==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 02-JUL-07 2JIW . COMPND 2 MOLECULE: O-GLCNACASE BT_4395; . SOURCE 2 ORGANISM_SCIENTIFIC: BACTEROIDES THETAIOTAOMICRON; . AUTHOR R.J.DENNIS,G.J.DAVIES . 1180 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 49197.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 801 67.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 104 8.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 48 4.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 4 0.3 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 . 60 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 97 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 432 36.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 17 1.4 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 2 5 3 4 0 4 0 0 2 0 0 2 0 2 0 0 0 1 1 0 RESIDUES PER ALPHA HELIX . 0 4 0 10 4 2 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 . 2 0 0 0 4 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 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 0 103 0, 0.0 2,-0.4 0, 0.0 398,-0.0 0.000 360.0 360.0 360.0 158.6 -14.5 13.9 -0.2 2 5 A L - 0 0 22 4,-0.0 101,-0.1 105,-0.0 105,-0.0 -0.997 360.0-129.8-118.4 131.7 -11.4 14.7 2.0 3 6 A Q S S+ 0 0 7 -2,-0.4 383,-0.1 1,-0.3 380,-0.0 -0.985 97.3 23.1-132.9 120.3 -8.9 11.8 2.1 4 7 A P S S- 0 0 0 0, 0.0 -1,-0.3 0, 0.0 382,-0.1 0.631 105.9-125.2 -63.6 155.3 -7.9 10.9 4.7 5 8 A P - 0 0 29 0, 0.0 388,-0.1 0, 0.0 -2,-0.1 -0.476 31.2-111.7 -70.2 134.3 -11.1 12.4 6.4 6 9 A P - 0 0 12 0, 0.0 3,-0.2 0, 0.0 114,-0.2 -0.239 15.0-117.9 -68.9 160.1 -10.1 14.8 9.2 7 10 A Q S S+ 0 0 50 1,-0.2 2,-0.4 114,-0.1 113,-0.2 0.929 101.2 17.6 -59.8 -47.9 -10.7 14.2 12.9 8 11 A Q E +A 119 0A 84 111,-2.2 111,-1.8 2,-0.0 2,-0.4 -0.993 68.3 172.8-132.6 130.3 -13.0 17.2 13.1 9 12 A L E -A 118 0A 76 -2,-0.4 2,-0.5 109,-0.2 109,-0.2 -0.995 10.2-174.9-135.3 126.0 -14.8 19.1 10.4 10 13 A I E -A 117 0A 70 107,-2.2 107,-1.9 -2,-0.4 2,-0.5 -0.986 15.9-161.3-115.2 117.2 -17.4 21.8 10.6 11 14 A V E -A 116 0A 74 -2,-0.5 2,-0.4 105,-0.2 105,-0.2 -0.852 6.8-159.5 -99.4 127.5 -18.8 22.9 7.2 12 15 A Q E -A 115 0A 95 103,-3.2 103,-0.7 -2,-0.5 -2,-0.0 -0.874 26.5-126.3 -95.7 142.0 -20.6 26.2 6.7 13 16 A N E S+ 0 0 164 -2,-0.4 2,-0.2 101,-0.1 103,-0.1 0.268 81.4 94.7 -83.8 15.7 -22.7 26.1 3.6 14 17 A K E - 0 0 102 101,-0.2 101,-1.9 0, 0.0 2,-0.3 -0.592 59.6-155.7 -86.7 159.0 -21.2 29.2 2.1 15 18 A T E -A 114 0A 89 99,-0.2 2,-0.3 -2,-0.2 -2,-0.0 -0.979 7.0-159.3-129.1 150.9 -18.3 29.1 -0.4 16 19 A I E -A 113 0A 14 97,-2.9 97,-2.7 -2,-0.3 2,-0.4 -0.774 22.1-103.9-120.3 171.5 -15.7 31.8 -1.1 17 20 A D E -A 112 0A 113 -2,-0.3 95,-0.2 95,-0.2 94,-0.1 -0.802 35.3-112.7 -93.1 133.5 -13.3 32.6 -3.9 18 21 A L - 0 0 13 93,-2.8 2,-0.4 -2,-0.4 4,-0.0 -0.520 62.1 -76.4 -56.1 124.2 -9.6 31.9 -3.5 19 22 A P - 0 