==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER GLYCOSIDASE 01-JUN-94 1XNC . COMPND 2 MOLECULE: XYLANASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BACILLUS CIRCULANS; . AUTHOR R.L.CAMPBELL . 185 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7888.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 139 75.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 7 3.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 87 47.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 1.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.5 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 . 20 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 8 4.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 8 4.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.1 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 0 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 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 0 0 0 1 0 3 1 3 1 1 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 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 1 A A 0 0 85 0, 0.0 2,-0.4 0, 0.0 51,-0.1 0.000 360.0 360.0 360.0 160.7 33.5 43.0 21.6 2 2 A S - 0 0 109 183,-0.1 2,-0.2 21,-0.0 183,-0.1 -0.708 360.0-134.0 -85.9 138.2 36.4 43.1 24.0 3 3 A T - 0 0 26 -2,-0.4 39,-0.2 181,-0.2 3,-0.1 -0.611 20.1-175.7 -85.6 150.8 36.6 40.2 26.4 4 4 A D + 0 0 102 37,-2.4 2,-0.4 -2,-0.2 38,-0.2 0.216 56.9 74.9-132.4 10.6 37.2 41.2 30.0 5 5 A Y E -A 41 0A 68 36,-1.8 36,-2.1 162,-0.1 2,-0.5 -0.993 53.0-164.8-133.1 136.1 37.6 37.8 31.6 6 6 A W E -A 40 0A 65 -2,-0.4 2,-0.6 34,-0.2 34,-0.2 -0.982 9.6-163.2-119.8 117.7 40.4 35.3 31.6 7 7 A Q E +A 39 0A 14 32,-3.0 32,-2.3 -2,-0.5 2,-0.2 -0.905 20.3 158.6-104.2 121.6 39.6 31.8 32.9 8 8 A N E +A 38 0A 79 -2,-0.6 2,-0.4 30,-0.2 30,-0.2 -0.712 12.6 155.4-147.1 87.7 42.5 29.6 33.8 9 9 A W E +A 37 0A 92 28,-2.7 28,-2.5 -2,-0.2 2,-0.3 -0.953 9.1 168.1-120.3 137.9 41.6 26.7 36.1 10 10 A T E -A 36 0A 57 -2,-0.4 26,-0.2 26,-0.2 -2,-0.0 -0.984 37.9-136.2-143.1 146.9 43.4 23.4 36.6 11 11 A D - 0 0 85 24,-2.1 25,-0.1 -2,-0.3 -2,-0.0 0.359 61.9-100.9 -82.6 5.1 43.0 20.7 39.3 12 12 A G S S+ 0 0 61 1,-0.3 2,-0.3 23,-0.2 24,-0.1 0.266 78.5 134.9 98.3 -10.8 46.8 20.5 39.3 13 13 A G - 0 0 24 22,-0.3 21,-1.0 2,-0.1 -1,-0.3 -0.545 64.7 -31.7 -79.9 136.0 47.3 17.4 37.2 14 14 A G S S- 0 0 50 19,-0.3 2,-0.5 -2,-0.3 18,-0.2 -0.093 98.9 -34.0 63.0-154.3 49.9 17.3 34.5 15 15 A