==== 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 10-JUN-08 2VVN . COMPND 2 MOLECULE: O-GLCNACASE BT_4395; . SOURCE 2 ORGANISM_SCIENTIFIC: BACTEROIDES THETAIOTAOMICRON; . AUTHOR Y.HE,G.J.DAVIES . 1296 10 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 56100.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 878 67.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 106 8.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 106 8.2 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 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 . 1 0.1 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 . 66 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 104 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 433 33.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 20 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 0 0 0 0 2 2 2 3 5 2 4 0 4 0 0 1 1 0 0 2 2 0 0 0 0 2 0 RESIDUES PER ALPHA HELIX . 0 4 0 10 2 4 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 5 7 0 1 1 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 2 0 2 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 4 A S 0 0 90 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 95.6 -14.5 13.8 -0.3 2 5 A L - 0 0 28 4,-0.0 101,-0.1 105,-0.0 105,-0.0 -0.435 360.0-129.4 -58.6 127.6 -11.5 14.8 1.8 3 6 A Q S S+ 0 0 7 1,-0.3 383,-0.1 -2,-0.2 103,-0.0 -0.979 95.8 23.6-134.3 121.5 -8.9 12.0 2.0 4 7 A P S S- 0 0 1 0, 0.0 -1,-0.3 0, 0.0 382,-0.1 0.619 105.6-125.3 -63.1 151.3 -8.0 11.2 4.7 5 8 A P - 0 0 29 0, 0.0 388,-0.1 0, 0.0 -2,-0.1 -0.479 30.5-112.2 -66.5 135.2 -11.1 12.5 6.3 6 9 A P - 0 0 9 0, 0.0 114,-0.2 0, 0.0 3,-0.1 -0.261 15.4-118.1 -71.6 159.1 -10.2 15.0 9.0 7 10 A Q S S+ 0 0 28 1,-0.2 2,-0.4 114,-0.1 113,-0.2 0.879 100.5 14.5 -60.1 -40.5 -10.8 14.4 12.7 8 11 A Q E S+A 119 0A 85 111,-1.6 111,-1.6 2,-0.0 2,-0.4 -0.999 70.1 174.7-142.0 132.7 -13.2 17.3 13.0 9 12 A L E -A 118 0A 83 -2,-0.4 2,-0.5 109,-0.2 109,-0.2 -0.985 9.9-174.4-142.2 127.4 -14.8 19.3 10.2 10 13 A I E -A 117 0A 69 107,-2.5 107,-2.0 -2,-0.4 2,-0.4 -0.982 13.4-168.1-122.0 117.5 -17.4 22.1 10.3 11 14 A V E -A 116 0A 71 -2,-0.5 2,-0.4 105,-0.2 105,-0.2 -0.896 10.6-155.8-108.2 131.7 -18.8 23.3 6.9 12 15 A Q E -A 115 0A 87 103,-3.1 2,-2.9 -2,-0.4 103,-0.7 -0.870 31.5-118.2 -95.3 137.7 -20.8 26.4 6.3 13 16 A N E S+ 0 0 168 -2,-0.4 2,-0.3 101,-0.1 103,-0.1 -0.302 86.5 97.1 -74.6 58.4 -23.0 26.3 3.2 14 17 A K E - 0 0 108 -2,-2.9 101,-2.7 101,-0.2 2,-0.3 -0.986 56.9-158.7-141.5 138.8 -21.1 29.2 1.8 15 18 A T E -A 114 0A 97 -2,-0.3 2,-0.3 99,-0.3 -2,-0.0 -0.920 5.6-159.1-116.8 151.6 -18.1 29.2 -0.6 16 19 A I E -A 113 0A 20 97,-3.0 97,-3.0 -2,-0.3 2,-0.3 -0.845 23.6-107.0-119.4 160.9 -15.6 32.0 -1.2 17 20 A D E -A 112 0A 109 -2,-0.3 95,-0.2 95,-0.2 94,-0.1 -0.642 39.6-101.1 -81.7 147.3 -13.2 32.7 -4.1 18 21 A L - 0 0 9 93,-2.6 -1,-0.1 -2,-0.3 4,-0.0 -0.573 56.1 -95.5 -64.0 113.1 -9.5 32.1 -3.8 19 22 A P - 0 0 12 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 -0.037 33.4-166.1 -45.8 105.7 -8.2 35.5 -3.1 20 23 A A S S+ 0 0 61 1,-0.2 26,-1.3 25,-0.1 2,-0.4 0.819 89.5 31.8 -53.2 -38.1 -7.0 37.1 -6.4 21 24 A V E S+b 46 0A 60 24,-0.2 31,-1.5 2,-0.0 2,-0.3 -0.999 86.5 165.3-128.6 132.2 -5.3 39.6 -4.2 22 25 A Y E -b 52 0A 19 24,-1.2 26,-1.5 -2,-0.4 2,-0.6 -0.981 37.7-133.4-146.8 148.7 -3.9 38.5 -0.8 23 26 A Q E -b 53 0A 33 29,-3.3 31,-2.9 -2,-0.3 2,-0.4 -0.952 