0 3 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.527 32.0-169.3 -65.3 121.1 -8.0 35.4 -3.4 20 23 A A S S+ 0 0 62 -2,-0.4 2,-0.4 1,-0.2 -2,-0.1 0.507 89.8 19.9 84.5-106.9 -7.6 37.3 -5.9 21 24 A V S S+ 0 0 72 2,-0.0 31,-0.8 32,-0.0 2,-0.3 -0.998 82.3 174.5-124.9 138.9 -5.4 39.6 -3.9 22 25 A Y E -b 52 0A 20 24,-1.8 26,-1.6 -2,-0.4 2,-0.5 -0.977 32.8-138.4-142.2 147.5 -3.9 38.2 -0.7 23 26 A Q E -b 53 0A 53 29,-2.5 31,-2.8 -2,-0.3 2,-0.6 -0.962 24.0-147.2-100.9 124.9 -1.5 39.0 2.1 24 27 A L E -b 54 0A 44 -2,-0.5 2,-0.6 29,-0.2 31,-0.2 -0.857 13.1-164.7 -91.2 118.0 0.7 36.0 3.0 25 28 A N E +b 55 0A 67 29,-3.3 31,-2.9 -2,-0.6 -2,-0.0 -0.924 69.4 5.0-105.0 114.1 1.4 36.0 6.7 26 29 A G S >> S+ 0 0 12 -2,-0.6 4,-2.2 29,-0.2 3,-0.8 0.501 75.6 133.7 96.5 7.5 4.3 33.7 7.9 27 30 A G T 34 S+ 0 0 16 1,-0.2 8,-0.1 2,-0.2 -2,-0.1 0.710 76.2 51.9 -59.8 -23.8 5.7 32.4 4.5 28 31 A E T 34 S+ 0 0 188 1,-0.1 -1,-0.2 7,-0.0 -3,-0.0 0.760 118.1 35.6 -83.8 -26.4 9.3 33.1 5.7 29 32 A E T <4 S+ 0 0 75 -3,-0.8 -2,-0.2 27,-0.2 29,-0.1 0.589 100.3 90.2-102.3 -18.9 8.9 31.2 9.0 30 33 A A S < S- 0 0 5 -4,-2.2 64,-0.1 26,-0.2 5,-0.0 -0.294 97.2 -67.3 -80.1 162.8 6.6 28.3 8.0 31 34 A N > - 0 0 0 1,-0.2 4,-2.6 63,-0.1 3,-0.3 -0.307 43.5-141.9 -44.1 116.4 7.6 24.8 6.7 32 35 A P H > S+ 0 0 86 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.827 101.5 57.9 -55.7 -34.0 9.1 25.5 3.2 33 36 A H H > S+ 0 0 58 2,-0.2 4,-1.4 1,-0.2 5,-0.1 0.911 110.4 42.8 -62.2 -42.7 7.5 22.4 1.9 34 37 A A H > S+ 0 0 0 -3,-0.3 4,-2.5 2,-0.2 -1,-0.2 0.913 112.8 52.0 -68.5 -44.5 4.1 23.8 3.0 35 38 A V H X S+ 0 0 10 -4,-2.6 4,-3.1 1,-0.2 5,-0.2 0.911 106.7 54.7 -60.9 -41.2 4.8 27.3 1.6 36 39 A K H X S+ 0 0 124 -4,-2.6 4,-1.9 2,-0.2 -1,-0.2 0.902 109.7 46.0 -55.6 -47.9 5.9 25.8 -1.7 37 40 A V H X S+ 0 0 24 -4,-1.4 4,-1.9 2,-0.2 -2,-0.2 0.944 113.7 50.3 -58.7 -50.8 2.5 24.0 -2.0 38 41 A L H X S+ 0 0 0 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.911 110.0 48.8 -55.4 -49.0 0.6 27.2 -1.0 39 42 A K H < S+ 0 0 98 -4,-3.1 -1,-0.2 1,-0.2 -2,-0.2 0.860 107.9 54.7 -64.7 -33.1 2.5 29.3 -3.5 40 43 A E H >< S+ 0 0 121 -4,-1.9 3,-0.9 -5,-0.2 -1,-0.2 0.887 110.6 46.5 -64.4 -38.3 1.7 26.8 -6.3 41 44 A L H 3< S+ 0 0 46 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.2 0.829 114.1 47.4 -69.1 -34.0 -2.0 27.1 -5.5 42 45 A L T >< S+ 0 0 3 -4,-1.9 3,-0.9 -5,-0.2 -1,-0.2 0.190 84.7 157.7 -91.4 14.5 -1.8 30.9 -5.4 43 46 A S T < - 0 0 91 -3,-0.9 -3,-0.1 1,-0.2 -4,-0.0 -0.146 68.3 -3.2 -53.8 126.4 0.1 30.9 -8.7 44 47 A G T 3 S+ 0 0 76 -5,-0.1 -1,-0.2 1,-0.1 -4,-0.0 0.897 98.9 115.5 57.8 50.7 -0.2 34.3 -10.5 45 48 A K S < S- 0 0 50 -3,-0.9 -23,-0.2 -26,-0.1 -2,-0.1 0.364 71.2-115.8-132.3 3.5 -2.5 35.9 -8.0 46 49 A Q - 0 0 144 -25,-0.1 -24,-1.8 -4,-0.1 2,-0.3 0.905 14.3-139.9 67.5 110.5 -0.5 38.9 -6.4 47 50 A S E +b 22 0A 79 -26,-0.2 -24,-0.2 1,-0.1 