==== 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 3EDF . 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) . 42824.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 788 66.0 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 . 4 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 . 91 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 173 14.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 226 18.9 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 2 0 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 0 114 0, 0.0 27,-0.1 0, 0.0 4,-0.0 0.000 360.0 360.0 360.0-168.6 86.0 49.7 9.1 2 4 A T - 0 0 105 25,-0.1 26,-0.6 1,-0.1 3,-0.3 -0.160 360.0-113.1 -47.0 138.3 86.6 46.0 8.3 3 5 A A S S+ 0 0 41 1,-0.3 2,-0.6 24,-0.1 25,-0.2 0.895 104.1 11.3 -46.5 -76.1 83.3 44.1 7.9 4 6 A I S S+ 0 0 30 1,-0.1 -1,-0.3 23,-0.1 23,-0.3 -0.952 73.1 176.8-102.0 115.2 83.7 41.8 11.0 5 7 A E + 0 0 88 21,-2.4 2,-0.4 -2,-0.6 22,-0.2 0.828 67.1 15.9 -88.0 -39.3 86.5 43.2 13.0 6 8 A H E -A 26 0A 34 20,-2.1 20,-2.6 2,-0.0 2,-0.4 -1.000 54.3-175.3-137.3 139.2 86.3 40.8 16.0 7 9 A M E -A 25 0A 10 -2,-0.4 18,-0.2 18,-0.2 16,-0.0 -0.971 28.8-137.7-129.1 117.0 84.6 37.5 16.5 8 10 A E E S+A 24 0A 10 16,-2.1 16,-2.9 -2,-0.4 285,-0.1 -0.982 88.1 20.1-137.3 125.4 84.9 36.2 20.1 9 11 A P S S- 0 0 0 0, 0.0 -1,-0.2 0, 0.0 3,-0.1 0.610 85.6-153.7 -66.5 152.1 85.4 33.4 20.9 10 12 A P S S- 0 0 30 0, 0.0 77,-0.4 0, 0.0 2,-0.3 0.666 74.0 -5.0 -75.5 -17.6 86.8 32.9 17.3 11 13 A F - 0 0 40 75,-0.1 2,-0.2 78,-0.0 77,-0.2 -0.934 68.9-163.5-161.1 167.1 86.0 29.2 17.3 12 14 A W E -d 88 0B 3 75,-2.5 77,-2.9 -2,-0.3 2,-0.3 -0.617 19.6 -99.8-139.2-158.7 84.6 26.7 19.9 13 15 A W E > -d 89 0B 9 75,-0.3 3,-0.6 -2,-0.2 2,-0.2 -0.969 18.9-121.8-134.9 146.9 84.4 22.9 20.6 14 16 A A T 3 S+ 0 0 10 75,-2.5 77,-0.3 -2,-0.3 53,-0.1 -0.577 93.8 29.7 -72.4 148.3 81.9 20.2 20.2 15 17 A G T 3 S+ 0 0 48 48,-0.3 -1,-0.2 -2,-0.2 2,-0.1 0.743 75.2 154.8 77.9 24.4 81.1 18.3 23.5 16 18 A M < - 0 0 9 -3,-0.6 -1,-0.2 2,-0.2 313,-0.0 -0.349 51.9-117.9 -73.5 166.2 81.6 21.0 26.2 17 19 A Q S S+ 0 0 118 308,-0.1 2,-0.5 1,-0.1 -1,-0.1 0.946 102.6 56.0 -69.9 -48.6 79.8 20.7 29.5 18 20 A H S S- 0 0 71 1,-0.1 -2,-0.2 307,-0.1 -1,-0.1 -0.747 72.5-158.5 -88.7 125.6 77.9 23.9 29.1 