26.3-153.6-105.0 115.1 -1.7 39.3 2.1 24 27 A L E -b 54 0A 38 -2,-0.6 2,-0.5 24,-0.2 31,-0.2 -0.761 9.7-167.4 -86.3 130.4 0.5 36.3 3.1 25 28 A N E +b 55 0A 57 29,-3.3 31,-2.5 -2,-0.4 -2,-0.0 -0.980 67.8 15.8-122.3 120.6 1.6 36.3 6.7 26 29 A G S >> S+ 0 0 11 -2,-0.5 4,-1.8 29,-0.2 3,-0.9 0.506 73.2 133.9 100.2 8.7 4.3 33.9 8.0 27 30 A G T 34 S+ 0 0 14 1,-0.2 8,-0.1 2,-0.2 -2,-0.1 0.823 75.9 48.6 -55.9 -33.9 5.7 32.8 4.6 28 31 A E T 34 S+ 0 0 181 1,-0.2 -1,-0.2 7,-0.0 29,-0.1 0.662 117.7 38.1 -82.3 -18.1 9.3 33.3 6.0 29 32 A E T <4 S+ 0 0 75 -3,-0.9 29,-0.2 27,-0.2 -2,-0.2 0.522 97.3 88.6-115.4 -10.6 8.8 31.4 9.2 30 33 A A S < S- 0 0 8 -4,-1.8 5,-0.1 1,-0.2 64,-0.1 -0.434 97.8 -66.7 -84.1 162.2 6.6 28.4 8.2 31 34 A N >> - 0 0 1 1,-0.2 4,-2.2 -2,-0.1 3,-0.5 -0.301 43.8-142.4 -42.6 113.6 7.7 25.0 6.8 32 35 A P H 3> S+ 0 0 89 0, 0.0 4,-2.2 0, 0.0 -1,-0.2 0.797 101.4 58.5 -55.7 -31.0 9.2 25.9 3.4 33 36 A H H 3> S+ 0 0 59 2,-0.2 4,-1.3 1,-0.2 5,-0.1 0.895 108.8 43.6 -66.2 -39.4 7.7 22.6 2.1 34 37 A A H <> S+ 0 0 0 -3,-0.5 4,-2.2 2,-0.2 -1,-0.2 0.889 113.0 52.3 -68.4 -38.9 4.2 23.9 3.1 35 38 A V H X S+ 0 0 10 -4,-2.2 4,-2.6 1,-0.2 -2,-0.2 0.853 104.8 55.8 -69.1 -37.0 4.9 27.4 1.7 36 39 A K H X S+ 0 0 129 -4,-2.2 4,-1.2 2,-0.2 -1,-0.2 0.927 108.9 47.6 -56.9 -47.7 6.0 26.0 -1.7 37 40 A V H >X S+ 0 0 21 -4,-1.3 4,-2.0 2,-0.2 3,-0.6 0.944 112.8 48.6 -59.3 -49.1 2.6 24.2 -2.0 38 41 A L H 3X S+ 0 0 0 -4,-2.2 4,-2.0 1,-0.3 -2,-0.2 0.893 109.6 51.0 -60.6 -45.1 0.7 27.4 -1.0 39 42 A K H 3< S+ 0 0 101 -4,-2.6 -1,-0.3 1,-0.2 -2,-0.2 0.712 109.0 52.2 -69.5 -20.6 2.6 29.6 -3.5 40 43 A E H X< S+ 0 0 120 -4,-1.2 3,-0.9 -3,-0.6 -1,-0.2 0.845 109.9 48.2 -78.0 -38.0 1.9 27.1 -6.3 41 44 A L H 3< S+ 0 0 43 -4,-2.0 -2,-0.2 1,-0.2 -3,-0.1 0.836 112.9 49.1 -65.4 -35.3 -1.8 27.2 -5.4 42 45 A L T >< S+ 0 0 2 -4,-2.0 3,-1.4 -5,-0.2 -1,-0.2 0.168 82.6 134.2 -92.9 13.2 -1.7 31.0 -5.4 43 46 A S T < + 0 0 91 -3,-0.9 3,-0.1 1,-0.2 -3,-0.1 -0.337 67.1 29.6 -57.0 144.3 0.1 31.0 -8.7 44 47 A G T 3 S+ 0 0 81 1,-0.4 -1,-0.2 -2,-0.0 2,-0.1 0.071 109.2 86.2 87.0 -24.9 -1.4 33.6 -11.1 45 48 A K < - 0 0 62 -3,-1.4 -1,-0.4 -26,-0.0 2,-0.3 -0.400 69.1-140.5 -93.6 176.4 -2.4 35.8 -8.1 46 49 A Q E -b 21 0A 113 -26,-1.3 -24,-1.2 -2,-0.1 2,-0.2 -0.999 7.0-126.0-145.3 150.1 -0.1 38.4 -6.4 47 50 A S E +b 22 0A 74 -2,-0.3 2,-0.3 -26,-0.2 -24,-0.2 -0.517 32.5 148.0 -97.3 160.4 0.6 39.5 -2.8 48 51 A S E - 0 0 38 -26,-1.5 -24,-0.2 2,-0.5 -27,-0.0 -0.878 63.7 -88.2-162.1-175.8 0.5 42.9 -1.2 49 52 A K E S+ 0 0 171 -2,-0.3 -26,-0.1 -26,-0.1 2,-0.1 0.476 114.3 67.1 -85.4 -5.9 -0.2 44.6 2.1 50 53 A K E S+ 0 0 158 -28,-0.2 -2,-0.5 2,-0.0 0, 0.0 -0.267 78.5 51.7 -89.9-174.9 -3.8 44.7 0.8 51 54 A G E S- 0 0 40 -29,-0.2 -29,-0.3 -2,-0.1 -28,-0.1 0.092 95.1 -21.2 80.3 173.7 -6.1 41.7 0.1 52 55 A M E -b 22 0A 31 -31,-1.5 -29,-3.3 1,-0.1 2,-0.4 -0.266 67.8-117.5 -56.5 133.9 -7.3 38.7 2.1 53 56 A L E -bc 23 86A 50 32,-0.9 34,-2.3 -31,-0.2 2,-0.4 -0.632 30.0-172.8 -73.6 129.4 -5.1 37.7 5.0 54 57 A I E -bc 24 87A 0 -31,-2.9 -29,-3.3 -2,-0.4 2,-0.5 -0.992 5.8-164.7-121.9 120.5 -3.6 34.3 4.7 55 58 A S E +bc 25 88A 3 32,-2.8 34,-2.7 -2,-0.4 2,-0.4 -0.927 11.3 173.3-114.2 123.5 -1.8 33.1 7.8 56 59 A I E + c 0 89A 0 -31,-2.5 2,-0.3 -2,-0.5 -27,-0.2 -0.981 23.2 98.2-128.6 137.3 0.6 30.1 7.6 57 60 A G E - c 0 90A 0 32,-1.8 34,-2.3 -2,-0.4 2,-0.3 -0.942 60.2 -84.3 167.7 175.6 2.9 28.9 10.3 58 61 A E