2,-0.1 -0.730 37.1 147.8 -88.7 149.4 0.5 39.3 -2.8 48 51 A S E - 0 0 68 -26,-1.6 -24,-0.2 -2,-0.3 3,-0.1 -0.129 56.9 -95.8-143.0-121.0 0.2 42.8 -1.4 49 52 A K E S+ 0 0 167 1,-0.5 2,-0.2 -26,-0.1 -26,-0.1 0.295 104.4 49.5-153.4 -26.1 -0.5 44.3 2.1 50 53 A K E S+ 0 0 176 -28,-0.1 -1,-0.5 2,-0.0 -2,-0.2 -0.653 86.7 62.1-103.6 174.4 -4.3 44.9 1.8 51 54 A G E S- 0 0 33 -2,-0.2 -28,-0.3 -3,-0.1 -29,-0.2 -0.101 97.7 -11.4 86.7 166.8 -6.7 42.2 0.5 52 55 A M E -b 22 0A 33 -31,-0.8 -29,-2.5 -30,-0.2 2,-0.3 0.050 68.0-128.3 -47.2 125.9 -7.5 38.7 2.0 53 56 A L E -bc 23 86A 43 32,-0.8 34,-2.4 -31,-0.2 2,-0.5 -0.576 21.7-172.8 -77.3 129.7 -5.2 37.5 4.8 54 57 A I E -bc 24 87A 0 -31,-2.8 -29,-3.3 -2,-0.3 2,-0.5 -0.978 7.7-165.2-120.4 114.5 -3.7 34.0 4.6 55 58 A S E +bc 25 88A 1 32,-2.9 34,-2.8 -2,-0.5 2,-0.4 -0.883 11.1 173.6-105.3 124.9 -1.8 33.0 7.7 56 59 A I E + c 0 89A 0 -31,-2.9 2,-0.3 -2,-0.5 34,-0.2 -0.991 21.8 104.8-129.6 137.4 0.6 30.0 7.6 57 60 A G E - c 0 90A 0 32,-1.8 34,-2.0 -2,-0.4 2,-0.3 -0.947 58.2 -90.0 172.5 172.3 2.9 28.8 10.3 58 61 A E E > - c 0 91A 12 -2,-0.3 3,-3.1 32,-0.2 6,-0.3 -0.792 61.1 -79.0-100.3 150.2 3.7 26.3 13.1 59 62 A K T 3 S+ 0 0 85 32,-2.8 -1,-0.1 -2,-0.3 3,-0.1 -0.183 125.1 35.4 -42.8 127.9 2.5 26.6 16.7 60 63 A G T 3 S+ 0 0 79 1,-0.4 -1,-0.3 4,-0.1 2,-0.2 0.059 90.4 118.6 106.5 -25.1 5.0 29.1 18.2 61 64 A D S X S- 0 0 29 -3,-3.1 3,-1.5 1,-0.1 -1,-0.4 -0.523 72.3-124.1 -70.4 139.9 5.3 31.2 15.0 62 65 A K G > S+ 0 0 133 1,-0.3 3,-1.3 -2,-0.2 4,-0.3 0.857 106.3 63.8 -48.1 -43.4 4.2 34.9 15.1 63 66 A S G 3 S+ 0 0 8 1,-0.2 -1,-0.3 -7,-0.2 3,-0.2 0.705 108.7 36.6 -59.1 -26.4 1.8 34.3 12.2 64 67 A V G X S+ 0 0 2 -3,-1.5 3,-1.3 -6,-0.3 4,-0.3 0.210 77.9 114.7-118.9 16.2 -0.5 31.9 14.0 65 68 A R G X S+ 0 0 159 -3,-1.3 3,-0.8 -4,-0.3 4,-0.2 0.803 75.7 56.7 -49.5 -37.4 -0.4 33.4 17.5 66 69 A K G 3 S+ 0 0 150 -4,-0.3 -1,-0.3 1,-0.2 3,-0.2 0.771 110.7 44.1 -71.7 -22.3 -4.1 34.2 17.3 67 70 A Y G X> S+ 0 0 13 -3,-1.3 3,-1.4 1,-0.2 4,-1.2 0.245 72.7 115.3-109.6 11.3 -5.0 30.5 16.6 68 71 A S T <4 S+ 0 0 51 -3,-0.8 -1,-0.2 -4,-0.3 -2,-0.1 0.767 75.7 54.6 -58.1 -30.1 -2.8 28.6 19.2 69 72 A R T 34 S+ 0 0 222 -3,-0.2 -1,-0.3 1,-0.2 4,-0.1 0.736 107.3 50.5 -75.7 -26.3 -5.8 27.2 21.1 70 73 A Q T <4 S+ 0 0 38 -3,-1.4 -2,-0.2 2,-0.1 -1,-0.2 0.700 85.1 99.4 -84.9 -19.0 -7.3 25.7 18.0 71 74 A I S < S- 0 0 7 -4,-1.2 8,-0.1 8,-0.1 20,-0.1 -0.544 83.4-117.9 -70.0 113.9 -4.1 23.9 16.9 72 75 A P - 0 0 17 0, 0.0 2,-1.9 0, 0.0 5,-0.2 -0.238 14.9-127.2 -57.7 139.2 -4.4 20.2 18.1 73 76 A D S S+ 0 0 137 -4,-0.1 2,-0.3 5,-0.0 48,-0.1 -0.425 73.7 109.5 -86.7 61.2 -1.8 19.2 20.6 74 77 A H S > S- 0 0 84 -2,-1.9 3,-2.0 46,-0.1 18,-0.2 -0.985 79.4 -97.3-134.1 144.8 -0.8 16.2 18.5 75 78 A K T 3 S+ 0 0 140 -2,-0.3 3,-0.1 1,-0.3 -2,-0.0 -0.420 114.2 9.7 -52.8 130.3 2.3 15.3 16.5 76 79 A E T 3 S+ 0 0 4 1,-0.2 -1,-0.3 45,-0.1 2,-0.1 0.539 101.4 141.9 69.9 10.5 1.5 16.1 12.8 77 80 A G < - 0 0 0 -3,-2.0 15,-3.0 -5,-0.2 16,-0.6 -0.362 26.7-177.9 -79.1 159.0 -1.7 17.9 13.9 78 81 A Y E -DE 91 120A 0 42,-2.9 42,-2.5 13,-0.3 2,-0.4 -0.996 26.1-137.8-153.4 158.1 -3.0 21.0 12.3 79 82 A Y E -DE 90 119A 9 11,-3.1 11,-2.8 -2,-0.3 2,-0.4 -0.981 24.0-176.9-113.4 128.3 -5.8 23.7 12.4 80 83 A L E +DE 89 118A 0 38,-2.6 38,-3.2 -2,-0.4 2,-0.3 -0.988 3.4 175.5-121.1 137.4 -7.2 24.8 9.0 81 84 A S E -DE 88 117A 9 7,-2.3 7,-3.1 -2,-0.4 2,-0.4 -0.996 10.4-176.6-141.0 139.5 -9.8 27.6 8.6 82 85 A V E +DE 87 116A 3 34,-2.4 34,-0.6 -2,-0.3 2,-0.2 -0.988 24.0 138.5-128.5 121.6 -11.4 29.2 5.6 83 86 A N - 0 0 34 3,-2.1 -2,-0.0 -2,-0.4 -67,-0.0 -0.833 65.2 -85.9-140.7-170.5 -13.9 32.1 5.9 84 87 A E S S+ 0 0 129 -2,-0.2 3,-0.1 1,-0.2 -67,-0.1 0.894 124.7 44.1 -60.1 -44.0 -14.9 35.4 4.4 85 88 A K S S- 0 0 136 1,-0.2 -32,-0.8 -33,-0.1 2,-0.3 0.923 122.7 -20.8 -73.7 -46.1 -12.3 37.2 6.5 86 89 A E E -c 53 0A 15 -34,-0.1 -3,-2.1 2,-0.0 2,-0.4 -0.964 46.9-119.0-158.7 166.6 -9.3 35.0 6.3 87 90 A I E -cD 54 82A 0 -34,-2.4 -32,-2.9 -2,-0.3 2,-0.4 -0.980 26.0-164.4-116.7 131.4 -7.5 31.6 5.6 88 91 A V E +cD 55 81A 0 -7,-3.1 -7,-2.3 -2,-0.4 2,-0.4 -0.968 14.2 174.4-121.0 129.2 -5.6 29.9 8.4 89 92 A L E +cD 56 80A 0 -34,-2.8 -32,-1.8 -2,-0.4 2,-0.5 -0.848 20.1 163.3-134.4 92.5 -3.1 27.0 7.8 90 93 A A E -cD 57 79A 0 -11,-2.8 -11,-3.1 -2,-0.4 2,-0.2 -0.930 19.0-163.1-131.0 108.5 -1.5 26.2 11.2 91 94 A G E -cD 58 78A 0 -34,-2.0 -32,-2.8 -2,-0.5 -13,-0.3 -0.596 25.6-138.5 -89.6 151.1 0.5 23.1 12.1 92 95 A N S S+ 0 0 31 -15,-3.0 2,-0.3 -2,-0.2 -14,-0.1 0.775 97.5 2.4 -67.4 -28.2 1.3 21.9 15.5 93 96 A D S > S- 0 0 44 -16,-0.6 4,-1.7 -36,-0.1 -1,-0.1 -0.860 95.9 -84.3-147.6 175.3 4.7 21.1 14.0 94 97 A E H > S+ 0 0 105 -2,-0.3 4,-1.6 1,-0.2 -60,-0.1 0.889 128.7 48.3 -56.6 -41.2 6.4 21.6 10.5 95 98 A R H > S+ 0 0 35 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.857 105.9 58.7 -69.1 -36.6 4.9 18.4 9.2 96 99 A G H > S+ 0 0 0 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.878 103.8 52.2 -52.7 -41.6 1.4 19.4 10.5 97 100 A T H X S+ 0 0 0 -4,-1.7 4,-1.6 2,-0.2 -2,-0.2 0.910 107.8 50.3 -65.8 -43.2 1.6 22.5 8.4 98 101 A Y H X S+ 0 0 9 -4,-1.6 4,-1.7 1,-0.2 -1,-0.2 0.907 109.6 52.4 -56.5 -42.2 2.4 20.5 5.3 99 102 A Y H X S+ 0 0 0 -4,-2.2 4,-1.8 1,-0.2 -2,-0.2 0.891 104.3 55.5 -65.2 -37.6 -0.6 18.3 6.1 100 103 A A H X S+ 0 0 0 -4,-2.1 4,-2.6 1,-0.2 -1,-0.2 0.881 107.8 50.7 -57.5 -39.9 -2.9 21.4 6.4 101 104 A L H X S+ 0 0 0 -4,-1.6 4,-2.8 2,-0.2 -1,-0.2 0.869 105.2 54.9 -69.6 -35.6 -1.8 22.2 2.9 102 105 A Q H X S+ 0 0 11 -4,-1.7 4,-0.7 2,-0.2 -1,-0.2 0.842 113.0 42.9 -65.8 -34.3 -2.6 18.8 1.6 103 106 A T H >X S+ 0 0 0 -4,-1.8 4,-1.4 2,-0.2 3,-0.8 0.912 112.5 53.6 -72.9 -43.6 -6.2 19.1 2.9 104 107 A F H 3X S+ 0 0 0 -4,-2.6 4,-1.4 1,-0.3 