==== 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 03-SEP-08 3EDJ . COMPND 2 MOLECULE: CYCLOMALTODEXTRINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: FLAVOBACTERIUM SP. 92; . AUTHOR S.BUEDENBENDER,G.E.SCHULZ . 1194 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 42964.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 787 65.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 74 6.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 149 12.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.3 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 . 7 0.6 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 . 88 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 174 14.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 228 19.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 1.2 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 6 4 4 0 2 2 0 0 2 4 2 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 5 6 4 6 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 . 9 3 8 4 0 0 6 0 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 . 5 0 5 1 3 1 0 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 3 A P 0 0 98 0, 0.0 2,-0.3 0, 0.0 26,-0.0 0.000 360.0 360.0 360.0 149.1 85.4 50.4 10.3 2 4 A T - 0 0 118 25,-0.1 26,-0.0 2,-0.0 0, 0.0 -0.786 360.0 -56.2-112.4 137.6 85.4 47.3 8.1 3 5 A A S S- 0 0 55 -2,-0.3 2,-0.6 1,-0.1 25,-0.3 0.053 109.1 -17.8 47.7-136.8 83.5 44.0 7.8 4 6 A I - 0 0 35 79,-0.2 23,-0.3 1,-0.1 3,-0.1 -0.947 65.7-178.9-101.2 117.1 83.5 41.9 11.0 5 7 A E + 0 0 92 21,-2.3 2,-0.4 -2,-0.6 22,-0.2 0.839 66.4 16.4 -88.4 -39.7 86.4 43.3 13.1 6 8 A H E -A 26 0A 33 20,-2.1 20,-2.7 2,-0.0 2,-0.4 -1.000 54.2-177.4-135.2 140.2 86.2 40.9 16.1 7 9 A M E -A 25 0A 11 -2,-0.4 18,-0.2 18,-0.2 16,-0.0 -0.957 29.1-137.6-132.6 116.8 84.4 37.6 16.7 8 10 A E E S+A 24 0A 9 16,-2.1 16,-2.9 -2,-0.4 285,-0.1 -0.988 87.8 20.7-139.2 125.2 84.8 36.3 20.2 9 11 A P S S- 0 0 0 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 0.609 85.2-153.3 -69.0 153.2 85.3 33.6 21.0 10 12 A P S S- 0 0 30 0, 0.0 77,-0.4 0, 0.0 2,-0.3 0.630 74.0 -7.0 -75.2 -16.4 86.6 33.0 17.4 11 13 A F - 0 0 41 75,-0.1 2,-0.2 78,-0.0 77,-0.2 -0.936 68.5-163.2-165.5 168.2 85.8 29.3 17.4 12 14 A W E -d 88 0B 3 75,-2.5 77,-3.0 -2,-0.3 2,-0.3 -0.614 19.8 -96.9-143.0-160.1 84.5 26.7 20.0 13 15 A W E > -d 