E > - c 0 91A 13 -2,-0.3 3,-3.1 32,-0.2 6,-0.3 -0.779 61.2 -80.0-101.0 150.4 3.6 26.4 13.2 59 62 A K T 3 S+ 0 0 88 32,-2.5 -1,-0.1 -2,-0.3 3,-0.1 -0.236 124.7 37.0 -42.8 126.4 2.4 26.9 16.7 60 63 A G T 3 S+ 0 0 77 1,-0.5 -1,-0.3 4,-0.1 2,-0.1 0.003 89.8 116.7 107.1 -28.9 4.9 29.4 18.2 61 64 A D S X S- 0 0 27 -3,-3.1 3,-0.9 1,-0.1 -1,-0.5 -0.460 72.4-127.0 -66.6 146.0 5.2 31.4 15.0 62 65 A K G > S+ 0 0 132 1,-0.2 3,-1.2 2,-0.2 4,-0.3 0.819 105.1 67.6 -61.2 -35.4 4.0 35.0 15.2 63 66 A S G 3 S+ 0 0 10 1,-0.2 -1,-0.2 -7,-0.2 3,-0.2 0.798 108.4 34.5 -55.5 -34.1 1.8 34.5 12.2 64 67 A V G X S+ 0 0 2 -3,-0.9 3,-1.0 -6,-0.3 4,-0.3 0.101 77.6 115.9-117.6 21.4 -0.5 32.1 14.1 65 68 A R G X S+ 0 0 159 -3,-1.2 3,-0.7 1,-0.3 4,-0.2 0.799 76.2 56.2 -62.2 -35.6 -0.6 33.5 17.7 66 69 A K G 3 S+ 0 0 153 -4,-0.3 3,-0.3 -3,-0.2 -1,-0.3 0.758 111.8 44.4 -61.1 -28.1 -4.3 34.3 17.5 67 70 A Y G X> S+ 0 0 19 -3,-1.0 3,-1.6 1,-0.2 4,-1.2 0.314 74.3 113.1-105.4 8.0 -5.1 30.6 16.6 68 71 A S T <4 S+ 0 0 49 -3,-0.7 3,-0.3 1,-0.3 -1,-0.2 0.825 78.1 53.1 -52.0 -36.4 -2.8 28.9 19.2 69 72 A R T 34 S+ 0 0 219 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.737 107.4 49.9 -69.9 -29.7 -5.9 27.5 21.1 70 73 A Q T <4 S+ 0 0 44 -3,-1.6 -1,-0.2 2,-0.1 -2,-0.2 0.663 85.0 100.4 -88.4 -15.7 -7.4 25.9 18.0 71 74 A I S < S- 0 0 7 -4,-1.2 8,-0.1 -3,-0.3 20,-0.1 -0.576 83.3-115.0 -71.6 117.6 -4.2 24.1 16.9 72 75 A P - 0 0 15 0, 0.0 2,-1.9 0, 0.0 5,-0.2 -0.235 15.8-127.7 -57.3 137.2 -4.6 20.4 18.0 73 76 A D S S+ 0 0 138 5,-0.0 2,-0.3 48,-0.0 48,-0.1 -0.365 74.2 107.1 -84.2 61.5 -2.0 19.4 20.6 74 77 A H S > S- 0 0 82 -2,-1.9 3,-2.2 46,-0.2 18,-0.2 -0.990 80.6 -95.7-138.4 139.9 -0.9 16.4 18.5 75 78 A K T 3 S+ 0 0 142 -2,-0.3 3,-0.1 1,-0.3 -2,-0.0 -0.329 114.7 11.4 -47.3 132.3 2.1 15.5 16.5 76 79 A E T 3 S+ 0 0 4 1,-0.2 -1,-0.3 45,-0.1 2,-0.1 0.561 100.4 144.3 67.6 11.3 1.4 16.3 12.8 77 80 A G < + 0 0 0 -3,-2.2 15,-3.2 -5,-0.2 16,-0.7 -0.310 24.3 179.3 -76.8 160.7 -1.8 18.2 13.8 78 81 A Y E -DE 91 120A 0 42,-2.2 42,-2.3 13,-0.3 2,-0.4 -0.993 26.5-136.3-158.1 158.8 -3.1 21.4 12.2 79 82 A Y E -DE 90 119A 11 11,-3.1 11,-3.1 -2,-0.3 2,-0.4 -0.987 22.9-175.0-117.5 130.2 -5.9 23.9 12.3 80 83 A L E +DE 89 118A 0 38,-2.5 38,-3.1 -2,-0.4 2,-0.4 -0.995 4.7 175.3-126.7 130.9 -7.4 25.0 8.9 81 84 A S E -DE 88 117A 9 7,-2.1 7,-2.8 -2,-0.4 2,-0.4 -0.999 9.2-178.8-137.7 135.2 -10.0 27.8 8.6 82 85 A V E +DE 87 116A 3 34,-2.7 34,-0.9 -2,-0.4 2,-0.3 -0.979 21.3 142.2-130.8 121.5 -11.5 29.4 5.5 83 86 A N - 0 0 42 3,-1.8 3,-0.1 -2,-0.4 -2,-0.0 -0.895 64.7 -87.2-141.0 178.4 -14.0 32.2 5.8 84 87 A E S S+ 0 0 119 -2,-0.3 3,-0.1 1,-0.2 -67,-0.1 0.772 123.4 44.2 -57.1 -29.8 -14.8 35.4 3.9 85 88 A K S S- 0 0 140 1,-0.2 -32,-0.9 -33,-0.1 2,-0.3 0.846 121.2 -9.5 -90.7 -35.8 -12.3 37.4 5.9 86 89 A E E -c 53 0A 9 -34,-0.2 -3,-1.8 -3,-0.1 2,-0.4 -0.993 49.5-126.4-158.6 165.4 -9.2 35.2 6.1 87 90 A I E -cD 54 82A 0 -34,-2.3 -32,-2.8 -2,-0.3 2,-0.4 -0.963 23.5-163.3-115.0 132.4 -7.5 31.8 5.5 88 91 A V E +cD 55 81A 0 -7,-2.8 -7,-2.1 -2,-0.4 2,-0.3 -0.965 15.9 172.8-121.3 131.2 -5.6 30.0 8.3 89 92 A L E +cD 56 80A 0 -34,-2.7 -32,-1.8 -2,-0.4 2,-0.6 -0.818 19.1 164.7-134.3 88.6 -3.1 27.2 7.8 90 93 A A E -cD 57 79A 0 -11,-3.1 -11,-3.1 -2,-0.3 2,-0.2 -0.928 17.5-162.7-122.4 112.6 -1.6 26.5 11.3 91 94 A G E -cD 58 78A 0 -34,-2.3 -32,-2.5 -2,-0.6 -13,-0.3 -0.611 24.9-138.7 -90.4 150.4 0.4 23.4 12.1 92 95 A