3,-0.5 0.896 103.3 57.1 -58.9 -41.6 -6.4 22.7 1.6 105 108 A A H 3< S+ 0 0 33 -4,-2.8 -1,-0.3 1,-0.2 -2,-0.2 0.803 107.9 48.2 -59.4 -30.5 -5.4 21.5 -1.9 106 109 A Q H << S+ 0 0 59 -3,-0.8 -1,-0.2 -4,-0.7 -2,-0.2 0.748 106.3 56.2 -81.3 -27.2 -8.4 19.1 -1.9 107 110 A L H < S+ 0 0 13 -4,-1.4 2,-0.5 -3,-0.5 -2,-0.2 0.816 84.4 94.8 -72.2 -33.2 -10.9 21.7 -0.7 108 111 A L < - 0 0 40 -4,-1.4 2,-0.6 5,-0.1 5,-0.2 -0.507 55.7-175.2 -70.8 112.0 -10.1 24.1 -3.6 109 112 A K B > -F 112 0A 153 3,-3.3 3,-1.3 -2,-0.5 -1,-0.1 -0.898 65.7 -42.0-119.1 101.0 -12.6 23.4 -6.3 110 113 A D T 3 S- 0 0 165 -2,-0.6 -1,-0.2 1,-0.2 3,-0.1 0.929 125.0 -34.5 36.8 68.9 -12.0 25.4 -9.5 111 114 A G T 3 S+ 0 0 35 1,-0.2 -93,-2.8 -94,-0.1 2,-0.3 0.313 122.9 101.3 80.1 -7.3 -11.1 28.7 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129.4 49.0 -91.3 -10.3 25.3 -11.8 0.9 172 175 A N G >4 S+ 0 0 55 -6,-0.3 3,-1.2 1,-0.3 -2,-0.2 0.335 76.7 99.3 -82.1 11.4 25.8 -8.3 -0.4 173 176 A W G 3< S+ 0 0 0 -4,-0.8 -1,-0.3 1,-0.2 -3,-0.1 0.838 82.2 59.1 -54.6 -29.8 24.1 -6.7 2.5 174 177 A R G < S+ 0 0 53 -3,-1.3 -1,-0.2 -5,-0.1 -2,-0.2 0.671 94.7 81.5 -70.6 -22.5 27.8 -6.1 3.5 175 178 A L S < S- 0 0 73 -3,-1.2 2,-0.1 -4,-0.1 43,-0.0 -0.684 82.4-118.0 -91.8 141.2 28.6 -4.2 0.3 176 179 A P - 0 0 70 0, 0.0 3,-0.1 0, 0.0 -1,-0.1 -0.407 43.6 -93.2 -66.9 149.9 27.8 -0.5 -0.3 177 180 A Y - 0 0 13 1,-0.1 6,-0.0 -10,-0.1 0, 0.0 -0.342 47.9-104.2 -54.9 141.3 25.5 0.3 -3.3 178 181 A P > - 0 0 47 0, 0.0 4,-2.8 0, 0.0 5,-0.2 -0.266 42.5 -94.5 -60.9 166.2 27.4 0.9 -6.5 179 182 A D H > S+ 0 0 148 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.832 121.4 51.1 -55.4 -45.2 27.5 4.6 -7.5 180 183 A K H > S+ 0 0 143 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.950 116.2 39.9 -60.6 -54.2 24.5 4.6 -9.8 181 184 A E H > S+ 0 0 69 2,-0.2 4,-2.9 1,-0.2 -2,-0.2 0.877 113.4 56.0 -62.0 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393 B N >< + 0 0 2 -4,-2.2 3,-0.7 -5,-0.2 -1,-0.2 -0.627 67.5 164.1-136.9 73.4 -15.8 -52.7 26.4 982 394 B P G > S+ 0 0 7 0, 0.0 3,-1.8 0, 0.0 -1,-0.1 0.855 73.1 64.5 -63.7 -31.2 -16.9 -49.1 25.7 983 395 B A G 3 S+ 0 0 72 1,-0.3 -35,-0.1 -34,-0.0 -5,-0.1 0.839 112.6 35.5 -61.4 -33.2 -20.1 -50.2 23.8 984 396 B K G < S+ 0 0 137 -3,-0.7 -1,-0.3 -7,-0.1 2,-0.3 0.177 86.5 140.5-101.3 10.9 -21.5 -51.7 27.0 985 397 B Y < - 0 0 27 -3,-1.8 2,-0.6 -7,-0.2 -37,-0.1 -0.431 30.7-170.3 -67.0 124.9 -20.0 -49.1 29.3 986 398 B D > - 0 0 87 -2,-0.3 4,-2.0 1,-0.2 5,-0.2 -0.938 6.2-163.0-119.2 103.9 -22.4 -48.3 32.1 987 399 B T H > S+ 0 0 35 -2,-0.6 4,-1.4 1,-0.2 -44,-0.3 0.880 84.5 38.2 -55.5 -54.5 -21.2 -45.3 34.1 988 400 B W H > S+ 0 0 100 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.908 117.0 48.1 -70.6 -43.4 -23.3 -45.6 37.3 989 401 B Q H > S+ 0 0 81 1,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.887 111.8 50.9 -66.0 -35.7 -23.3 -49.4 37.6 990 402 B T H X S+ 0 0 2 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.851 107.3 53.8 -69.0 -38.6 -19.5 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-2,-0.3 -1,-0.0 1,-0.3 0, 0.0 0.642 118.9 54.6 -65.4 -17.6 -8.7 -22.6 36.1 1021 433 B H T 3 S- 0 0 47 2,-0.1 -1,-0.3 -88,-0.1 -118,-0.2 0.536 99.7-134.1 -91.5 -8.8 -9.5 -25.5 33.8 1022 434 B G < + 0 0 54 -3,-1.7 2,-0.4 1,-0.2 -2,-0.1 0.676 55.4 144.2 64.7 20.6 -13.3 -24.9 34.0 1023 435 B Y + 0 0 17 -6,-0.1 2,-0.3 -7,-0.0 -1,-0.2 -0.789 21.1 170.0 -99.2 131.9 -13.9 -28.6 34.5 1024 436 B R - 0 0 93 -2,-0.4 2,-0.3 -3,-0.1 -9,-0.1 -0.893 18.9-153.1-134.0 162.7 -16.7 -29.8 36.8 1025 437 B R - 0 0 22 -2,-0.3 -8,-0.2 -8,-0.0 -11,-0.1 -0.946 32.8 -96.4-131.6 156.4 -18.5 -33.0 37.8 1026 438 B E + 0 0 102 -2,-0.3 2,-0.3 -12,-0.1 -85,-0.1 -0.326 44.9 177.4 -65.0 151.6 -22.0 -33.7 39.1 1027 439 B E + 0 0 4 -13,-0.1 -15,-0.2 -15,-0.1 -16,-0.1 -0.951 57.5 1.4-157.5 139.0 -22.3 -34.1 42.9 1028 440 B S S > S+ 0 0 2 -17,-2.1 4,-0.8 -2,-0.3 3,-0.1 0.765 73.9 152.9 59.3 29.3 -25.1 -34.6 45.4 1029 441 B M T 4 + 0 0 52 -18,-0.2 3,-0.3 1,-0.2 -1,-0.1 0.819 61.4 59.8 -61.8 -36.4 -27.6 -34.8 42.4 1030 442 B D T 4 S+ 0 0 139 1,-0.2 4,-0.4 2,-0.2 -1,-0.2 0.952 113.1 35.0 -60.0 -52.9 -30.2 -37.0 44.2 1031 443 B I T > S+ 0 0 17 1,-0.2 4,-2.3 2,-0.1 -1,-0.2 0.523 94.7 96.3 -79.4 -5.4 -30.8 -34.5 47.1 1032 444 B Q H X S+ 0 0 76 -4,-0.8 4,-2.4 -3,-0.3 -1,-0.2 0.797 80.4 48.6 -60.5 -39.7 -30.4 -31.5 44.9 1033 445 B P H > S+ 0 0 60 0, 0.0 4,-2.8 0, 0.0 -1,-0.2 0.946 112.6 48.7 -67.1 -44.0 -34.1 -30.8 44.1 1034 446 B A H > S+ 0 0 5 -4,-0.4 4,-2.6 1,-0.2 5,-0.2 0.897 114.2 48.0 -56.7 -41.9 -35.1 -31.1 47.8 1035 447 B A H X S+ 0 0 3 -4,-2.3 4,-2.4 2,-0.2 5,-0.2 0.932 112.6 46.5 -62.8 -50.4 -32.2 -28.7 48.7 1036 448 B E H X S+ 0 0 94 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.885 116.7 45.7 -62.1 -40.2 -33.2 -26.2 46.0 1037 449 B R H X S+ 0 0 115 -4,-2.8 4,-2.1 2,-0.2 -2,-0.2 0.923 112.8 48.2 -67.2 -49.3 -36.8 -26.3 47.0 1038 450 B F H X S+ 0 0 0 -4,-2.6 4,-0.9 -5,-0.2 -2,-0.2 0.940 118.0 42.5 -55.5 -50.1 -36.2 -26.0 50.8 1039 451 B L H X S+ 0 0 25 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.831 111.1 54.4 -65.4 -40.8 -33.8 -23.1 50.2 1040 452 B K H X S+ 0 0 83 -4,-2.1 4,-0.7 1,-0.2 -1,-0.2 0.824 101.6 59.2 -68.9 -32.8 -36.1 -21.4 47.6 1041 453 B A H X>S+ 0 0 8 -4,-2.1 5,-6.1 2,-0.2 4,-1.9 0.852 107.8 47.7 -59.7 -36.1 -39.0 -21.5 50.1 1042 454 B F H <5S+ 0 0 12 -4,-0.9 -2,-0.2 3,-0.2 -1,-0.2 0.929 109.7 49.1 -71.1 -46.6 -36.7 -19.4 52.4 1043 455 B K H <5S+ 0 0 161 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.561 121.6 38.3 -70.1 -8.4 -35.7 -16.8 49.7 1044 456 B E H <5S- 0 0 128 -4,-0.7 -2,-0.2 -3,-0.2 -1,-0.2 0.637 128.6 -85.0-112.7 -26.1 -39.4 -16.4 48.8 1045 457 B G T <5 - 0 0 59 -4,-1.9 -3,-0.2 -5,-0.1 -4,-0.1 0.522 68.5-136.1 130.1 14.1 -41.1 -16.6 52.2 1046 458 B K < + 0 0 86 -5,-6.1 2,-0.1 -6,-0.2 3,-0.0 -0.156 53.7 172.5 63.4-165.7 -41.7 -20.4 53.0 1047 459 B N - 0 0 150 1,-0.1 2,-0.3 -9,-0.0 -1,-0.1 0.786 39.0-155.4 -74.0 163.1 -43.2 -22.7 54.0 1048 460 B Y - 0 0 54 -2,-0.1 2,-0.3 -7,-0.1 -1,-0.1 -0.677 26.5 -98.6 -94.0 155.3 -41.0 -25.7 53.1 1049 461 B D >> - 0 0 94 -2,-0.3 4,-2.0 1,-0.1 3,-0.6 -0.575 21.4-136.3 -73.2 132.6 -42.2 -29.2 52.6 1050 462 B K H 3> S+ 0 0 137 -2,-0.3 4,-1.9 1,-0.2 -1,-0.1 0.765 105.5 60.1 -53.9 -29.3 -41.8 -31.5 55.6 1051 463 B A H 3> S+ 0 0 46 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.866 105.5 46.7 -72.4 -36.9 -40.5 -34.2 53.2 1052 464 B D H <> S+ 0 0 8 -3,-0.6 4,-2.1 2,-0.2 -2,-0.2 0.908 110.4 51.0 -68.4 -50.0 -37.6 -31.9 52.0 1053 465 B F H X S+ 0 0 6 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.908 114.3 46.6 -49.5 -47.4 -36.6 -30.9 55.6 1054 466 B E H X S+ 0 0 91 -4,-1.9 4,-2.8 2,-0.2 -2,-0.2 0.804 107.1 55.7 -69.3 -34.9 -36.6 -34.7 56.4 1055 467 B T H X S+ 0 0 49 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.910 110.4 46.6 -58.1 -47.0 -34.6 -35.6 53.3 1056 468 B L H X S+ 0 0 1 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.926 113.0 49.2 -62.9 -45.7 -31.9 -33.2 54.4 1057 469 B Q H X S+ 0 0 71 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.903 110.6 49.8 -57.8 -48.2 -32.0 -34.6 57.9 1058 470 B Y H X S+ 0 0 144 -4,-2.8 4,-2.3 1,-0.2 -1,-0.2 0.866 109.6 52.8 -58.2 -41.2 -31.7 -38.2 56.7 1059 471 B T H X S+ 0 0 9 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.896 108.3 48.7 -61.9 -43.9 -28.7 -37.2 54.5 1060 472 B F H X S+ 0 0 3 -4,-2.0 4,-2.0 1,-0.2 -2,-0.2 0.903 111.8 50.2 -69.3 -38.0 -26.8 -35.7 57.4 1061 473 B E H X S+ 0 0 103 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.910 112.0 46.5 -60.6 -46.3 -27.5 -38.8 59.6 1062 474 B R H X S+ 0 0 57 -4,-2.3 4,-2.7 1,-0.2 -2,-0.2 0.880 109.4 55.5 -67.4 -37.4 -26.3 -41.1 56.8 1063 475 B M H X S+ 0 0 0 -4,-2.5 4,-2.9 2,-0.2 -1,-0.2 0.914 108.5 47.4 -58.4 -47.1 -23.2 -38.9 56.3 1064 476 B K H X S+ 0 0 61 -4,-2.0 4,-2.3 2,-0.2 5,-0.2 0.902 111.9 50.5 -62.3 -43.2 -22.3 -39.2 60.0 1065 477 B E H X S+ 0 0 76 -4,-2.1 4,-2.4 2,-0.2 5,-0.2 0.944 113.4 45.3 -58.7 -50.4 -22.8 -43.0 59.9 1066 478 B S H X S+ 0 0 0 -4,-2.7 4,-3.0 2,-0.2 5,-0.2 0.930 111.3 52.4 -61.6 -48.0 -20.6 -43.3 56.8 1067 479 B A H X S+ 0 0 0 -4,-2.9 4,-2.4 2,-0.2 -2,-0.2 0.939 114.3 41.6 -51.6 -51.3 -17.8 -41.0 58.2 1068 480 B D H X S+ 0 0 64 -4,-2.3 4,-1.3 1,-0.2 -2,-0.2 0.894 116.0 48.4 -70.2 -40.4 -17.5 -43.0 61.5 1069 481 B I H < S+ 0 0 71 -4,-2.4 4,-0.5 -5,-0.2 -1,-0.2 0.896 112.6 49.7 -62.9 -40.2 -17.8 -46.4 59.9 1070 482 B L H >< S+ 0 0 0 -4,-3.0 3,-1.5 -5,-0.2 -2,-0.2 0.940 105.8 55.8 -66.1 -43.9 -15.1 -45.4 57.3 1071 483 B L H 3< S+ 0 0 34 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.853 