I E +H 31 0B 107 16,-2.5 16,-2.5 2,-0.0 2,-0.4 -0.899 48.3 173.1-112.7 127.4 51.0 20.3 32.4 16 16 A V E -H 30 0B 33 -2,-0.5 2,-1.0 14,-0.2 14,-0.2 -0.939 8.1-172.4-131.2 102.4 48.7 23.1 31.3 17 17 A N E -H 29 0B 81 12,-3.3 12,-1.7 -2,-0.4 2,-0.5 -0.845 13.6-179.0 -98.8 94.5 50.6 25.9 29.5 18 18 A A E -H 28 0B 23 -2,-1.0 2,-0.5 10,-0.2 10,-0.2 -0.868 10.5-159.4-100.3 128.5 47.9 28.6 29.1 19 19 A V E -H 27 0B 61 8,-2.9 8,-1.6 -2,-0.5 2,-1.1 -0.930 11.5-148.9-113.0 122.4 48.8 31.8 27.4 20 20 A N E -H 26 0B 90 -2,-0.5 6,-0.2 6,-0.2 3,-0.1 -0.790 33.7-170.5 -86.9 98.5 46.8 35.0 27.8 21 21 A G - 0 0 20 4,-1.4 2,-0.1 -2,-1.1 5,-0.0 -0.074 30.2 -62.7 -83.8-172.4 47.3 36.6 24.4 22 22 A S S > S- 0 0 108 2,-0.1 3,-2.2 4,-0.0 -1,-0.2 -0.405 100.1 -22.1 -71.7 146.2 46.5 40.0 23.0 23 23 A G T 3 S- 0 0 63 1,-0.3 162,-0.1 -3,-0.1 -21,-0.0 -0.262 132.4 -18.3 58.7-127.7 42.9 40.9 22.8 24 24 A G T 3 S+ 0 0 13 160,-0.1 160,-2.1 16,-0.1 2,-0.3 0.204 108.4 114.3 -98.4 17.4 40.6 37.9 22.8 25 25 A N E < + I 0 183B 36 -3,-2.2 -4,-1.4 158,-0.3 2,-0.3 -0.678 32.9 159.4 -93.3 141.2 43.3 35.5 21.8 26 26 A Y E -HI 20 182B 0 156,-2.5 156,-2.4 -2,-0.3 2,-0.3 -0.964 17.4-159.7-149.8 159.4 44.6 32.7 24.0 27 27 A S E -HI 19 181B 22 -8,-1.6 -8,-2.9 -2,-0.3 2,-0.3 -0.960 1.6-164.2-139.5 157.3 46.5 29.4 23.5 28 28 A V E -HI 18 180B 0 152,-2.3 152,-2.1 -2,-0.3 2,-0.5 -0.988 8.1-173.3-144.8 134.9 46.9 26.2 25.5 29 29 A N E +HI 17 179B 74 -12,-1.7 -12,-3.3 -2,-0.3 2,-0.3 -0.998 23.8 177.8-122.8 125.8 49.4 23.4 25.2 30 30 A W E -HI 16 178B 7 148,-2.7 148,-2.5 -2,-0.5 2,-0.3 -0.959 13.6-173.9-134.9 152.6 48.5 20.6 27.6 31 31 A S E -H 15 0B 37 -16,-2.5 -16,-2.5 -2,-0.3 146,-0.2 -0.968 64.6 -16.6-151.8 131.4 49.9 17.1 28.5 32 32 A N S S+ 0 0 130 -2,-0.3 145,-0.2 -18,-0.2 -16,-0.1 0.848 88.5 169.8 44.8 57.5 48.8 14.2 30.7 33 33 A T - 0 0 8 143,-1.8 -19,-0.3 1,-0.2 -1,-0.1 -0.123 41.1-140.5 -92.3 176.0 46.4 16.4 32.6 34 34 A G S S- 0 0 12 -21,-1.0 141,-1.9 1,-0.2 2,-0.4 0.219 72.1 -40.9 -97.8-124.1 43.7 15.9 35.2 35 35 A N E + B 0 174A 22 139,-0.2 -24,-2.1 -2,-0.1 2,-0.3 -0.848 69.3 162.2-109.4 139.0 40.7 18.3 34.4 36 36 A F E -AB 10 173A 0 137,-1.6 137,-1.9 -2,-0.4 2,-0.4 -0.981 22.6-158.3-150.7 157.3 41.3 22.0 33.4 37 37 A V E +AB 9 172A 2 -28,-2.5 -28,-2.7 -2,-0.3 2,-0.4 -0.973 15.2 174.2-142.6 122.1 39.3 24.8 31.7 38 38 A V E +AB 8 171A 0 133,-2.6 133,-2.8 -2,-0.4 2,-0.3 -0.989 19.4 120.8-130.0 135.8 40.9 27.7 29.9 39 39 A G E -AB 