0.6 0, 0.0 3,-0.4 -0.029 32.0-130.7 -53.3 144.9 45.0 16.9 56.8 712 126 B E T >4 S+ 0 0 97 1,-0.3 3,-1.3 2,-0.2 4,-0.3 0.897 106.8 54.2 -66.0 -43.5 48.5 16.4 55.5 713 127 B W G >4 S+ 0 0 28 1,-0.2 3,-1.5 2,-0.2 -1,-0.3 0.841 100.8 61.8 -57.5 -33.4 48.2 12.7 55.0 714 128 B A G 34 S+ 0 0 6 -3,-0.4 3,-0.5 1,-0.3 -1,-0.2 0.728 93.6 67.1 -65.5 -19.8 45.0 13.3 52.9 715 129 B K G << S+ 0 0 61 -3,-1.3 -1,-0.3 -4,-0.6 -2,-0.2 0.613 113.0 26.5 -78.0 -17.7 47.3 15.2 50.5 716 130 B E S < S+ 0 0 65 -3,-1.5 -1,-0.2 -4,-0.3 -2,-0.2 0.066 92.6 136.1-135.7 31.5 49.1 12.0 49.5 717 131 B A - 0 0 2 -3,-0.5 2,-0.4 -4,-0.2 56,-0.1 -0.378 37.2-169.1 -72.4 142.8 46.6 9.4 50.1 718 132 B V - 0 0 0 317,-0.2 56,-2.8 -2,-0.1 57,-1.0 -0.961 26.5-159.0-118.6 125.0 45.7 6.5 47.9 719 133 B I E -no 7751037O 0 317,-2.5 319,-2.7 -2,-0.4 2,-0.4 -0.644 9.5-151.5-102.5 161.2 42.4 5.2 49.4 720 134 B Y E -no 7761038O 0 55,-1.2 57,-1.9 -2,-0.2 2,-0.9 -0.934 14.1-136.7-137.9 109.3 40.9 1.6 49.0 721 135 B Q E -no 7771039O 3 317,-2.8 319,-1.2 -2,-0.4 2,-0.8 -0.523 20.6-161.5 -69.6 106.6 37.1 1.1 49.3 722 136 B I E -n 778 0O 0 55,-2.1 57,-1.1 -2,-0.9 3,-0.1 -0.808 7.5-162.1 -96.7 113.4 36.7 -2.0 51.4 723 137 B F > - 0 0 25 -2,-0.8 3,-0.7 55,-0.2 4,-0.4 -0.910 14.3-152.9 -90.6 113.4 33.3 -3.4 50.9 724 138 B P G >> S+ 0 0 3 0, 0.0 3,-2.6 0, 0.0 4,-0.7 0.954 84.0 55.1 -62.8 -54.5 33.3 -5.6 54.0 725 139 B E G 34 S+ 0 0 10 1,-0.3 31,-1.3 2,-0.1 29,-0.4 0.667 119.0 33.2 -56.1 -22.9 30.8 -8.4 53.0 726 140 B R G <4 S+ 0 0 17 -3,-0.7 332,-2.2 29,-0.1 -1,-0.3 0.362 99.8 82.7-114.8 9.9 32.8 -9.2 49.8 727 141 B F T <4 S- 0 0 0 -3,-2.6 2,-0.3 -4,-0.4 -2,-0.1 0.983 105.1 -36.9 -85.6 -58.1 36.4 -8.5 51.0 728 142 B A < - 0 0 0 -4,-0.7 29,-2.3 29,-0.2 2,-0.6 -0.891 46.3-132.5-159.7 131.0 37.6 -11.6 52.8 729 143 B N + 0 0 50 27,-0.3 27,-0.2 -2,-0.3 26,-0.1 -0.858 38.2 158.5 -80.8 124.6 35.8 -14.0 55.1 730 144 B G + 0 0 15 -2,-0.6 -1,-0.1 25,-0.4 26,-0.1 0.416 64.9 36.1-125.3 -4.8 38.2 -14.4 58.0 731 145 B D > - 0 0 58 24,-0.4 3,-0.7 72,-0.0 4,-0.4 -0.867 59.6-170.1-139.8 107.1 35.9 -15.6 60.9 732 146 B P T 3 S+ 0 0 94 0, 0.0 24,-0.0 0, 0.0 -3,-0.0 0.087 76.8 80.1 -82.7 24.6 33.1 -18.0 59.9 733 147 B S T 3 S+ 0 0 104 1,-0.1 68,-0.0 68,-0.0 0, 0.0 0.716 94.8 47.8 -89.9 -26.0 31.5 -17.8 63.3 734 148 B N S < S+ 0 0 22 -3,-0.7 21,-0.1 21,-0.1 69,-0.1 0.750 81.9 124.1 -79.5 -30.9 29.9 -14.5 62.2 735 149 B D - 0 0 41 -4,-0.4 3,-0.1 20,-0.2 4,-0.1 -0.008 61.3-125.0 -43.5 120.7 28.6 -15.7 58.9 736 150 B P > - 0 0 18 0, 0.0 3,-1.2 0, 0.0 2,-0.6 -0.234 40.2 -78.3 -67.8 158.5 24.9 -15.2 58.4 737 151 B P T 3 S+ 0 0 134 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 -0.396 117.7 27.7 -69.5 106.6 22.6 -18.1 57.5 738 152 B G T 3 S+ 0 0 55 -2,-0.6 15,-0.6 1,-0.2 2,-0.2 0.663 73.5 165.2 117.9 22.2 22.9 -18.8 53.8 739 153 B T B < -v 753 0P 45 -3,-1.2 15,-0.2 13,-0.1 -1,-0.2 -0.507 28.7-140.4 -53.8 125.0 26.4 -17.7 53.0 740 154 B E - 0 0 58 13,-2.8 2,-0.2 -2,-0.2 -1,-0.1 -0.316 31.2 -86.0 -77.8 174.7 27.5 -19.0 49.6 741 155 B Q - 0 0 175 -2,-0.1 2,-0.9 1,-0.1 -1,-0.1 -0.510 43.0-100.2 -82.8 161.0 31.1 -20.3 49.1 742 156 B W + 0 0 78 -2,-0.2 2,-0.3 12,-0.1 -1,-0.1 -0.640 65.1 149.2 -83.8 106.5 34.0 -17.9 48.1 743 157 B A > - 0 0 29 -2,-0.9 3,-1.0 1,-0.1 316,-0.1 -0.998 52.9-139.5-150.2 140.4 34.3 -18.5 44.3 744 158 B K T 3 S+ 0 0 89 -2,-0.3 -1,-0.1 1,-0.3 315,-0.1 0.824 104.4 59.7 -69.7 -33.1 35.3 -16.6 41.2 745 159 B D T 3 S+ 0 0 126 2,-0.1 -1,-0.3 0, 0.0 0, 0.0 0.807 83.8 125.0 -62.1 -22.7 32.5 -18.1 39.1 746 160 B A < - 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