89 0B 9 75,-0.3 3,-0.5 -2,-0.2 2,-0.3 -0.960 18.8-125.0-133.8 145.0 84.2 23.0 20.7 14 16 A A T 3 S+ 0 0 10 75,-2.4 77,-0.3 -2,-0.3 53,-0.1 -0.626 93.4 32.6 -74.1 149.2 81.6 20.3 20.3 15 17 A G T 3 S+ 0 0 50 48,-0.3 -1,-0.2 -2,-0.3 2,-0.1 0.760 75.4 154.0 79.7 24.6 80.9 18.4 23.5 16 18 A M < - 0 0 10 -3,-0.5 -1,-0.2 2,-0.1 313,-0.1 -0.427 51.8-119.9 -76.8 162.0 81.4 21.1 26.2 17 19 A Q S S+ 0 0 119 -2,-0.1 2,-0.5 308,-0.1 -1,-0.1 0.957 102.4 55.7 -65.8 -50.1 79.6 20.7 29.5 18 20 A H S S- 0 0 71 1,-0.1 -2,-0.1 307,-0.1 -1,-0.1 -0.745 72.5-159.6 -87.5 124.9 77.7 24.0 29.2 19 21 A K + 0 0 65 -2,-0.5 43,-2.9 42,-0.1 -1,-0.1 0.801 61.2 94.4 -77.7 -29.7 75.7 24.0 25.9 20 22 A G E - B 0 61A 13 41,-0.2 2,-0.4 39,-0.0 41,-0.2 -0.306 48.6-177.8 -67.2 142.5 75.3 27.8 25.6 21 23 A L E - B 0 60A 4 39,-2.6 39,-3.2 2,-0.0 2,-0.6 -0.960 8.8-162.5-141.2 124.3 77.7 29.9 23.6 22 24 A Q E - B 0 59A 21 -2,-0.4 2,-0.4 37,-0.2 37,-0.2 -0.932 8.9-156.5-109.5 113.4 77.4 33.7 23.4 23 25 A L E - B 0 58A 0 35,-3.0 35,-2.7 -2,-0.6 2,-0.7 -0.738 3.8-153.2 -89.4 131.2 79.3 35.3 20.5 24 26 A M E -AB 8 57A 6 -16,-2.9 -16,-2.1 -2,-0.4 2,-0.4 -0.941 18.4-168.7-101.6 115.8 80.3 38.9 20.8 25 27 A V E -AB 7 56A 0 31,-3.2 31,-2.5 -2,-0.7 2,-0.4 -0.878 4.5-169.4-112.4 135.2 80.5 40.3 17.3 26 28 A H E +AB 6 55A 15 -20,-2.7 -21,-2.3 -2,-0.4 -20,-2.1 -0.991 27.8 113.8-131.5 128.2 82.0 43.7 16.5 27 29 A G S > S- 0 0 0 27,-1.8 3,-2.1 -2,-0.4 4,-0.4 -0.900 71.9 -61.8-177.3 160.5 82.0 45.6 13.2 28 30 A R T 3 S- 0 0 137 -25,-0.3 26,-0.2 1,-0.3 -25,-0.0 -0.351 120.0 -12.4 -58.8 123.6 80.5 48.8 11.8 29 31 A D T > S+ 0 0 45 -2,-0.1 3,-1.4 1,-0.1 -1,-0.3 0.642 89.7 138.1 56.9 22.1 76.7 48.6 12.0 30 32 A I G X + 0 0 2 -3,-2.1 3,-1.5 1,-0.3 24,-0.2 0.847 67.7 62.4 -63.9 -31.3 76.9 44.9 12.8 31 33 A G G 3 S+ 0 0 26 22,-2.4 -1,-0.3 -4,-0.4 23,-0.2 0.700 92.0 64.3 -63.2 -22.3 74.1 45.5 15.4 32 34 A R G < S+ 0 0 150 -3,-1.4 -1,-0.3 21,-0.6 46,-0.2 0.476 95.6 86.0 -78.2 -0.9 71.8 46.6 12.5 33 35 A M S < S- 0 0 12 -3,-1.5 2,-0.5 20,-0.2 44,-0.2 -0.536 70.8-132.0-108.3 165.6 72.0 43.1 11.2 34 36 A E E -E 76 0B 137 42,-2.0 42,-2.2 -2,-0.2 2,-0.2 -0.969 22.9-137.4-116.9 127.0 70.2 39.7 11.7 35 37 A A E +E 75 0B 15 -2,-0.5 2,-0.3 40,-0.2 40,-0.2 -0.518 22.7 178.0 -83.7 153.5 72.2 36.5 12.2 36 38 A A E +E 74 0B 54 38,-1.2 38,-3.2 -2,-0.2 2,-0.3 -0.984 3.9 165.3-152.5 