19 21 A K + 0 0 65 -2,-0.5 43,-2.7 42,-0.1 -1,-0.1 0.825 62.0 92.2 -76.0 -31.3 75.9 23.9 25.9 20 22 A G E - B 0 61A 12 41,-0.2 2,-0.4 39,-0.0 41,-0.2 -0.280 49.0-177.7 -71.3 144.3 75.4 27.7 25.5 21 23 A L E - B 0 60A 4 39,-2.6 39,-3.2 2,-0.0 2,-0.6 -0.957 9.1-161.6-141.2 124.9 77.8 29.8 23.5 22 24 A Q E - B 0 59A 19 -2,-0.4 2,-0.4 37,-0.2 37,-0.2 -0.935 9.7-155.2-110.0 116.5 77.5 33.6 23.3 23 25 A L E - B 0 58A 0 35,-3.2 35,-2.4 -2,-0.6 2,-0.7 -0.746 3.4-152.8 -91.7 134.2 79.4 35.2 20.4 24 26 A M E -AB 8 57A 5 -16,-2.9 -16,-2.1 -2,-0.4 2,-0.4 -0.944 18.2-169.1-106.0 113.9 80.4 38.8 20.7 25 27 A V E -AB 7 56A 0 31,-3.2 31,-2.4 -2,-0.7 2,-0.4 -0.870 3.8-169.5-109.9 134.9 80.6 40.2 17.1 26 28 A H E +AB 6 55A 19 -20,-2.6 -21,-2.4 -2,-0.4 -20,-2.1 -0.994 28.2 110.4-131.1 130.5 82.2 43.6 16.4 27 29 A G S > S- 0 0 0 27,-2.1 3,-2.2 -2,-0.4 4,-0.4 -0.875 72.8 -58.1 176.8 161.4 82.1 45.5 13.2 28 30 A R T 3 S- 0 0 146 -26,-0.6 26,-0.2 1,-0.3 -2,-0.0 -0.340 119.7 -14.7 -58.4 121.5 80.6 48.7 11.7 29 31 A D T > S+ 0 0 42 -2,-0.1 3,-1.3 1,-0.1 -1,-0.3 0.635 89.2 138.3 55.7 22.6 76.8 48.4 11.9 30 32 A I G X + 0 0 2 -3,-2.2 3,-1.7 1,-0.3 24,-0.2 0.870 69.4 61.0 -60.6 -32.7 77.0 44.7 12.7 31 33 A G G 3 S+ 0 0 25 22,-2.4 -1,-0.3 -4,-0.4 23,-0.2 0.720 92.7 64.1 -64.6 -23.7 74.2 45.4 15.2 32 34 A R G < S+ 0 0 149 -3,-1.3 -1,-0.3 21,-0.7 46,-0.2 0.511 97.2 84.4 -74.4 -4.1 72.0 46.6 12.4 33 35 A M S < S- 0 0 13 -3,-1.7 2,-0.4 -4,-0.2 44,-0.2 -0.422 71.4-131.7-104.7 171.5 72.1 43.0 11.1 34 36 A E E -E 76 0B 133 42,-1.8 42,-2.4 -2,-0.1 2,-0.2 -0.991 22.1-138.9-124.7 126.8 70.4 39.6 11.6 35 37 A A E +E 75 0B 14 -2,-0.4 2,-0.3 40,-0.2 40,-0.2 -0.542 22.0 176.1 -85.9 152.2 72.3 36.4 12.0 36 38 A A E +E 74 0B 55 38,-1.4 38,-3.0 -2,-0.2 2,-0.3 -0.985 2.7 166.1-151.3 147.9 71.5 33.0 10.5 37 39 A L - 0 0 37 -2,-0.3 2,-0.3 36,-0.2 7,-0.2 -0.980 22.0-152.1-156.5 164.8 73.1 29.6 10.4 38 40 A D + 0 0 150 34,-0.5 34,-0.2 -2,-0.3 5,-0.1 -0.838 37.6 131.6-146.0 101.4 72.4 25.9 9.5 39 41 A Y > - 0 0 38 3,-0.5 3,-2.1 -2,-0.3 32,-0.1 -0.934 58.3-105.9-154.4 125.1 74.3 23.1 11.3 40 42 A P T 3 S+ 0 0 103 0, 0.0 27,-0.5 0, 0.0 3,-0.1 -0.253 105.3 15.8 -56.4 133.2 72.8 20.0 12.9 41 43 A G T 3 S+ 0 0 17 1,-0.2 22,-3.4 25,-0.2 2,-0.5 0.299 102.9 103.9 88.8 -10.2 72.9 20.2 