7 170A 0 -32,-2.3 -32,-3.0 -2,-0.4 2,-0.4 -0.988 45.8-115.2-179.5 169.0 39.2 30.4 28.0 40 40 A K E +AB 6 169A 7 129,-1.2 129,-2.5 -2,-0.3 2,-0.2 -0.935 52.1 99.6-120.7 151.0 38.4 34.1 27.4 41 41 A G E -AB 5 168A 0 -36,-2.1 -37,-2.4 -2,-0.4 -36,-1.8 -0.805 63.7 -26.3 178.5-134.5 35.1 35.8 27.6 42 42 A W E - B 0 167A 10 125,-2.8 125,-2.3 -2,-0.2 3,-0.1 -0.916 32.2-138.9-122.0 142.3 33.0 38.0 29.9 43 43 A T S S+ 0 0 69 -2,-0.4 2,-0.6 123,-0.2 -1,-0.1 0.858 100.2 38.9 -62.6 -37.3 32.9 38.4 33.7 44 44 A T S S- 0 0 92 122,-0.1 122,-0.2 123,-0.1 -1,-0.2 -0.956 85.7-144.0-120.4 112.5 29.1 38.6 33.7 45 45 A G - 0 0 6 120,-2.8 119,-0.1 -2,-0.6 121,-0.1 -0.282 11.6-157.6 -71.0 163.2 27.3 36.2 31.3 46 46 A S > - 0 0 34 1,-0.1 3,-1.0 -4,-0.0 100,-0.1 -0.999 24.5-139.9-143.0 141.4 24.2 37.1 29.4 47 47 A P T 3 S+ 0 0 32 0, 0.0 103,-0.2 0, 0.0 102,-0.1 0.626 106.8 55.6 -74.2 -10.8 21.4 35.0 27.8 48 48 A F T 3 S+ 0 0 159 98,-0.1 99,-0.1 99,-0.1 98,-0.0 0.439 80.5 122.7 -99.9 -0.2 21.4 37.6 25.0 49 49 A R < - 0 0 59 -3,-1.0 97,-1.4 96,-0.1 2,-0.6 -0.295 48.0-154.6 -70.6 143.5 25.1 37.3 24.0 50 50 A T E -J 145 0B 67 95,-0.2 2,-0.4 96,-0.1 95,-0.2 -0.989 17.9-155.8-114.6 116.1 26.3 36.4 20.6 51 51 A I E -J 144 0B 0 93,-2.6 93,-2.6 -2,-0.6 2,-0.4 -0.853 8.1-166.9 -98.8 131.5 29.7 34.9 20.8 52 52 A N E +J 143 0B 40 133,-2.7 133,-2.6 -2,-0.4 2,-0.3 -0.926 16.0 160.8-114.8 142.9 32.2 34.9 17.9 53 53 A Y E -JK 142 184B 4 89,-2.4 89,-3.3 -2,-0.4 2,-0.4 -0.989 28.0-157.0-156.2 160.4 35.3 32.9 17.8 54 54 A N E - K 0 183B 35 129,-1.9 129,-2.0 -2,-0.3 2,-1.0 -0.947 12.0-155.6-141.6 113.3 37.9 31.5 15.4 55 55 A A E - K 0 182B 0 85,-0.5 84,-0.9 -2,-0.4 127,-0.3 -0.839 12.3-179.5 -93.1 99.3 39.9 28.5 16.5 56 56 A G E S+ 0 0 52 125,-1.1 2,-0.4 -2,-1.0 -1,-0.2 0.761 77.3 27.5 -67.7 -29.2 43.1 28.7 14.5 57 57 A V E + K 0 181B 63 124,-1.8 124,-2.3 -3,-0.1 2,-0.3 -0.990 59.5 165.5-137.0 123.3 44.4 25.5 16.2 58 58 A W E + K 0 180B 35 -2,-0.4 122,-0.2 122,-0.2 80,-0.1 -0.829 20.2 147.9-136.0 95.9 42.1 22.7 17.5 59 59 A A E + K 0 179B 48 120,-2.8 120,-1.1 -2,-0.3 2,-0.3 -0.521 13.8 170.6-132.1 62.4 44.4 19.7 18.1 60 60 A P E - K 0 178B 24 0, 0.0 2,-0.3 0, 0.0 118,-0.3 -0.593 20.9-160.5 -77.8 140.8 43.3 17.6 21.0 61 61 A N E S- K 0 177B 134 116,-3.2 116,-0.7 -2,-0.3 2,-0.3 -0.580 76.0 -15.7-111.8 57.4 45.1 14.2 21.4 62 62 A G S S+ 0 0 12 -2,-0.3 25,-1.4 114,-0.2 2,-0.7 -0.985 120.5 4.7 146.0-150.4 42.3 12.7 23.5 63 63 A N S S+ 0 0 