145.1 71.3 33.2 10.5 37 39 A L - 0 0 38 -2,-0.3 2,-0.3 36,-0.2 7,-0.2 -0.981 22.1-153.6-156.6 161.8 72.9 29.7 10.5 38 40 A D + 0 0 146 34,-0.5 34,-0.2 -2,-0.3 5,-0.1 -0.807 37.5 131.6-144.1 98.9 72.2 26.1 9.6 39 41 A Y > - 0 0 38 3,-0.5 3,-2.2 -2,-0.3 32,-0.1 -0.950 58.7-104.7-151.4 126.1 74.1 23.3 11.4 40 42 A P T 3 S+ 0 0 103 0, 0.0 27,-0.5 0, 0.0 3,-0.1 -0.242 105.7 13.3 -55.6 131.3 72.7 20.1 13.0 41 43 A G T 3 S+ 0 0 18 1,-0.2 22,-3.1 25,-0.2 2,-0.5 0.254 102.8 104.3 89.2 -13.7 72.6 20.4 16.8 42 44 A V E < -C 62 0A 15 -3,-2.2 -3,-0.5 20,-0.2 2,-0.4 -0.919 51.2-167.2-104.2 126.0 73.3 24.1 16.9 43 45 A R E -C 61 0A 144 18,-2.4 18,-2.3 -2,-0.5 2,-0.7 -0.949 16.7-141.3-112.3 130.9 70.3 26.4 17.7 44 46 A L E -C 60 0A 48 -2,-0.4 16,-0.2 16,-0.2 -7,-0.1 -0.818 15.6-154.2 -89.6 114.4 70.3 30.2 17.2 45 47 A V - 0 0 60 14,-3.0 -1,-0.2 -2,-0.7 15,-0.1 0.885 39.0 -96.8 -62.6 -50.8 68.3 31.6 20.2 46 48 A S - 0 0 73 13,-0.3 -1,-0.1 2,-0.0 14,-0.0 -0.018 49.4 -69.8 128.0 130.6 67.0 34.9 18.8 47 49 A P - 0 0 82 0, 0.0 2,-0.5 0, 0.0 11,-0.1 0.086 28.3-170.0 -56.5 141.3 68.5 38.4 19.2 48 50 A T - 0 0 103 9,-0.5 9,-0.3 2,-0.0 -2,-0.0 -0.957 32.5-143.5-119.0 108.0 68.6 40.5 22.3 49 51 A R - 0 0 186 -2,-0.5 7,-0.1 7,-0.1 -18,-0.0 -0.282 12.5-152.9 -74.9 153.4 69.8 43.9 21.0 50 52 A V - 0 0 22 5,-0.3 5,-0.1 2,-0.2 184,-0.1 -0.926 28.1-119.3-115.4 148.8 72.1 46.4 22.5 51 53 A P S S+ 0 0 95 0, 0.0 2,-0.7 0, 0.0 183,-0.1 0.771 90.4 93.6 -58.1 -28.4 71.8 50.2 21.6 52 54 A N > - 0 0 32 181,-0.4 3,-1.6 1,-0.2 -2,-0.2 -0.583 65.1-156.8 -72.9 112.7 75.4 50.3 20.2 53 55 A A T 3 S+ 0 0 35 -2,-0.7 -22,-2.4 1,-0.3 -21,-0.6 0.567 86.6 66.4 -65.9 -8.7 75.1 49.6 16.4 54 56 A N T 3 S+ 0 0 36 -25,-0.2 -27,-1.8 -24,-0.2 2,-0.4 0.410 96.7 59.4 -96.3 3.5 78.7 48.4 16.3 55 57 A Y E < -B 26 0A 1 -3,-1.6 2,-0.4 -29,-0.2 -5,-0.3 -0.988 55.0-175.5-133.4 143.1 78.1 45.3 18.4 56 58 A L E -B 25 0A 15 -31,-2.5 -31,-3.2 -2,-0.4 2,-0.6 -0.994 13.0-152.9-135.8 128.5 76.0 42.2 18.1 57 59 A F E -B 24 0A 8 -2,-0.4 2,-0.6 -9,-0.3 -9,-0.5 -0.907 12.5-161.8 -99.7 120.9 75.6 39.4 20.7 58 60 A V E -B 23 0A 6 -35,-2.7 -35,-3.0 -2,-0.6 2,-0.6 -0.929 5.1-152.2-107.4 119.1 74.7 36.1 19.1 59 61 A D E +B 22 0A 34 -2,-0.6 -14,-3.0 -37,-0.2 -13,-0.3 -0.820 18.9 177.7 -97.1 116.6 73.2 33.4 21.4 60 62 A L E -BC 21 44A 4 -39,-3.2 -39,-2.6 -2,-0.6 2,-0.5 -0.864 