N S S- 0 0 30 -15,-3.2 2,-0.3 -2,-0.2 -14,-0.1 0.822 96.0 -1.5 -67.2 -31.6 1.2 22.1 15.5 93 96 A D S > S- 0 0 45 -16,-0.7 4,-1.7 -35,-0.1 3,-0.2 -0.845 96.0 -81.2-147.2 178.0 4.6 21.3 14.0 94 97 A E H > S+ 0 0 105 -2,-0.3 4,-1.8 1,-0.2 3,-0.2 0.901 128.2 48.4 -58.1 -43.3 6.3 21.6 10.6 95 98 A R H > S+ 0 0 35 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.874 107.1 58.0 -65.6 -35.1 4.7 18.4 9.2 96 99 A G H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.881 103.6 52.2 -60.6 -37.9 1.3 19.6 10.4 97 100 A T H X S+ 0 0 0 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.923 109.4 49.6 -64.8 -45.7 1.6 22.8 8.4 98 101 A Y H X S+ 0 0 7 -4,-1.8 4,-1.7 2,-0.2 -2,-0.2 0.915 110.6 50.0 -54.6 -46.9 2.4 20.6 5.3 99 102 A Y H X S+ 0 0 0 -4,-2.6 4,-2.0 2,-0.2 -2,-0.2 0.870 105.7 56.2 -63.7 -34.2 -0.7 18.4 6.0 100 103 A A H X S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 -1,-0.2 0.931 108.6 48.8 -58.9 -45.1 -2.9 21.5 6.4 101 104 A L H X S+ 0 0 0 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.843 106.0 55.3 -63.0 -37.7 -1.8 22.5 2.9 102 105 A Q H X S+ 0 0 13 -4,-1.7 4,-0.8 2,-0.2 -1,-0.2 0.856 112.5 43.7 -68.2 -33.8 -2.5 19.0 1.6 103 106 A T H >X S+ 0 0 0 -4,-2.0 4,-1.4 2,-0.2 3,-0.6 0.901 110.9 55.0 -70.4 -43.5 -6.1 19.3 2.9 104 107 A F H 3X S+ 0 0 0 -4,-2.6 4,-1.5 1,-0.2 3,-0.5 0.903 102.8 56.6 -58.1 -41.9 -6.3 22.9 1.5 105 108 A A H 3< S+ 0 0 32 -4,-2.5 -1,-0.2 1,-0.2 -2,-0.2 0.829 106.9 48.8 -61.2 -33.4 -5.4 21.7 -2.0 106 109 A Q H << S+ 0 0 40 -4,-0.8 -1,-0.2 -3,-0.6 -2,-0.2 0.726 107.4 55.2 -76.1 -25.9 -8.4 19.3 -2.0 107 110 A L H < S+ 0 0 18 -4,-1.4 2,-0.6 -3,-0.5 -2,-0.2 0.818 89.9 88.9 -72.8 -32.7 -10.8 22.0 -0.8 108 111 A L < + 0 0 35 -4,-1.5 2,-0.4 5,-0.1 5,-0.2 -0.578 52.9 159.1 -75.4 114.5 -9.8 24.2 -3.7 109 112 A K B > -F 112 0A 126 3,-2.6 3,-0.8 -2,-0.6 -3,-0.0 -0.956 65.6 -9.7-144.9 121.5 -12.0 23.5 -6.8 110 113 A D T 3 S- 0 0 162 -2,-0.4 3,-0.1 1,-0.2 -1,-0.1 0.876 127.1 -55.6 58.8 43.7 -12.6 25.8 -9.7 111 114 A G T 3 S+ 0 0 39 1,-0.2 -93,-2.6 -94,-0.1 2,-0.3 0.608 118.7 107.9 69.1 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-1,-0.1 -0.068 25.8 178.7-163.1 57.4 13.5 -3.2 1.7 162 165 A P > - 0 0 0 0, 0.0 3,-2.1 0, 0.0 6,-0.2 -0.457 28.1-140.7 -65.0 122.2 13.0 -5.1 -1.6 163 166 A K T 3 S+ 0 0 12 -30,-1.8 -29,-0.2 -2,-0.3 6,-0.1 0.757 99.3 53.5 -58.6 -27.5 13.8 -8.7 -0.8 164 167 A D T 3 S+ 0 0 85 -31,-0.6 -1,-0.3 -29,-0.4 -30,-0.1 0.429 76.9 108.0 -92.7 5.0 15.5 -9.0 -4.2 165 168 A D X> - 0 0 14 -3,-2.1 4,-1.9 1,-0.2 3,-1.6 -0.726 61.0-152.1 -79.5 114.6 17.9 -6.0 -3.9 166 169 A P T 34 S+ 0 0 67 0, 0.0 6,-0.3 0, 0.0 -1,-0.2 0.727 94.0 54.5 -64.4 -25.0 21.3 -7.6 -3.4 167 170 A Y T 34 S+ 0 0 47 1,-0.1 10,-0.1 6,-0.1 3,-0.1 0.438 111.3 47.0 -84.6 -0.8 22.7 -4.6 -1.4 168 171 A H T <4 S+ 0 0 0 -3,-1.6 36,-2.8 -6,-0.2 -1,-0.1 0.746 120.8 25.9-101.8 -41.0 19.7 -5.0 1.0 169 172 A S S X S- 0 0 21 -4,-1.9 4,-1.1 34,-0.2 5,-0.1 -0.236 100.8 -3.8-117.2-162.3 19.8 -8.8 1.6 170 173 A A T 4 S- 0 0 40 1,-0.2 -1,-0.1 34,-0.2 -2,-0.1 -0.560 111.9 -6.1 -89.5 144.9 22.4 -11.5 1.5 171 174 A P T >4 S+ 0 0 76 0, 0.0 3,-1.2 0, 0.0 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113.5 53.7 -62.8 -34.8 22.3 3.1 -7.3 182 185 A A H X S+ 0 0 14 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.908 107.5 48.4 -66.2 -46.0 23.7 5.4 -4.6 183 186 A A H X S+ 0 0 54 -4,-2.5 4,-1.8 2,-0.2 -2,-0.2 0.853 112.0 