29 111,-0.4 111,-1.9 -2,-0.3 2,-0.3 -0.569 75.6 133.3 -76.3 110.9 39.4 14.0 25.5 64 64 A G E -C 173 0A 0 -2,-0.7 22,-1.3 109,-0.2 2,-0.4 -0.979 37.8-146.5-156.5 146.1 39.0 17.8 25.0 65 65 A Y E -CD 172 85A 24 107,-2.9 107,-2.1 -2,-0.3 2,-0.7 -0.946 8.2-156.8-121.2 140.0 36.1 20.1 24.3 66 66 A L E +CD 171 84A 0 18,-2.6 17,-2.1 -2,-0.4 18,-1.6 -0.962 50.3 144.7-108.6 107.7 36.0 23.4 22.3 67 67 A T E -CD 170 82A 0 103,-2.5 103,-3.0 -2,-0.7 2,-0.3 -0.982 61.6-109.7-152.9 152.4 32.9 24.9 23.9 68 68 A L E -CD 169 81A 0 13,-2.6 13,-1.8 -2,-0.3 2,-0.4 -0.690 50.2-171.4 -75.4 142.5 31.1 28.0 25.2 69 69 A Y E +CD 168 80A 9 99,-3.1 99,-3.2 -2,-0.3 2,-0.3 -0.999 16.0 135.5-145.8 138.8 31.2 27.5 29.0 70 70 A G E -CD 167 79A 0 9,-1.7 9,-2.8 -2,-0.4 2,-0.3 -0.985 31.4-127.9-168.6 176.8 29.7 29.3 31.9 71 71 A W E - D 0 78A 4 95,-1.5 94,-2.2 -2,-0.3 2,-0.3 -0.947 7.0-166.3-137.8 152.3 27.9 29.2 35.2 72 72 A T E > -CD 164 77A 0 5,-1.9 5,-2.2 -2,-0.3 2,-0.3 -0.927 14.8-145.9-128.8 158.0 24.8 30.6 36.9 73 73 A R E 5 +C 163 0A 68 90,-2.8 90,-2.1 -2,-0.3 89,-0.3 -0.817 68.0 66.3-117.5 158.5 24.1 30.6 40.6 74 74 A S T 5S+ 0 0 85 -2,-0.3 88,-2.2 87,-0.2 -1,-0.2 0.955 127.1 21.5 53.9 66.1 20.6 30.2 42.2 75 75 A P T 5S- 0 0 77 0, 0.0 2,-0.5 0, 0.0 86,-0.3 0.557 107.5-125.6 -91.9 169.4 20.6 27.6 41.1 76 76 A L T 5 + 0 0 38 -3,-0.2 50,-0.9 48,-0.1 2,-0.4 -0.582 42.1 164.9 -71.1 115.6 24.1 26.5 40.5 77 77 A I E < -De 72 126A 4 -5,-2.2 -5,-1.9 -2,-0.5 2,-0.5 -1.000 28.6-156.9-140.0 133.6 24.4 25.3 36.9 78 78 A E E -De 71 127A 13 48,-1.8 50,-1.7 -2,-0.4 2,-0.3 -0.959 26.3-167.3-107.4 122.1 27.4 24.7 34.7 79 79 A Y E -De 70 128A 0 -9,-2.8 -9,-1.7 -2,-0.5 2,-0.3 -0.869 10.6-168.4-119.0 159.7 26.5 25.0 31.0 80 80 A Y E -De 69 129A 3 48,-2.4 50,-1.1 -2,-0.3 2,-0.4 -0.980 21.2-169.0-143.9 144.8 28.0 24.1 27.7 81 81 A V E -De 68 130A 0 -13,-1.8 -13,-2.6 -2,-0.3 2,-0.6 -0.893 29.4-159.6-130.7 98.1 27.6 24.7 24.0 82 82 A V E +De 67 131A 0 48,-3.0 50,-2.5 -2,-0.4 -15,-0.2 -0.753 24.3 168.1 -89.0 118.4 30.0 22.2 22.5 83 83 A D E + 0 0 0 -17,-2.1 53,-2.6 -2,-0.6 2,-0.3 0.747 69.2 4.3 -96.0 -33.0 31.1 22.9 18.9 84 84 A S E +D 66 0A 4 -18,-1.6 -18,-2.6 51,-0.2 -1,-0.3 -0.972 61.4 179.8-147.7 166.2 34.0 20.4 18.7 85 85 A W E -D 65 0A 23 -2,-0.3 -20,-0.2 -20,-0.2 4,-0.1 -0.874 23.1-121.7-153.9-179.2 35.7 17.7 20.7 86 86 A G S S- 0 0 9 -22,-1.3 -23,-0.2 2,-0.4 -1,-0.2 0.563 79.0 -27.6-100.1-111.0 38.5 15.2 20.6 87 87 A T S S+ 0 0 112 -25,-1.4 2,-0.5 1,-0.1 -24,-0.2 0.667 125.0 57.4 -87.1 -13.4 38.1 11.5 21.1 88 88 A Y - 0 0 105 -26,-0.3 -2,-0.4 -24,-0.2 -24,-0.2 -0.962 66.0-151.8-126.5 122.5 34.9 11.6 23.2 89 89 A R - 0 0 57 -2,-0.5 2,-0.2 -4,-0.1 -24,-0.1 -0.792 29.6-126.6 -88.8 120.8 31.6 13.2 22.3 90 90 A P + 0 0 1 0, 0.0 2,-0.3 0, 0.0 -8,-0.1 -0.449 39.7 162.9 -71.2 136.8 29.9 14.3 25.5 91 91 A T + 0 0 66 -2,-0.2 2,-0.2 3,-0.0 17,-0.1 -0.915 9.0 155.2-142.8 172.4 26.4 13.1 26.0 92 92 A G - 0 0 32 -2,-0.3 2,-0.6 15,-0.1 18,-0.2 -0.692 60.9 -8.5-165.6-143.5 23.8 12.7 28.8 93 93 A T E S-F 109 0A 86 16,-2.8 16,-1.3 -2,-0.2 2,-0.2 -0.644 75.1-125.1 -76.7 113.8 20.1 12.5 29.3 94 94 A Y E +F 108 0A 133 -2,-0.6 14,-0.2 14,-0.2 3,-0.1 -0.431 38.6 165.4 -64.5 129.7 18.6 13.3 25.9 95 95 A K E - 0 0 84 12,-2.9 2,-0.3 1,-0.4 13,-0.2 0.688 55.0 -78.6-113.7 -33.5 16.1 16.2 25.8 96 96 A G E -F 107 0A 9 11,-1.0 11,-3.2 2,-0.0 -1,-0.4 -0.979 46.7 -82.0 159.5-163.3 15.8 17.1 22.2 97 97 A T E -F 106 0A 45 -2,-0.3 2,-0.3 9,-0.3 9,-0.2 -0.922 25.4-167.5-134.5 162.8 17.6 19.0 19.4 98 98 A V E -F 105 0A 17 7,-2.1 7,-3.0 -2,-0.3 2,-0.6 -0.991 17.8-136.3-149.7 141.9 17.9 22.6 18.2 99 99 A K E +F 104 0A 124 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.923 34.9 161.1-103.7 122.1 19.3 24.2 15.1 100 100 A a E > -F 103 0A 3 3,-2.1 3,-2.2 -2,-0.6 -2,-0.1 -0.992 60.6 -4.2-140.6 138.3 21.5 27.2 15.7 101 101 A D T 3 S- 0 0 46 -2,-0.3 42,-0.2 1,-0.3 3,-0.1 0.826 128.6 -51.6 50.1 43.2 24.1 28.9 13.6 102 102 A G T 3 S+ 0 0 83 1,-0.2 -1,-0.3 0, 0.0 2,-0.3 0.347 119.6 95.2 80.0 -5.1 23.9 26.4 10.8 103 103 A G E < -F 100 0A 4 -3,-2.2 -3,-2.1 33,-0.0 2,-0.5 -0.773 68.5-128.8-119.1 160.6 24.4 23.4 13.0 104 104 A T E -F 99 0A 47 -2,-0.3 29,-2.7 -5,-0.2 2,-0.4 -0.947 27.7-166.1-108.1 130.4 22.1 20.9 14.7 105 105 A Y E -FG 98 132A 0 -7,-3.0 -7,-2.1 -2,-0.5 2,-0.3 -0.918 16.3-137.4-119.4 142.2 22.7 20.3 18.4 106 106 A D E -FG 97 131A 17 25,-2.8 25,-2.7 -2,-0.4 2,-0.5 -0.722 22.7-137.3 -91.0 146.0 21.5 17.6 20.8 107 107 A I E +FG 96 130A 0 -11,-3.2 -12,-2.9 -2,-0.3 -11,-1.0 -0.927 29.8 170.2-108.7 129.6 20.4 18.9 24.2 108 108 A Y E -FG 94 129A 19 21,-1.9 21,-2.6 -2,-0.5 2,-0.3 -0.941 22.2-153.8-136.0 159.2 21.4 16.9 27.3 109 109 A T E +FG 93 128A 24 -16,-1.3 -16,-2.8 -2,-0.3 2,-0.3 -0.951 17.8 170.1-130.2 146.6 21.4 17.2 31.0 110 110 A T E - G 0 127A 30 17,-1.6 17,-2.7 -2,-0.3 2,-0.4 -0.908 23.1-133.6-145.8 167.9 23.8 15.5 33.4 111 111 A T E - G 0 126A 59 -2,-0.3 2,-0.4 15,-0.2 15,-0.2 -0.985 9.3-148.6-131.1 138.4 24.5 15.8 37.2 112 112 A R E - G 0 125A 90 13,-3.0 13,-1.7 -2,-0.4 2,-0.5 -0.913 12.9-151.0-107.4 136.3 27.9 16.1 38.9 113 113 A Y E S- 0 0 164 -2,-0.4 11,-0.2 11,-0.2 -2,-0.0 -0.951 70.7 -15.9-115.2 126.6 28.2 14.6 42.4 114 114 A N E S+ 0 0 98 -2,-0.5 10,-0.2 1,-0.2 -1,-0.2 0.921 96.9 147.0 48.9 53.9 30.7 15.9 44.9 115 115 A A E - G 0 123A 1 8,-2.6 8,-2.2 -3,-0.2 -1,-0.2 -0.858 57.4 -89.2-118.4 153.6 32.6 17.8 42.2 116 116 A P E - G 0 122A 49 0, 0.0 6,-0.2 0, 0.0 2,-0.2 -0.333 49.4-169.5 -61.5 135.7 34.5 21.1 42.3 117 117 A S > - 0 0 16 4,-1.1 3,-1.5 3,-0.3 -39,-0.0 -0.618 40.3 -88.6-118.3-176.5 32.2 24.1 41.5 118 118 A I T 3 S+ 0 0 41 1,-0.3 3,-0.1 -2,-0.2 -47,-0.0 0.844 124.4 56.5 -61.2 -34.6 32.8 27.8 40.8 119 119 A D T 3 S- 0 0 104 1,-0.3 -1,-0.3 2,-0.0 2,-0.1 0.496 114.0-115.9 -76.2 -6.0 32.6 28.6 44.5 120 120 A G S < S+ 0 0 37 -3,-1.5 -3,-0.3 1,-0.2 -1,-0.3 -0.327 80.6 62.8 91.8 178.6 35.4 26.2 45.3 121 121 A D S S- 0 0 149 -2,-0.1 -4,-1.1 -5,-0.1 2,-0.3 -0.151 94.0 -70.2 56.7-162.8 35.1 23.1 47.5 122 122 A R E + G 0 116A 149 -6,-0.2 2,-0.3 -3,-0.1 -8,-0.1 -0.954 55.7 146.8-128.9 153.1 32.8 20.4 46.2 123 123 A T E - G 0 115A 61 -8,-2.2 -8,-2.6 -2,-0.3 2,-0.5 -0.913 46.2 -88.2-163.9-178.5 29.0 20.0 45.7 124 124 A T E + 0 0 78 -2,-0.3 2,-0.3 -11,-0.2 -11,-0.2 -0.927 51.4 158.2-107.6 128.4 26.3 18.4 43.6 125 125 A F E - G 0 112A 7 -13,-1.7 -13,-3.0 -2,-0.5 2,-0.2 -0.973 36.9-109.1-148.9 162.7 25.1 20.4 40.6 126 126 A T E -eG 77 111A 53 -50,-0.9 -48,-1.8 -2,-0.3 2,-0.4 -0.620 23.0-153.0 -94.2 147.5 23.3 20.1 37.2 127 127 A Q E -eG 78 110A 14 -17,-2.7 -17,-1.6 -2,-0.2 2,-0.4 -0.973 3.1-154.3-121.0 137.2 25.0 20.6 33.8 128 128 A Y E -eG 79 109A 22 -50,-1.7 -48,-2.4 -2,-0.4 2,-0.4 -0.947 18.2-170.9-110.3 135.9 23.1 21.8 30.7 129 129 A W E -eG 80 108A 13 -21,-2.6 -21,-1.9 -2,-0.4 2,-0.4 -0.963 27.4-175.6-134.6 140.6 24.5 20.9 27.3 130 130 A S E -eG 81 107A 0 -50,-1.1 -48,-3.0 -2,-0.4 2,-0.5 -0.981 24.9-174.3-122.8 118.5 24.0 21.6 23.6 131 131 A V E -eG 82 106A 0 -25,-2.7 -25,-2.8 -2,-0.4 -48,-0.2 -0.983 25.9-119.7-122.1 122.3 26.4 19.3 21.7 132 132 A R E - G 0 105A 29 -50,-2.5 -27,-0.3 -2,-0.5 3,-0.1 -0.276 16.7-133.0 -58.3 142.9 26.8 19.6 18.0 133 133 A Q S S+ 0 0 96 -29,-2.7 2,-0.3 1,-0.1 -1,-0.1 0.842 92.7 18.2 -67.8 -33.3 25.8 16.4 16.2 134 134 A S S S- 0 0 75 -30,-0.3 -1,-0.1 -51,-0.1 -30,-0.1 -0.958 103.1 -85.2-134.2 150.1 