22.3-153.9-116.0 146.6 73.8 29.8 20.4 61 63 A E E -BC 20 43A 79 -18,-2.3 -18,-2.4 -2,-0.3 2,-0.9 -0.984 12.1-159.3-118.1 117.2 72.8 26.5 22.1 62 64 A I E - C 0 42A 10 -43,-2.9 -20,-0.2 -2,-0.5 -46,-0.1 -0.852 16.6-148.7-100.9 100.8 75.2 23.8 21.0 63 65 A G > - 0 0 9 -22,-3.1 3,-1.8 -2,-0.9 -48,-0.3 -0.181 26.4-108.0 -66.5 161.5 73.4 20.5 21.8 64 66 A P T 3 S+ 0 0 103 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.708 119.9 63.0 -63.6 -16.2 75.1 17.3 22.7 65 67 A E T 3 S+ 0 0 120 -24,-0.2 2,-0.2 2,-0.1 -23,-0.1 0.621 76.4 111.1 -83.9 -12.4 74.2 16.1 19.2 66 68 A A < - 0 0 4 -3,-1.8 -51,-0.2 -25,-0.4 -25,-0.2 -0.434 57.5-151.2 -64.8 130.7 76.3 18.8 17.5 67 69 A Q - 0 0 120 -27,-0.5 21,-0.1 -2,-0.2 -2,-0.1 -0.646 26.6 -86.2-101.0 157.4 79.3 17.3 15.8 68 70 A P S S+ 0 0 60 0, 0.0 2,-0.3 0, 0.0 21,-0.2 -0.331 81.6 88.2 -56.4 146.8 82.8 18.8 15.1 69 71 A G E - F 0 88B 27 19,-2.4 19,-3.3 -3,-0.1 2,-0.3 -0.982 67.5 -82.7 157.7-158.5 82.8 20.8 11.9 70 72 A S E + F 0 87B 41 -2,-0.3 2,-0.3 17,-0.3 17,-0.2 -0.971 29.7 179.4-144.6 160.6 82.1 24.3 10.6 71 73 A F E - F 0 86B 6 15,-2.4 15,-3.5 -2,-0.3 2,-0.4 -0.989 29.8-105.5-157.8 149.9 79.3 26.5 9.5 72 74 A D E - F 0 85B 54 -2,-0.3 2,-0.6 13,-0.2 -34,-0.5 -0.651 17.5-155.4 -80.3 132.6 78.6 29.9 8.2 73 75 A I E - F 0 84B 0 11,-2.8 11,-1.6 -2,-0.4 2,-0.5 -0.956 20.0-158.3 -99.7 120.2 77.0 32.6 10.4 74 76 A V E -EF 36 83B 40 -38,-3.2 -38,-1.2 -2,-0.6 2,-0.5 -0.854 7.4-161.6-108.2 130.2 75.3 35.0 8.0 75 77 A F E -EF 35 82B 0 7,-3.9 7,-3.0 -2,-0.5 2,-0.4 -0.947 13.1-175.1-113.5 126.8 74.4 38.6 9.0 76 78 A K E +EF 34 81B 135 -42,-2.2 -42,-2.0 -2,-0.5 2,-0.2 -0.968 21.0 109.8-129.4 139.2 71.9 40.5 6.9 77 79 A G E > + F 0 80B 20 3,-2.5 3,-2.1 -2,-0.4 -44,-0.1 -0.869 61.2 34.8 170.4 158.4 70.6 44.1 6.9 78 80 A D T 3 S- 0 0 80 1,-0.3 3,-0.1 -2,-0.2 -45,-0.1 0.821 125.2 -63.7 52.0 38.3 70.5 47.4 5.0 79 81 A G T 3 S+ 0 0 96 1,-0.2 -1,-0.3 0, 0.0 2,-0.2 0.345 121.1 93.3 69.9 -6.6 70.6 45.5 1.7 80 82 A R E < - F 0 77B 82 -3,-2.1 -3,-2.5 2,-0.0 2,-0.3 -0.640 57.4-156.5-109.6 170.0 74.0 44.1 2.5 81 83 A S E - F 0 76B 67 -5,-0.2 2,-0.3 -2,-0.2 -5,-0.2 -0.994 3.0-162.9-148.4 142.2 75.2 40.8 4.2 82 84 A E E - F 0 75B 49 -7,-3.0 -7,-3.9 -2,-0.3 2,-0.3 -0.866 9.6-161.2-119.4 156.0 78.3 39.7 6.1 83 85 A R E - F 0 74B 151 -2,-0.3 2,-0.3 -9,-0.2 -9,-0.2 -0.978 9.6-168.5-136.7 154.8 