50.6 -62.7 -37.9 23.0 8.6 -6.5 184 187 A Q H X S+ 0 0 58 -4,-1.9 4,-2.7 2,-0.2 -2,-0.2 0.952 110.4 48.3 -61.6 -51.9 19.4 7.3 -7.2 185 188 A L H X S+ 0 0 5 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.891 109.7 53.9 -54.0 -41.0 18.9 6.6 -3.4 186 189 A Q H X S+ 0 0 97 -4,-2.2 4,-2.0 2,-0.2 -1,-0.2 0.890 109.2 47.0 -62.3 -41.1 20.2 10.0 -2.6 187 190 A E H X S+ 0 0 95 -4,-1.8 4,-2.6 2,-0.2 -2,-0.2 0.921 108.2 56.7 -67.3 -41.6 17.7 11.6 -4.9 188 191 A L H X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.869 109.2 47.4 -54.8 -38.3 14.9 9.3 -3.3 189 192 A V H X S+ 0 0 6 -4,-2.2 4,-2.8 2,-0.2 5,-0.2 0.922 110.1 49.7 -68.6 -46.0 15.9 10.8 0.1 190 193 A A H X S+ 0 0 43 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.959 114.7 46.1 -59.0 -47.5 15.8 14.4 -1.2 191 194 A V H X S+ 0 0 15 -4,-2.6 4,-1.0 1,-0.2 -1,-0.2 0.896 111.6 51.0 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38.4 -59.3 -49.3 26.1 -35.5 24.3 868 218 B D H > S+ 0 0 3 2,-0.2 4,-2.7 1,-0.2 5,-0.2 0.908 115.3 53.1 -71.7 -42.5 22.5 -35.2 25.5 869 219 B R H X S+ 0 0 57 -4,-2.1 4,-2.2 2,-0.2 -2,-0.2 0.943 112.2 46.9 -50.7 -52.3 21.2 -37.7 22.9 870 220 B D H X S+ 0 0 55 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.878 111.4 50.0 -59.4 -43.2 23.9 -40.2 24.2 871 221 B L H X S+ 0 0 59 -4,-2.1 4,-2.3 2,-0.2 -1,-0.2 0.876 108.8 52.3 -65.3 -39.4 23.0 -39.6 27.9 872 222 B L H X S+ 0 0 0 -4,-2.7 4,-2.8 2,-0.2 -2,-0.2 0.972 112.5 45.0 -60.4 -51.9 19.3 -40.2 27.2 873 223 B L H X S+ 0 0 22 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.894 110.9 53.7 -60.0 -39.7 20.1 -43.5 25.5 874 224 B A H X S+ 0 0 52 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.893 109.7 48.7 -59.5 -40.0 22.5 -44.4 28.3 875 225 B K H X S+ 0 0 3 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.942 110.0 50.8 -64.4 -48.5 19.7 -43.8 30.8 876 226 B F H X S+ 0 0 0 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.921 109.0 52.5 -53.8 -43.6 17.3 -45.9 28.7 877 227 B E H X S+ 0 0 56 -4,-2.7 4,-2.0 2,-0.2 -1,-0.2 0.899 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1035 385 B Y H X S+ 0 0 13 -4,-2.6 4,-1.6 2,-0.2 -1,-0.2 0.866 114.9 48.2 -64.4 -36.4 -11.5 -49.6 37.8 1036 386 B S H X S+ 0 0 0 -4,-1.2 4,-3.0 -5,-0.2 -2,-0.2 0.880 110.9 49.0 -71.2 -43.8 -14.1 -47.6 35.7 1037 387 B V H X S+ 0 0 0 -4,-2.9 4,-2.7 2,-0.2 5,-0.2 0.897 108.8 54.2 -63.0 -38.3 -11.5 -46.6 33.0 1038 388 B A H X S+ 0 0 1 -4,-2.7 4,-1.7 1,-0.2 -2,-0.2 0.912 112.1 45.0 -58.4 -44.4 -10.4 -50.3 32.8 1039 389 B S H X S+ 0 0 0 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.927 114.2 48.0 -64.6 -50.0 -14.1 -51.2 32.2 1040 390 B Y H < S+ 0 0 5 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.913 113.6 46.1 -56.8 -46.4 -14.6 -48.4 29.7 1041 391 B A H < S+ 0 0 0 -4,-2.7 -264,-1.0 2,-0.2 -265,-0.4 0.783 114.4 46.8 -76.9 -28.4 -11.5 -49.1 27.6 1042 392 B W H < S+ 0 0 0 -4,-1.7 -266,-2.3 -5,-0.2 -2,-0.2 0.953 135.4 7.4 -71.7 -54.1 -12.0 -52.9 27.5 1043 393 B N >< + 0 0 1 -4,-2.2 3,-0.9 -5,-0.2 -1,-0.2 -0.617 68.4 163.1-131.3 73.4 -15.7 -52.8 26.5 1044 394 B P G > S+ 0 0 6 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 0.831 73.0 63.7 -63.2 -30.5 -16.8 -49.2 25.7 1045 395 B A G 3 S+ 0 0 73 1,-0.3 -35,-0.1 -34,-0.0 -5,-0.1 0.795 112.5 36.4 -65.8 -28.3 -19.9 -50.3 23.9 1046 396 B K G < S+ 0 0 131 -3,-0.9 -1,-0.3 -7,-0.2 2,-0.2 0.211 85.5 142.0-100.9 10.2 -21.3 -51.8 27.1 1047 397 B