16.7 42 44 A V E < -C 62 0A 16 -3,-2.1 -3,-0.5 20,-0.2 2,-0.5 -0.933 51.3-166.6-108.4 125.3 73.4 24.0 16.8 43 45 A R E -C 61 0A 143 18,-2.5 18,-2.1 -2,-0.5 2,-0.6 -0.946 15.4-143.3-109.9 128.3 70.4 26.3 17.6 44 46 A L E -C 60 0A 53 -2,-0.5 16,-0.2 16,-0.2 -7,-0.1 -0.805 15.1-154.7 -87.3 118.4 70.4 30.1 17.1 45 47 A V - 0 0 54 14,-3.1 -1,-0.1 -2,-0.6 15,-0.1 0.907 38.5 -95.7 -68.0 -50.2 68.4 31.5 20.0 46 48 A S - 0 0 70 13,-0.3 -1,-0.1 2,-0.0 14,-0.0 0.053 49.5 -71.7 127.2 127.9 67.1 34.8 18.6 47 49 A P - 0 0 78 0, 0.0 2,-0.5 0, 0.0 11,-0.1 0.078 28.9-169.3 -59.9 137.9 68.6 38.3 19.0 48 50 A T - 0 0 100 9,-0.5 9,-0.4 2,-0.0 2,-0.1 -0.982 33.2-143.7-112.8 110.4 68.7 40.3 22.2 49 51 A R - 0 0 175 -2,-0.5 7,-0.1 7,-0.1 -18,-0.0 -0.346 13.6-152.0 -82.5 154.5 69.9 43.7 20.8 50 52 A V - 0 0 22 5,-0.3 5,-0.2 2,-0.2 184,-0.1 -0.919 28.1-118.5-115.0 149.2 72.2 46.3 22.3 51 53 A P S S+ 0 0 102 0, 0.0 2,-0.7 0, 0.0 183,-0.1 0.784 90.7 93.0 -56.7 -30.8 71.9 50.1 21.4 52 54 A N > - 0 0 30 181,-0.4 3,-1.6 1,-0.2 -2,-0.2 -0.564 65.3-156.8 -72.0 111.1 75.5 50.1 20.0 53 55 A A T 3 S+ 0 0 34 -2,-0.7 -22,-2.4 1,-0.3 -21,-0.7 0.577 86.3 67.2 -62.2 -10.5 75.1 49.5 16.2 54 56 A N T 3 S+ 0 0 36 -25,-0.2 -27,-2.1 -24,-0.2 2,-0.4 0.403 96.2 56.7 -94.7 4.7 78.8 48.2 16.2 55 57 A Y E < -B 26 0A 1 -3,-1.6 2,-0.4 -29,-0.2 -5,-0.3 -0.992 55.5-173.5-137.6 142.1 78.3 45.1 18.2 56 58 A L E -B 25 0A 11 -31,-2.4 -31,-3.2 -2,-0.4 2,-0.6 -0.997 12.5-152.4-134.3 130.7 76.0 42.1 18.0 57 59 A F E -B 24 0A 7 -2,-0.4 2,-0.6 -9,-0.4 -9,-0.5 -0.919 13.3-162.8-101.9 121.9 75.7 39.3 20.6 58 60 A V E -B 23 0A 6 -35,-2.4 -35,-3.2 -2,-0.6 2,-0.6 -0.940 5.7-150.9-110.4 118.9 74.7 36.0 19.0 59 61 A D E +B 22 0A 34 -2,-0.6 -14,-3.1 -37,-0.2 -13,-0.3 -0.805 18.8 179.1 -96.6 117.2 73.3 33.3 21.4 60 62 A L E -BC 21 44A 4 -39,-3.2 -39,-2.6 -2,-0.6 2,-0.5 -0.855 21.2-154.8-114.8 148.2 73.9 29.7 20.3 61 63 A E E -BC 20 43A 81 -18,-2.1 -18,-2.5 -2,-0.3 2,-0.9 -0.987 11.9-159.7-120.2 115.1 73.0 26.4 22.0 62 64 A I E - C 0 42A 9 -43,-2.7 -20,-0.2 -2,-0.5 -46,-0.1 -0.859 16.6-148.0 -99.3 103.8 75.3 23.7 21.0 63 65 A G > - 0 0 9 -22,-3.4 3,-1.9 -2,-0.9 -48,-0.3 -0.190 26.0-107.4 -69.5 161.6 73.5 20.4 21.7 64 66 A P T 3 S+ 0 0 100 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.724 