79.5 36.1 6.9 84 86 A Y E - F 0 73B 63 -11,-1.6 -11,-2.8 -2,-0.3 2,-0.9 -0.987 24.5-131.5-140.9 129.4 81.8 34.3 9.3 85 87 A R E - F 0 72B 134 -2,-0.3 2,-0.5 -13,-0.2 -13,-0.2 -0.740 29.0-158.9 -82.3 106.1 83.0 30.6 9.1 86 88 A Y E - F 0 71B 0 -15,-3.5 -15,-2.4 -2,-0.9 2,-0.5 -0.762 3.4-156.5 -93.3 127.9 82.4 29.3 12.6 87 89 A R E - F 0 70B 156 -2,-0.5 -75,-2.5 -77,-0.4 2,-0.6 -0.877 12.4-162.8-108.9 130.1 84.3 26.2 13.6 88 90 A L E -dF 12 69B 1 -19,-3.3 -19,-2.4 -2,-0.5 -75,-0.3 -0.961 24.8-151.8-103.9 113.4 83.4 23.6 16.3 89 91 A L E -d 13 0B 38 -77,-3.0 -75,-2.4 -2,-0.6 2,-0.4 -0.442 15.9-111.4 -81.4 157.1 86.6 21.7 17.1 90 92 A A - 0 0 61 -77,-0.2 2,-0.2 -2,-0.1 -75,-0.1 -0.725 38.2-118.7 -80.4 138.1 86.8 18.1 18.3 91 93 A R - 0 0 46 -2,-0.4 3,-0.1 -77,-0.3 -1,-0.0 -0.544 27.9-105.5 -78.1 142.7 88.1 18.0 21.9 92 94 A E > - 0 0 158 -2,-0.2 3,-1.9 207,-0.2 4,-0.3 -0.271 49.9 -85.4 -58.1 150.4 91.4 16.2 22.7 93 95 A Q T 3 S+ 0 0 189 1,-0.3 -1,-0.1 2,-0.1 0, 0.0 -0.420 115.3 10.8 -62.6 129.1 91.0 12.8 24.4 94 96 A G T 3 S+ 0 0 50 -2,-0.1 4,-0.3 -3,-0.1 -1,-0.3 0.525 86.1 136.0 79.7 8.8 90.7 13.3 28.2 95 97 A S S X S+ 0 0 9 -3,-1.9 3,-1.6 1,-0.2 -2,-0.1 0.919 70.7 44.5 -52.7 -55.4 90.3 17.0 27.9 96 98 A A T 3 S+ 0 0 33 1,-0.3 236,-0.5 -4,-0.3 -1,-0.2 0.836 115.2 50.5 -62.9 -31.9 87.5 17.4 30.4 97 99 A Q T 3 S+ 0 0 99 -3,-0.2 -1,-0.3 233,-0.1 -2,-0.2 0.319 79.0 147.2 -89.5 5.9 89.2 15.1 32.9 98 100 A R < - 0 0 37 -3,-1.6 2,-0.6 -4,-0.3 234,-0.3 -0.102 51.6-118.7 -46.9 135.5 92.6 16.9 32.7 99 101 A Q - 0 0 132 232,-0.1 234,-0.2 234,-0.1 -1,-0.1 -0.693 27.1-146.4 -83.2 119.3 94.5 16.8 36.0 100 102 A G - 0 0 2 232,-2.5 205,-0.2 -2,-0.6 233,-0.1 -0.281 36.6 -75.2 -72.5 164.9 95.2 20.2 37.5 101 103 A F + 0 0 3 203,-1.1 -1,-0.2 233,-0.2 234,-0.1 -0.273 65.0 162.9 -60.4 147.4 98.2 21.0 39.5 102 104 A G > - 0 0 9 -3,-0.1 3,-2.4 232,-0.1 -1,-0.1 -0.799 51.4 -54.3-151.4-168.8 98.3 19.6 43.0 103 105 A P T 3 S+ 0 0 35 0, 0.0 340,-0.2 0, 0.0 411,-0.1 0.744 125.5 56.5 -53.4 -28.5 100.3 18.7 46.1 104 106 A G T 3 S+ 0 0 28 340,-0.1 2,-0.1 409,-0.1 405,-0.1 0.578 98.0 83.0 -79.4 -11.0 102.7 16.5 44.1 105 107 A D < - 0 0 33 -3,-2.4 2,-0.4 408,-0.1 55,-0.1 -0.451 61.2-155.3 -88.7 162.8 103.6 19.4 41.8 106 108 A A - 0 0 4 -2,-0.1 55,-2.6 338,-0.1 56,-1.3 -0.983 17.6-143.2-136.4 131.0 106.1 22.3 42.2 107 109 A I E -gh 