Y < - 0 0 29 -3,-1.5 2,-0.6 -4,-0.2 -37,-0.1 -0.396 30.0-170.4 -66.1 123.7 -19.8 -49.1 29.4 1048 398 B D > - 0 0 87 -2,-0.2 4,-2.4 1,-0.2 5,-0.3 -0.931 6.4-161.8-115.8 98.9 -22.3 -48.3 32.2 1049 399 B T H > S+ 0 0 36 -2,-0.6 4,-1.6 1,-0.2 -44,-0.3 0.882 85.0 35.8 -49.3 -57.0 -21.1 -45.2 34.2 1050 400 B W H > S+ 0 0 96 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.904 117.4 49.2 -71.7 -43.8 -23.1 -45.5 37.4 1051 401 B Q H > S+ 0 0 83 1,-0.2 4,-2.6 2,-0.2 -1,-0.2 0.893 112.1 50.0 -63.7 -38.1 -23.1 -49.3 37.7 1052 402 B T H X S+ 0 0 3 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.890 109.0 52.3 -68.1 -36.3 -19.4 -49.4 37.2 1053 403 B W H X S+ 0 0 4 -4,-1.6 4,-1.9 -5,-0.3 -2,-0.2 0.926 112.2 44.6 -59.3 -50.1 -18.8 -46.7 39.9 1054 404 B K H X S+ 0 0 75 -4,-2.2 4,-2.3 2,-0.2 -2,-0.2 0.888 113.1 52.3 -61.3 -42.8 -20.9 -48.7 42.4 1055 405 B D H X S+ 0 0 24 -4,-2.6 4,-1.8 1,-0.2 -2,-0.2 0.907 108.6 50.6 -58.1 -46.7 -19.0 -51.9 41.3 1056 406 B A H X S+ 0 0 0 -4,-2.6 4,-2.7 2,-0.2 -1,-0.2 0.896 110.9 48.4 -54.6 -48.7 -15.7 -50.2 41.9 1057 407 B I H X S+ 0 0 0 -4,-1.9 4,-2.9 1,-0.2 -2,-0.2 0.916 111.7 48.9 -63.6 -43.6 -16.7 -49.1 45.4 1058 408 B R H < S+ 0 0 135 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.782 114.1 47.0 -69.3 -29.9 -17.9 -52.5 46.4 1059 409 B T H < S+ 0 0 74 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.869 116.0 44.8 -72.9 -43.9 -14.7 -54.1 45.1 1060 410 B I H < S+ 0 0 16 -4,-2.7 -2,-0.2 1,-0.2 -3,-0.2 0.899 134.8 10.1 -70.8 -40.9 -12.5 -51.5 46.8 1061 411 B L >< + 0 0 0 -4,-2.9 3,-1.6 -5,-0.2 -1,-0.2 -0.523 66.5 165.3-142.4 70.3 -14.3 -51.5 50.2 1062 412 B P G > S+ 0 0 64 0, 0.0 3,-0.7 0, 0.0 4,-0.2 0.792 76.8 58.9 -59.4 -32.5 -16.8 -54.3 50.4 1063 413 B S G 3 S+ 0 0 71 1,-0.2 -5,-0.1 2,-0.1 3,-0.0 0.622 124.3 19.4 -72.2 -15.4 -17.1 -54.0 54.2 1064 414 B A G <> S+ 0 0 1 -3,-1.6 4,-2.6 -7,-0.2 -1,-0.2 -0.097 79.1 138.7-145.5 45.6 -18.3 -50.4 53.9 1065 415 B A H <> S+ 0 0 3 -3,-0.7 4,-2.7 1,-0.2 5,-0.1 0.889 74.4 46.9 -64.5 -46.3 -19.5 -50.0 50.4 1066 416 B E H > S+ 0 0 110 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.849 112.2 51.4 -66.0 -35.8 -22.6 -47.9 51.0 1067 417 B E H > S+ 0 0 31 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.907 111.3 47.5 -68.1 -41.1 -20.6 -45.6 53.4 1068 418 B L H X S+ 0 0 2 -4,-2.6 4,-3.1 -7,-0.2 5,-0.2 0.906 109.9 53.4 -65.9 -40.9 -18.0 -45.1 50.7 1069 419 B E H X S+ 0 0 26 -4,-2.7 4,-2.6 -5,-0.2 -2,-0.2 0.932 108.8 50.1 -53.6 -47.3 -20.7 -44.4 48.1 1070 420 B C H X S+ 0 0 8 -4,-2.2 4,-0.8 2,-0.2 -2,-0.2 0.966 114.3 43.5 -56.5 -52.9 -22.1 -41.8 50.5 1071 421 B F H >< S+ 0 0 0 -4,-2.5 3,-0.7 1,-0.2 -2,-0.2 0.921 114.9 49.5 -57.6 -47.2 -18.7 -40.1 50.9 1072 422 B A H >< S+ 0 0 0 -4,-3.1 3,-1.9 1,-0.2 -70,-0.3 0.883 102.9 58.6 -66.4 -38.6 -17.9 -40.3 47.1 1073 423 B M H 3< S+ 0 0 44 -4,-2.6 17,-2.1 1,-0.3 3,-0.2 0.747 111.7 41.7 -69.2 -15.6 -21.1 -38.8 45.8 1074 424 B H T << S+ 0 0 7 -4,-0.8 133,-1.4 -3,-0.7 -1,-0.3 0.099 111.5 58.8-113.2 18.1 -20.6 -35.6 47.8 1075 425 B N S < S+ 0 0 4 -3,-1.9 -73,-2.9 131,-0.2 -1,-0.2 -0.518 78.2 95.5-137.9 66.9 -16.9 -35.5 46.9 1076 426 B S + 0 0 3 -75,-0.2 -73,-0.2 -3,-0.2 13,-0.1 0.610 59.1 81.0-126.8 -38.3 -17.1 -35.4 43.1 1077 427 B D - 0 0 0 1,-0.1 131,-0.1 9,-0.1 -75,-0.1 -0.394 60.5-147.3 -86.0 161.4 -16.8 -31.8 41.9 1078 428 B L - 0 0 0 1,-0.2 -80,-0.1 7,-0.1 -1,-0.1 0.578 34.8-134.1 -99.4 -12.9 -13.6 -29.8 41.5 1079 429 B G - 0 0 5 8,-0.2 -1,-0.2 2,-0.1 6,-0.1 -0.144 56.7 -29.4 72.3 179.3 -15.0 -26.4 42.4 1080 430 B P S S+ 0 0 118 0, 0.0 2,-0.3 0, 0.0 6,-0.0 -0.382 78.8 166.9 -63.7 140.6 -14.0 -23.4 40.2 1081 431 B N > - 0 0 33 1,-0.0 3,-1.6 -2,-0.0 -85,-0.1 -0.985 51.2-103.9-152.0 159.7 -10.6 -23.8 38.6 1082 432 B G T 3 S+ 0 0 78 -2,-0.3 -1,-0.0 1,-0.3 0, 0.0 0.718 117.8 55.9 -56.6 -23.9 -8.3 -22.4 35.9 1083 433 B H T 3 S- 0 0 50 2,-0.1 -1,-0.3 -88,-0.1 -118,-0.2 0.579 100.1-133.0 -88.1 -9.9 -9.1 -25.4 33.6 1084 434 B G < + 0 0 53 -3,-1.6 2,-0.4 1,-0.2 -2,-0.1 0.692 55.6 143.5 65.0 22.5 -12.9 -24.9 33.7 1085 435 B Y + 0 0 15 -6,-0.1 2,-0.3 -7,-0.0 -1,-0.2 -0.816 20.7 169.5-102.7 134.2 -13.5 -28.6 34.3 1086 436 B R - 0 0 94 -2,-0.4 2,-0.3 -3,-0.1 -9,-0.1 -0.923 17.6-155.0-136.4 158.5 -16.4 -29.6 36.6 1087 437 B R - 0 0 20 -2,-0.3 -8,-0.2 -8,-0.0 -11,-0.1 -0.964 31.4 -97.2-130.4 152.9 -18.2 -32.8 37.6 1088 438 B E + 0 0 103 -2,-0.3 2,-0.3 -12,-0.1 -85,-0.1 -0.285 44.6 177.0 -58.2 151.6 -21.7 -33.5 38.9 1089 439 B E + 0 0 4 -13,-0.1 -15,-0.2 -15,-0.1 -16,-0.1 -0.964 56.0 4.4-159.3 142.1 -22.1 -33.9 42.7 1090 440 B S S >> S+ 0 0 1 -17,-2.1 4,-1.0 -2,-0.3 3,-0.5 0.790 71.6 157.3 58.2 33.5 -25.0 -34.5 45.2 1091 441 B M T 34 + 0 0 48 1,-0.2 3,-0.5 -18,-0.2 -1,-0.1 0.853 62.2 59.6 -58.0 -42.2 -27.5 -34.8 42.3 1092 442 B D T 34 S+ 0 0 125 1,-0.2 4,-0.3 2,-0.1 -1,-0.2 0.852 112.3 36.9 -61.1 -37.7 -30.1 -36.7 44.3 1093 443 B I T <> S+ 0 0 13 -3,-0.5 4,-2.3 1,-0.2 -1,-0.2 0.575 91.2 93.7 -91.4 -10.5 -30.6 -34.1 47.0 1094 444 B Q H X S+ 0 0 79 -4,-1.0 4,-2.8 -3,-0.5 5,-0.2 0.870 83.0 50.8 -53.1 -44.6 -30.3 -31.0 44.7 1095 445 B P H > S+ 0 0 60 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.944 112.6 45.3 -62.7 -47.1 -34.0 -30.7 44.0 1096 446 B A H > S+ 0 0 4 -4,-0.3 4,-2.1 2,-0.2 -2,-0.2 0.852 113.6 51.1 -60.5 -36.6 -35.0 -30.7 47.7 1097 447 B A H X S+ 0 0 5 -4,-2.3 4,-2.4 2,-0.2 5,-0.2 0.943 111.8 47.2 -65.1 -48.4 -32.1 -28.3 48.4 1098 448 B E H X S+ 0 0 112 -4,-2.8 4,-2.0 1,-0.2 -2,-0.2 0.910 114.9 44.6 -56.5 -52.0 -33.3 -25.9 45.7 1099 449 B R H X S+ 0 0 128 -4,-2.6 4,-2.3 2,-0.2 5,-0.2 0.890 113.6 51.0 -60.7 -43.7 -37.0 -26.0 46.8 1100 450 B F H X S+ 0 0 1 -4,-2.1 4,-2.4 -5,-0.2 -2,-0.2 0.947 112.5 44.6 -60.9 -51.6 -36.1 -25.6 50.5 1101 451 B L H X S+ 0 0 28 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.835 113.7 49.9 -68.2 -36.3 -33.9 -22.6 50.0 1102 452 B K H X S+ 0 0 123 -4,-2.0 4,-0.9 -5,-0.2 6,-0.2 0.928 114.1 44.6 -63.8 -48.2 -36.3 -20.8 47.6 1103 453 B A H <>S+ 0 0 16 -4,-2.3 5,-2.1 1,-0.2 3,-0.5 0.917 114.1 50.4 -60.7 -43.7 -39.3 -21.3 50.0 1104 454 B F H ><5S+ 0 0 22 -4,-2.4 3,-1.5 1,-0.2 -2,-0.2 0.900 105.8 53.2 -67.0 -45.1 -37.3 -20.3 53.0 1105 455 B K H 3<5S+ 0 0 129 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.725 111.2 48.9 -62.8 -23.8 -35.9 -17.1 51.5 1106 456 B E T 3<5S- 0 0 71 -4,-0.9 -1,-0.3 -3,-0.5 -2,-0.2 0.201 111.2-113.6-100.3 10.3 -39.5 -15.9 50.7 1107 457 B G T < 5S+ 0 0 66 -3,-1.5 2,-0.3 1,-0.2 -3,-0.2 0.737 75.9 135.5 57.9 17.9 -41.2 -16.6 54.0 1108 458 B K < - 0 0 134 -5,-2.1 2,-0.4 -6,-0.2 -1,-0.2 -0.766 67.7 -99.7 -89.7 141.8 -43.1 -19.3 52.2 1109 459 B N - 0 0 155 -2,-0.3 -5,-0.1 -3,-0.1 3,-0.1 -0.502 35.3-132.6 -70.4 121.1 -43.3 -22.5 54.1 1110 460 B Y - 0 0 61 -2,-0.4 2,-0.4 1,-0.1 -10,-0.1 -0.286 32.5 -93.5 -53.6 154.6 -40.8 -25.1 53.0 1111 461 B D >> - 0 0 