120.0 62.0 -61.9 -17.4 75.3 17.2 22.7 65 67 A E T 3 S+ 0 0 122 -24,-0.2 2,-0.1 2,-0.1 -23,-0.1 0.632 76.6 111.6 -85.8 -11.2 74.4 15.9 19.2 66 68 A A < - 0 0 4 -3,-1.9 -51,-0.2 -25,-0.4 -25,-0.2 -0.410 56.9-151.5 -63.6 132.6 76.5 18.7 17.5 67 69 A Q - 0 0 119 -27,-0.5 21,-0.1 -2,-0.1 -2,-0.1 -0.683 26.8 -84.5-103.2 157.0 79.6 17.2 15.8 68 70 A P S S+ 0 0 60 0, 0.0 2,-0.3 0, 0.0 21,-0.2 -0.308 81.4 90.7 -54.3 144.2 83.0 18.7 15.1 69 71 A G E - F 0 88B 27 19,-2.2 19,-3.4 -3,-0.1 2,-0.3 -0.980 66.8 -85.6 161.0-159.7 83.0 20.7 11.8 70 72 A S E + F 0 87B 52 -2,-0.3 2,-0.3 17,-0.3 17,-0.2 -0.969 30.2 179.5-143.8 157.4 82.4 24.2 10.5 71 73 A F E - F 0 86B 9 15,-2.5 15,-3.2 -2,-0.3 2,-0.3 -0.992 29.5-106.1-156.7 148.0 79.5 26.3 9.4 72 74 A D E - F 0 85B 51 -2,-0.3 2,-0.6 13,-0.2 -34,-0.5 -0.595 18.0-156.3 -79.8 135.4 78.7 29.8 8.1 73 75 A I E - F 0 84B 0 11,-3.0 11,-2.1 -2,-0.3 2,-0.4 -0.980 19.1-159.2-103.9 123.7 77.1 32.4 10.3 74 76 A V E -EF 36 83B 43 -38,-3.0 -38,-1.4 -2,-0.6 2,-0.5 -0.893 7.7-161.4-112.2 131.4 75.4 34.9 7.9 75 77 A F E -EF 35 82B 0 7,-3.6 7,-3.0 -2,-0.4 2,-0.4 -0.951 14.8-177.2-115.8 126.8 74.5 38.5 8.9 76 78 A K E +EF 34 81B 130 -42,-2.4 -42,-1.8 -2,-0.5 2,-0.2 -0.956 20.9 101.7-130.9 144.5 72.0 40.4 6.8 77 79 A G E > + F 0 80B 23 3,-2.4 3,-2.4 -2,-0.4 -44,-0.1 -0.823 61.1 43.6 161.5 164.1 70.4 43.8 6.8 78 80 A D T 3 S- 0 0 78 1,-0.3 3,-0.1 -2,-0.2 -45,-0.1 0.842 126.1 -63.8 48.2 41.0 70.5 47.2 5.0 79 81 A G T 3 S+ 0 0 94 1,-0.2 -1,-0.3 0, 0.0 2,-0.2 0.431 119.9 96.8 66.8 -0.4 70.7 45.5 1.6 80 82 A R E < - F 0 77B 80 -3,-2.4 -3,-2.4 2,-0.0 2,-0.3 -0.676 55.2-157.8-115.0 169.1 74.1 44.0 2.6 81 83 A S E - F 0 76B 72 -5,-0.2 2,-0.3 -2,-0.2 -5,-0.2 -0.981 3.4-168.4-150.3 136.9 75.3 40.7 4.1 82 84 A E E - F 0 75B 41 -7,-3.0 -7,-3.6 -2,-0.3 2,-0.3 -0.850 8.3-161.3-119.2 155.9 78.4 39.5 6.0 83 85 A R E - F 0 74B 147 -2,-0.3 2,-0.4 -9,-0.2 -9,-0.2 -0.985 9.8-168.7-137.0 152.4 79.6 35.9 6.8 84 86 A Y E - F 0 73B 62 -11,-2.1 -11,-3.0 -2,-0.3 2,-0.9 -0.990 24.1-132.7-136.4 129.2 81.9 34.2 9.3 85 87 A R E - F 0 72B 124 -2,-0.4 2,-0.4 -13,-0.2 -13,-0.2 -0.756 28.2-158.4 -81.0 105.8 83.0 30.5 9.0 86 88 A Y E - F 0 71B 0 -15,-3.2 -15,-2.5 -2,-0.9 2,-0.4 -0.743 3.1-156.0 -93.0 128.9 82.6 29.2 12.5 87 89 A R E - F 0 70B 159 -2,-0.4 -75,-2.5 -77,-0.4 2,-0.6 -0.883 11.5-162.6-108.8 131.2 84.5 26.0 13.5 88 90 A L E -dF 12 69B 1 -19,-3.4 -19,-2.2 -2,-0.4 -75,-0.3 -0.970 24.8-151.2-104.7 112.0 83.6 23.5 16.3 89 91 A L E -d 13 0B 37 -77,-2.9 -75,-2.5 -2,-0.6 2,-0.4 -0.480 16.0-111.7 -79.0 156.2 86.8 21.6 17.0 90 92 A A - 0 0 61 -77,-0.2 2,-0.2 -2,-0.2 -75,-0.1 -0.711 39.1-117.3 -80.0 137.6 87.0 18.0 18.3 91 93 A R - 0 0 48 -2,-0.4 3,-0.1 -77,-0.3 -1,-0.0 -0.520 28.3-105.0 -75.6 142.0 88.3 17.9 21.9 92 94 A E > - 0 0 159 -2,-0.2 3,-1.9 207,-0.2 4,-0.3 -0.308 50.1 -86.9 -57.9 149.2 91.6 16.2 22.6 93 95 A Q T 3 S+ 0 0 191 1,-0.3 -1,-0.1 2,-0.1 0, 0.0 -0.419 115.6 13.3 -61.7 130.1 91.2 12.8 24.3 94 96 A G T 3 S+ 0 0 50 -2,-0.1 4,-0.3 -3,-0.1 -1,-0.3 0.528 85.8 136.4 81.6 9.7 91.0 13.2 28.1 95 97 A S S X S+ 0 0 9 -3,-1.9 3,-1.4 1,-0.2 -2,-0.1 0.920 71.0 42.8 -55.4 -53.8 90.4 17.0 27.8 96 98 A A T 3 S+ 0 0 33 1,-0.3 236,-0.5 -4,-0.3 -1,-0.2 0.826 115.5 51.0 -66.2 -31.5 87.6 17.4 30.4 97 99 A Q T 3 S+ 0 0 93 -3,-0.1 -1,-0.3 233,-0.1 -2,-0.2 0.323 78.3 146.5 -86.7 5.6 89.4 15.0 32.8 98 100 A R < - 0 0 37 -3,-1.4 2,-0.6 -4,-0.3 234,-0.3 -0.118 52.1-119.1 -48.3 136.7 92.8 16.9 32.7 99 101 A Q - 0 0 131 234,-0.1 234,-0.2 232,-0.1 -1,-0.1 -0.674 26.2-144.9 -83.7 118.1 94.6 16.7 36.0 100 102 A G - 0 0 2 232,-2.6 205,-0.2 -2,-0.6 233,-0.1 -0.270 36.8 -76.3 -68.0 163.2 95.3 20.2 37.5 101 103 A F + 0 0 3 203,-1.0 -1,-0.2 233,-0.2 234,-0.1 -0.290 65.3 163.9 -58.0 149.4 98.4 21.0 39.4 102 104 A G > - 0 0 9 -3,-0.1 3,-2.5 232,-0.1 305,-0.1 -0.809 51.1 -54.2-153.7-170.6 98.4 19.6 42.9 103 105 A P T 3 S+ 0 0 35 0, 0.0 340,-0.2 0, 0.0 411,-0.1 0.739 125.5 56.7 -53.0 -28.5 100.4 18.7 46.0 104 106 A G T 3 S+ 0 0 29 409,-0.1 2,-0.1 340,-0.1 405,-0.1 0.575 97.8 82.7 -78.5 -9.8 102.9 16.5 44.0 105 107 A D < - 0 0 33 -3,-2.5 2,-0.4 408,-0.1 55,-0.1 -0.477 61.7-154.4 -90.7 163.9 103.8 19.4 41.8 106 108 A A - 0 0 4 -2,-0.1 55,-2.6 338,-0.1 56,-1.3 -0.986 18.1-142.0-136.3 131.2 106.2 22.3 42.2 107 109 A I E -gh 162 446C 4 338,-2.8 340,-3.1 -2,-0.4 2,-0.5 -0.785 6.6-157.6-100.5 132.6 105.6 25.5 40.3 108 110 A Y E -gh 163 447C 0 54,-2.7 56,-2.7 -2,-0.4 2,-0.4 -0.944 16.1-155.5-106.7 120.0 108.3 27.7 38.6 109 111 A Q E +gh 164 448C 0 338,-3.0 340,-3.0 -2,-0.5 2,-0.3 -0.829 17.1 171.0 -99.9 