162 446C 4 338,-2.8 340,-2.9 -2,-0.4 2,-0.5 -0.797 6.4-157.9-101.5 132.6 105.4 25.5 40.3 108 110 A Y E -gh 163 447C 0 54,-2.7 56,-2.5 -2,-0.4 2,-0.4 -0.946 16.4-154.5-107.4 123.0 108.2 27.7 38.7 109 111 A Q E +gh 164 448C 0 338,-2.9 340,-2.9 -2,-0.5 2,-0.3 -0.832 17.1 172.7-102.4 134.3 106.9 31.3 38.2 110 112 A I E -g 165 0C 2 54,-2.1 56,-2.1 -2,-0.4 3,-0.1 -0.929 35.4-133.4-127.3 159.4 108.4 33.6 35.5 111 113 A M >> - 0 0 6 -2,-0.3 3,-1.9 54,-0.2 4,-0.7 -0.987 27.6-144.1-102.7 115.3 107.6 37.0 34.0 112 114 A P H >> S+ 0 0 1 0, 0.0 3,-0.6 0, 0.0 4,-0.6 0.835 97.1 53.1 -53.7 -37.2 107.9 36.2 30.3 113 115 A D H 34 S+ 0 0 0 65,-0.4 30,-2.2 1,-0.2 28,-0.1 0.741 115.7 40.5 -68.0 -20.6 109.5 39.7 29.4 114 116 A R H <4 S+ 0 0 9 -3,-1.9 357,-2.5 28,-0.1 -1,-0.2 0.383 105.9 64.1-111.3 0.3 112.2 39.2 32.1 115 117 A F H << S- 0 0 2 -4,-0.7 2,-0.4 -3,-0.6 -2,-0.1 0.940 109.0 -13.2 -92.0 -70.0 113.1 35.5 31.7 116 118 A A < - 0 0 1 -4,-0.6 28,-2.7 28,-0.2 2,-1.1 -0.978 44.7-150.3-147.3 129.1 114.7 34.8 28.3 117 119 A N + 0 0 19 357,-3.2 359,-0.3 -2,-0.4 26,-0.2 -0.778 26.1 165.7 -98.8 87.8 114.9 36.7 25.0 118 120 A G S S+ 0 0 16 -2,-1.1 -1,-0.2 1,-0.3 25,-0.1 0.668 73.0 31.5 -79.2 -19.9 115.0 34.0 22.4 119 121 A D > - 0 0 39 23,-0.4 3,-1.4 -3,-0.1 -1,-0.3 -0.806 59.3-173.6-142.4 95.3 114.2 36.3 19.6 120 122 A P G > S+ 0 0 84 0, 0.0 3,-1.6 0, 0.0 4,-0.3 0.755 80.8 74.1 -59.6 -20.6 115.5 39.9 19.7 121 123 A 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164 A Q E -gi 107 212C 9 -56,-1.3 -54,-2.7 49,-0.3 2,-0.5 -0.988 63.3-149.8-147.5 144.4 104.4 23.4 36.4 163 165 A L E -gi 108 213C 0 49,-2.3 51,-3.0 -2,-0.3 -54,-0.2 -0.982 10.3-174.2-116.5 123.9 105.2 26.7 34.7 164 166 A W E -g 109 0C 5 -56,-2.5 -54,-2.1 -2,-0.5 2,-0.4 -0.928 6.8-175.9-116.5 101.9 103.3 29.8 35.7 165 167 A P E -g 110 0C 4 0, 0.0 51,-0.6 0, 0.0 -54,-0.2 -0.800 32.6-112.5 -90.9 141.4 104.1 32.9 33.5 166 168 A T S S- 0 0 1 -56,-2.1 14,-0.1 -2,-0.4 50,-0.1 -0.191 70.7 -46.4 -61.4 165.2 102.6 36.3 34.4 167 169 A P - 0 0 4 0, 0.0 -1,-0.2 0, 0.0 15,-0.1 -0.051 48.2-176.9 -56.1 138.2 100.1 37.3 31.6 168 170 A L + 0 0 13 48,-0.2 22,-3.1 -3,-0.2 25,-0.2 0.428 45.9 118.8-102.5 -6.3 101.2 37.0 28.0 169 171 A V E S-L 189 0D 14 20,-0.3 20,-0.3 1,-0.2 13,-0.1 -0.227 82.6 -70.4 -63.8 155.7 98.0 38.5 26.5 170 172 A E E +L 185 0D 21 18,-2.7 14,-3.1 15,-0.9 