29.0 16.6 14.1 135 135 A K - 0 0 97 -2,-0.3 -51,-0.2 1,-0.1 -52,-0.1 -0.254 40.6-124.7 -56.7 135.3 32.2 18.6 14.8 136 136 A R - 0 0 32 -53,-2.6 -1,-0.1 1,-0.1 -53,-0.0 -0.691 33.4-108.3 -79.2 135.2 32.1 22.2 13.5 137 137 A P - 0 0 101 0, 0.0 3,-0.3 0, 0.0 2,-0.2 -0.339 37.4-143.1 -62.9 146.7 35.0 22.8 11.2 138 138 A T S S+ 0 0 56 1,-0.1 -82,-0.1 -80,-0.1 3,-0.1 -0.615 70.4 60.8-107.3 171.0 37.7 25.1 12.8 139 139 A G S S+ 0 0 43 -84,-0.9 2,-0.2 1,-0.4 -1,-0.1 0.329 88.9 93.2 95.8 -6.6 39.9 27.8 11.4 140 140 A S S S- 0 0 81 -3,-0.3 2,-0.7 -85,-0.1 -85,-0.5 -0.701 89.7 -90.2-115.5 165.7 36.9 29.9 10.3 141 141 A N - 0 0 118 -2,-0.2 2,-0.3 -87,-0.2 -87,-0.2 -0.690 53.8-173.2 -77.8 113.1 34.9 32.8 12.0 142 142 A A E -J 53 0B 7 -89,-3.3 -89,-2.4 -2,-0.7 2,-0.4 -0.819 13.4-151.8-111.9 155.4 32.2 31.0 13.9 143 143 A T E -J 52 0B 45 -2,-0.3 2,-0.5 -91,-0.2 -91,-0.2 -0.950 6.9-165.0-128.1 141.1 29.2 32.4 15.7 144 144 A I E -J 51 0B 0 -93,-2.6 -93,-2.6 -2,-0.4 2,-1.3 -0.978 10.9-157.2-125.3 106.9 27.2 30.9 18.7 145 145 A T E >> -J 50 0B 41 -2,-0.5 3,-1.2 -95,-0.2 4,-0.9 -0.774 9.3-167.8 -84.9 95.2 23.9 32.7 19.1 146 146 A F H >> S+ 0 0 0 -97,-1.4 4,-2.8 -2,-1.3 3,-0.6 0.851 79.6 64.1 -58.3 -33.5 23.4 31.9 22.8 147 147 A T H 3> S+ 0 0 42 -98,-0.5 4,-2.6 1,-0.3 -1,-0.3 0.832 96.4 59.9 -58.8 -34.6 19.7 33.0 22.8 148 148 A a H <> S+ 0 0 33 -3,-1.2 4,-1.4 2,-0.2 -1,-0.3 0.909 111.4 39.6 -59.8 -43.4 19.0 30.2 20.4 149 149 A H H <>S+ 0 0 1 -4,-2.8 5,-2.6 1,-0.2 3,-1.4 0.919 108.0 53.2 -60.8 -43.1 16.7 24.8 26.8 154 154 A K H ><5S+ 0 0 126 -4,-2.4 3,-2.1 1,-0.3 -1,-0.2 0.892 100.6 59.9 -61.0 -39.0 13.8 26.7 28.4 155 155 A S H 3<5S+ 0 0 88 -4,-1.8 -1,-0.3 1,-0.3 -2,-0.2 0.697 107.3 48.7 -62.5 -18.5 11.3 24.7 26.2 156 156 A H T <<5S- 0 0 67 -3,-1.4 -1,-0.3 -4,-0.6 -2,-0.2 0.148 124.8-100.5-106.3 17.1 12.6 21.6 27.8 157 157 A G T < 5S+ 0 0 53 -3,-2.1 2,-1.1 1,-0.2 -3,-0.2 0.684 80.6 135.7 74.1 17.1 12.4 22.8 31.4 158 158 A M < + 0 0 7 -5,-2.6 2,-0.4 -6,-0.2 -1,-0.2 -0.779 31.6 178.4-100.2 87.3 16.1 23.6 31.6 159 159 A N - 0 0 74 -2,-1.1 2,-0.1 -5,-0.1 -9,-0.0 -0.796 21.4-132.3 -96.4 134.0 16.0 27.1 33.2 160 160 A L - 0 0 33 -2,-0.4 -84,-0.1 1,-0.1 4,-0.1 -0.324 30.8 -93.9 -77.9 163.1 19.2 28.9 34.1 161 161 A G - 0 0 5 -86,-0.3 -87,-0.2 2,-0.1 -1,-0.1 -0.198 24.5-122.4 -72.4 168.1 19.9 30.6 37.4 162 162 A S S S+ 0 0 101 -88,-2.2 2,-0.7 -89,-0.3 -88,-0.2 0.698 95.0 67.8 -87.1 -18.5 19.2 34.2 38.2 163 163 A N E S- C 