95 1,-0.1 4,-2.0 -15,-0.1 3,-0.8 -0.638 22.9-137.7 -75.8 126.9 -42.0 -28.7 52.4 1112 462 B K H 3> S+ 0 0 141 -2,-0.4 4,-2.8 1,-0.2 5,-0.2 0.895 104.8 57.5 -46.2 -49.7 -41.7 -31.0 55.4 1113 463 B A H 3> S+ 0 0 48 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.842 106.5 48.7 -53.5 -38.4 -40.5 -33.8 53.1 1114 464 B D H <> S+ 0 0 9 -3,-0.8 4,-1.9 2,-0.2 -1,-0.2 0.907 109.9 50.0 -71.4 -43.7 -37.6 -31.6 51.8 1115 465 B F H X S+ 0 0 7 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.947 113.1 48.4 -53.6 -51.1 -36.5 -30.6 55.3 1116 466 B E H X S+ 0 0 86 -4,-2.8 4,-2.9 1,-0.2 -2,-0.2 0.842 105.6 57.2 -60.4 -36.7 -36.5 -34.3 56.2 1117 467 B T H X S+ 0 0 52 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.906 110.1 45.1 -60.4 -43.5 -34.5 -35.2 53.0 1118 468 B L H X S+ 0 0 1 -4,-1.9 4,-2.7 2,-0.2 5,-0.2 0.928 112.7 50.4 -63.4 -50.3 -31.7 -32.8 54.2 1119 469 B Q H X S+ 0 0 77 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.920 111.0 49.5 -49.1 -52.2 -31.9 -34.2 57.8 1120 470 B Y H X S+ 0 0 139 -4,-2.9 4,-2.3 2,-0.2 -1,-0.2 0.875 111.2 50.2 -54.4 -44.1 -31.7 -37.8 56.4 1121 471 B T H X S+ 0 0 9 -4,-1.9 4,-2.5 2,-0.2 -2,-0.2 0.918 109.9 48.4 -66.2 -46.8 -28.6 -36.8 54.3 1122 472 B F H X S+ 0 0 2 -4,-2.7 4,-2.0 1,-0.2 -1,-0.2 0.900 112.1 50.6 -62.1 -39.8 -26.8 -35.2 57.2 1123 473 B E H X S+ 0 0 105 -4,-2.3 4,-2.1 -5,-0.2 -2,-0.2 0.921 111.2 47.3 -62.8 -44.3 -27.5 -38.2 59.3 1124 474 B R H X S+ 0 0 34 -4,-2.3 4,-2.8 1,-0.2 -2,-0.2 0.870 108.1 57.1 -65.2 -38.8 -26.1 -40.6 56.6 1125 475 B M H X S+ 0 0 0 -4,-2.5 4,-2.7 2,-0.2 -1,-0.2 0.940 108.3 45.2 -56.8 -46.7 -23.1 -38.4 56.2 1126 476 B K H X S+ 0 0 60 -4,-2.0 4,-2.4 2,-0.2 5,-0.2 0.899 112.8 52.0 -67.8 -40.0 -22.1 -38.7 59.9 1127 477 B E H X S+ 0 0 79 -4,-2.1 4,-2.0 1,-0.2 5,-0.2 0.959 113.3 44.4 -54.9 -52.1 -22.7 -42.5 59.8 1128 478 B S H X S+ 0 0 0 -4,-2.8 4,-2.8 2,-0.2 -2,-0.2 0.892 112.3 51.3 -61.8 -46.8 -20.5 -42.8 56.7 1129 479 B A H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.940 113.1 44.8 -57.5 -49.5 -17.7 -40.6 58.1 1130 480 B D H X S+ 0 0 63 -4,-2.4 4,-1.0 2,-0.2 -1,-0.2 0.864 115.5 46.2 -67.8 -34.6 -17.5 -42.4 61.4 1131 481 B I H X S+ 0 0 78 -4,-2.0 4,-0.7 -5,-0.2 3,-0.3 0.925 112.6 50.4 -74.1 -43.8 -17.6 -45.9 59.8 1132 482 B L H >< S+ 0 0 0 -4,-2.8 3,-1.1 1,-0.2 -2,-0.2 0.918 106.2 56.7 -58.6 -41.7 -15.0 -45.0 57.2 1133 483 B L H 3< S+ 0 0 34 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.859 112.9 40.0 -56.9 -39.8 -12.6 -43.6 59.8 1134 484 B M H 3< S+ 0 0 144 -4,-1.0 -1,-0.3 -3,-0.3 -2,-0.2 0.449 85.8 122.0 -92.6 -1.9 -12.6 -46.9 61.7 1135 485 B N << + 0 0 20 -3,-1.1 7,-0.1 -4,-0.7 -3,-0.0 -0.427 33.0 178.7 -67.2 131.6 -12.4 -49.1 58.7 1136 486 B T > + 0 0 104 -2,-0.2 3,-0.5 1,-0.1 -1,-0.1 0.248 60.0 89.5-114.6 7.6 -9.4 -51.5 58.7 1137 487 B E T 3 S+ 0 0 101 1,-0.3 2,-0.3 2,-0.1 -1,-0.1 0.883 108.2 16.5 -74.5 -39.4 -10.1 -53.4 55.4 1138 488 B N T 3> S+ 0 0 22 1,-0.1 4,-1.8 -77,-0.0 -1,-0.3 -0.746 73.6 171.5-130.5 83.5 -8.1 -50.9 53.3 1139 489 B K H <> S+ 0 0 135 -3,-0.5 4,-2.9 -2,-0.3 5,-0.2 0.910 76.0 57.0 -61.7 -40.9 -6.1 -48.9 55.8 1140 490 B P H > S+ 0 0 73 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.920 106.9 49.3 -63.0 -38.9 -4.1 -47.0 53.1 1141 491 B L H > S+ 0 0 6 2,-0.2 4,-2.1 1,-0.2 -2,-0.2 0.931 111.0 49.5 -57.4 -47.2 -7.3 -45.7 51.5 1142 492 B I H X S+ 0 0 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