15,-0.9 -0.152 48.7 177.3 -54.0 131.1 98.3 41.7 24.5 171 173 A N + 0 0 2 12,-0.2 2,-2.0 13,-0.2 12,-0.1 -0.721 2.6 177.2-128.3 80.2 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-0.870 47.8-146.8-115.9 138.3 105.3 20.1 33.0 212 214 A G E -i 162 0C 1 -51,-2.3 -49,-2.3 -2,-0.4 2,-0.5 -0.493 18.7-127.6 -90.3 167.4 101.9 21.7 33.0 213 215 A L E -i 163 0C 1 89,-0.3 91,-2.5 -51,-0.2 92,-0.7 -0.985 16.6-163.5-124.3 122.4 101.2 25.3 32.0 214 216 A I E -m 305 0E 2 -51,-3.0 2,-0.3 -2,-0.5 92,-0.2 -0.934 12.3-146.3-109.1 120.3 99.3 27.6 34.4 215 217 A Q E -m 306 0E 16 90,-1.8 92,-2.7 -2,-0.5 2,-0.7 -0.675 8.6-134.5 -92.1 142.5 97.9 30.8 32.8 216 218 A D E -m 307 0E 5 -51,-0.6 2,-0.4 -2,-0.3 92,-0.2 -0.846 29.6-170.4 -96.1 114.5 97.7 34.0 34.8 217 219 A V E -m 308 0E 7 90,-2.8 92,-2.7 -2,-0.7 2,-0.5 -0.889 17.1-156.0-115.5 138.0 94.2 35.6 34.2 218 220 A V + 0 0 9 -2,-0.4 92,-0.1 90,-0.2 90,-0.0 -0.938 18.8 166.5-106.7 130.5 92.9 39.0 35.1 219 221 A L + 0 0 0 -2,-0.5 -1,-0.1 90,-0.4 60,-0.1 0.709 67.0 57.6-110.9 -32.2 89.2 39.2 35.5 220 222 A S S S+ 0 0 2 89,-0.2 59,-3.0 90,-0.1 2,-0.3 0.819 109.8 14.9 -73.4 -35.4 88.5 42.5 37.2 221 223 A H B -P 278 0F 4 57,-0.3 -38,-0.4 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424 426 A A T ><5S- 0 0 4 -4,-1.1 3,-1.2 -5,-0.3 -1,-0.3 0.151 123.2-107.7 -91.9 13.5 116.0 36.5 54.7 425 427 A G T < 5 - 0 0 58 -3,-2.0 -3,-0.2 1,-0.3 -2,-0.1 0.750 61.8 -72.1 69.1 27.2 118.6 39.3 55.3 426 428 A E T 3 - 0 0 35 -3,-1.2 4,-2.6 -6,-0.4 -1,-0.2 -0.875 36.6-164.4-101.9 105.8 121.6 35.0 55.3 428 430 A F H > S+ 0 0 37 -2,-0.8 4,-2.3 1,-0.2 -1,-0.2 0.878 86.8 53.5 -62.5 -40.1 122.2 31.8 53.4 429 431 A D H > S+ 0 0 60 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.915 112.9 42.9 -62.9 -42.7 121.7 29.6 56.4 430 432 A R H > S+ 0 0 16 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.908 109.9 57.3 -71.1 -36.6 118.3 31.1 57.2 431 433 A W H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.902 101.9 57.0 -56.5 -42.4 117.4 31.1 53.5 432 434 A R H X S+ 0 0 57 -4,-2.3 4,-2.9 1,-0.2 -1,-0.2 0.893 103.0 54.1 -56.5 -41.0 118.0 27.3 53.6 433 435 A M H X S+ 0 0 0 -4,-1.3 4,-2.6 1,-0.2 -1,-0.2 0.916 108.1 49.1 -59.9 -44.7 115.4 27.1 56.3 434 436 A N H X S+ 0 0 11 -4,-1.8 4,-2.7 2,-0.2 -2,-0.2 0.917 112.6 48.2 -59.2 -39.5 112.8 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