133.3 107.1 31.3 38.1 110 112 A I E -g 165 0C 2 54,-2.1 56,-2.1 -2,-0.4 3,-0.1 -0.930 35.8-132.5-126.4 160.0 108.5 33.6 35.4 111 113 A M >> - 0 0 5 -2,-0.3 3,-1.7 54,-0.2 4,-0.7 -0.989 28.1-142.5-102.6 116.3 107.7 37.1 34.0 112 114 A P H >> S+ 0 0 1 0, 0.0 3,-0.7 0, 0.0 4,-0.6 0.849 97.5 52.7 -53.3 -37.9 108.0 36.3 30.2 113 115 A D H 34 S+ 0 0 0 65,-0.4 30,-2.1 1,-0.2 28,-0.1 0.734 115.6 41.2 -67.3 -22.8 109.6 39.7 29.4 114 116 A R H <4 S+ 0 0 10 -3,-1.7 357,-2.5 28,-0.1 -1,-0.2 0.357 105.4 64.3-108.9 2.2 112.3 39.2 32.1 115 117 A F H << S- 0 0 2 -3,-0.7 2,-0.3 -4,-0.7 -2,-0.1 0.938 109.1 -13.6 -94.3 -69.2 113.2 35.6 31.7 116 118 A A < - 0 0 1 -4,-0.6 28,-2.5 28,-0.2 2,-1.1 -0.960 44.9-149.4-147.7 127.8 114.8 34.8 28.2 117 119 A N + 0 0 19 357,-3.2 359,-0.3 -2,-0.3 26,-0.2 -0.751 27.0 165.3 -94.8 86.9 115.0 36.8 25.0 118 120 A G S S+ 0 0 16 -2,-1.1 -1,-0.2 1,-0.3 25,-0.1 0.658 73.4 30.7 -77.2 -18.1 115.1 34.0 22.4 119 121 A D > - 0 0 40 23,-0.4 3,-1.5 -3,-0.1 -1,-0.3 -0.810 59.7-174.1-144.2 94.4 114.3 36.3 19.5 120 122 A P G > S+ 0 0 88 0, 0.0 3,-1.5 0, 0.0 4,-0.3 0.735 80.1 75.4 -62.0 -16.4 115.6 39.9 19.7 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426 A A T ><5S- 0 0 4 -4,-1.2 3,-1.1 -5,-0.3 -1,-0.3 0.182 123.5-107.7 -90.8 13.5 116.1 36.5 54.6 425 427 A G T < 5 - 0 0 59 -3,-2.0 -3,-0.2 1,-0.3 -2,-0.1 0.762 61.4 -72.1 71.7 25.8 118.7 39.3 55.2 426 428 A E T 3 - 0 0 35 -3,-1.1 4,-2.7 -6,-0.4 -1,-0.2 -0.870 36.3-164.8-100.5 107.0 121.8 35.1 55.3 428 430 A F H > S+ 0 0 38 -2,-0.8 4,-2.3 1,-0.2 -1,-0.2 0.876 86.7 53.7 -63.3 -39.3 122.3 31.8 53.3 429 431 A D H > S+ 0 0 60 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.927 112.9 42.7 -64.4 -43.4 121.8 29.6 56.4 430 432 A R H > S+ 0 0 16 2,-0.2 4,-1.9 1,-0.2 -2,-0.2 0.898 109.8 57.6 -70.5 -35.6 118.4 31.2 57.1 431 433 A W H X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.914 101.8 57.0 -56.2 -41.7 117.5 31.1 53.4 432 434 A R H X S+ 0 0 56 -4,-2.3 4,-2.7 1,-0.2 -1,-0.2 0.903 103.5 53.2 -55.4 -42.9 118.1 27.3 53.5 433 435 A M H X S+ 0 0 0 -4,-1.3 4,-2.5 1,-0.2 -1,-0.2 0.925 108.4 49.7 -58.4 -44.7 115.5 27.1 56.3 434 436 A N H X S+ 0 0 10 -4,-1.9 4,-2.6 1,-0.2 -2,-0.2 0.923 112.4 48.0 -57.8 -44.3 113.0 29.0 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