0 73A 82 -90,-2.1 -90,-2.8 -88,-0.1 2,-0.4 -0.894 77.5-149.2-106.4 108.7 22.7 35.2 39.2 164 164 A W E - C 0 72A 49 -2,-0.7 -92,-0.2 -92,-0.2 2,-0.1 -0.682 15.7-176.9 -83.3 128.3 25.0 35.1 36.2 165 165 A A E - 0 0 6 -94,-2.2 -120,-2.8 -2,-0.4 -123,-0.1 -0.137 47.4 -36.4-100.1-158.8 28.7 34.3 36.6 166 166 A Y E - 0 0 20 -122,-0.2 -95,-1.5 -2,-0.1 2,-0.4 -0.091 47.7-160.2 -64.9 163.1 31.4 34.3 33.9 167 167 A Q E +BC 42 70A 0 -125,-2.3 -125,-2.8 -97,-0.2 2,-0.3 -0.959 21.6 163.7-146.4 117.0 30.8 33.1 30.3 168 168 A V E -BC 41 69A 0 -99,-3.2 -99,-3.1 -2,-0.4 2,-0.9 -0.925 45.0-117.5-139.8 160.8 33.8 32.1 28.1 169 169 A M E -BC 40 68A 0 -129,-2.5 -129,-1.2 -2,-0.3 -101,-0.2 -0.895 58.1-174.8 -97.2 106.7 34.8 30.3 24.9 170 170 A A E -BC 39 67A 0 -103,-3.0 -103,-2.5 -2,-0.9 2,-0.5 -0.636 42.1-143.0-113.6 166.9 36.8 27.6 26.4 171 171 A T E -BC 38 66A 0 -133,-2.8 -133,-2.6 -2,-0.2 2,-0.4 -0.992 29.7-176.4-118.4 118.7 39.1 24.6 25.9 172 172 A E E -BC 37 65A 16 -107,-2.1 -107,-2.9 -2,-0.5 2,-0.3 -0.979 1.4-175.2-118.3 139.9 38.4 22.0 28.5 173 173 A G E -BC 36 64A 1 -137,-1.9 -137,-1.6 -2,-0.4 2,-0.3 -0.911 14.1-163.5-134.0 157.6 40.4 18.8 28.8 174 174 A Y E S-B 35 0A 113 -111,-1.9 -111,-0.4 -2,-0.3 -139,-0.2 -0.914 74.5 -29.3-144.3 113.0 40.3 15.6 30.9 175 175 A Q S S+ 0 0 133 -141,-1.9 -112,-0.3 -2,-0.3 2,-0.2 0.886 111.9 99.7 45.8 56.6 43.2 13.2 31.2 176 176 A S - 0 0 7 -142,-0.4 -143,-1.8 -114,-0.1 2,-0.3 -0.778 63.2-122.9-149.2-171.6 44.6 14.1 27.8 177 177 A S E + K 0 61B 29 -116,-0.7 -116,-3.2 -146,-0.2 2,-0.3 -0.938 43.2 109.6-139.0 159.5 47.1 16.1 25.8 178 178 A G E -IK 30 60B 10 -148,-2.5 -148,-2.7 -2,-0.3 2,-0.3 -0.982 46.4-104.0 163.5-170.6 46.7 18.6 23.0 179 179 A S E +IK 29 59B 41 -120,-1.1 -120,-2.8 -2,-0.3 2,-0.3 -0.989 24.1 176.9-149.5 146.0 46.9 22.2 21.7 180 180 A S E -IK 28 58B 2 -152,-2.1 -152,-2.3 -2,-0.3 2,-0.3 -0.981 11.9-169.4-148.2 155.3 44.5 24.9 20.9 181 181 A N E +IK 27 57B 53 -124,-2.3 -124,-1.8 -2,-0.3 -125,-1.1 -0.911 21.4 172.8-148.0 115.4 44.6 28.6 19.8 182 182 A V E -IK 26 55B 0 -156,-2.4 -156,-2.5 -2,-0.3 2,-0.4 -0.974 21.9-157.6-134.5 143.1 41.4 30.5 19.9 183 183 A T E -IK 25 54B 50 -129,-2.0 -129,-1.9 -2,-0.4 2,-0.4 -0.986 17.2-164.8-121.3 130.1 40.4 34.1 19.4 184 184 A V E K 0 53B 3 -160,-2.1 -181,-0.2 -2,-0.4 -131,-0.2 -0.926 360.0 360.0-120.7 141.4 37.1 35.4 20.9 185 185 A W 0 0 90 -133,-2.6 -133,-2.7 -2,-0.4 -183,-0.1 -0.917 360.0 360.0-157.3 360.0 35.1 38.5 20.3