113.5 41.6 -53.9 -37.9 -12.7 -44.1 59.9 1072 484 B M T 3< S+ 0 0 147 -4,-1.3 -1,-0.3 -5,-0.1 2,-0.2 0.416 84.6 124.0 -92.7 -0.9 -12.7 -47.4 61.7 1073 485 B N < + 0 0 18 -3,-1.5 7,-0.1 -4,-0.5 -3,-0.0 -0.437 33.4 180.0 -70.6 129.5 -12.6 -49.6 58.6 1074 486 B T + 0 0 106 -2,-0.2 3,-0.5 1,-0.1 -1,-0.1 0.361 62.1 85.2-111.7 0.1 -9.7 -52.1 58.7 1075 487 B E S S+ 0 0 98 1,-0.3 2,-0.3 2,-0.1 -1,-0.1 0.820 108.7 17.5 -75.6 -34.4 -10.2 -53.9 55.3 1076 488 B N S > S+ 0 0 20 1,-0.1 4,-1.7 -77,-0.1 -1,-0.3 -0.698 72.3 170.7-133.3 84.8 -8.4 -51.2 53.3 1077 489 B K H > S+ 0 0 134 -3,-0.5 4,-2.8 -2,-0.3 5,-0.2 0.931 75.8 56.7 -63.3 -45.6 -6.3 -49.3 55.8 1078 490 B P H > S+ 0 0 73 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.867 107.3 49.1 -53.5 -37.8 -4.3 -47.4 53.1 1079 491 B L H > S+ 0 0 4 -3,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.919 110.9 49.9 -66.1 -43.9 -7.5 -46.0 51.5 1080 492 B I H X S+ 0 0 10 -4,-1.7 4,-1.8 1,-0.2 -1,-0.2 0.934 108.6 52.6 -62.6 -44.7 -8.8 -44.9 54.9 1081 493 B V H < S+ 0 0 107 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.910 109.8 50.2 -54.7 -45.1 -5.5 -43.1 55.7 1082 494 B E H < S+ 0 0 35 -4,-1.8 4,-0.2 -5,-0.2 -1,-0.2 0.924 120.0 32.9 -58.1 -48.0 -5.8 -41.2 52.4 1083 495 B I H >X S+ 0 0 1 -4,-2.1 4,-2.7 1,-0.2 3,-0.7 0.562 89.1 101.5 -91.7 -11.3 -9.3 -40.0 52.8 1084 496 B T H 3X S+ 0 0 36 -4,-1.8 4,-2.6 1,-0.3 5,-0.2 0.823 79.8 51.0 -49.7 -44.7 -9.3 -39.6 56.7 1085 497 B P H 3> S+ 0 0 26 0, 0.0 4,-1.8 0, 0.0 -1,-0.3 0.914 115.1 44.2 -60.6 -43.4 -8.9 -35.8 56.7 1086 498 B W H <> S+ 0 0 3 -3,-0.7 4,-2.3 -4,-0.2 -2,-0.2 0.864 109.6 56.5 -65.6 -40.3 -11.8 -35.4 54.3 1087 499 B V H X S+ 0 0 1 -4,-2.7 4,-2.3 2,-0.2 -1,-0.2 0.920 107.3 48.6 -57.0 -44.7 -13.8 -37.9 56.3 1088 500 B H H X S+ 0 0 80 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.929 113.6 46.9 -57.6 -46.4 -13.4 -35.8 59.4 1089 501 B Q H X S+ 0 0 6 -4,-1.8 4,-2.3 1,-0.2 -1,-0.2 0.844 109.8 54.2 -64.6 -35.0 -14.5 -32.7 57.5 1090 502 B F H X S+ 0 0 0 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.896 108.5 48.2 -68.3 -44.3 -17.4 -34.6 56.0 1091 503 B K H X S+ 0 0 54 -4,-2.3 4,-2.6 2,-0.2 5,-0.2 0.915 110.6 51.7 -60.8 -45.4 -18.7 -35.6 59.5 1092 504 B L H X S+ 0 0 12 -4,-2.2 4,-3.0 2,-0.2 -2,-0.2 0.916 108.2 52.0 -57.3 -45.4 -18.3 -31.9 60.7 1093 505 B T H X S+ 0 0 0 -4,-2.3 4,-2.9 2,-0.2 -1,-0.2 0.917 110.7 48.3 -53.8 -49.6 -20.4 -30.8 57.7 1094 506 B A H X S+ 0 0 0 -4,-2.0 4,-2.4 2,-0.2 -2,-0.2 0.913 112.3 46.9 -59.6 -50.1 -23.1 -33.3 58.6 1095 507 B E H X S+ 0 0 50 -4,-2.6 4,-2.1 2,-0.2 -2,-0.2 0.894 112.6 51.0 -60.7 -41.8 -23.2 -32.3 62.3 1096 508 B M H X S+ 0 0 2 -4,-3.0 4,-2.6 -5,-0.2 -2,-0.2 0.943 109.0 51.7 -59.7 -47.6 -23.3 -28.6 61.2 1097 509 B G H X S+ 0 0 1 -4,-2.9 4,-2.4 1,-0.2 -2,-0.2 0.930 109.5 49.8 -51.7 -49.8 -26.2 -29.4 58.8 1098 510 B E H X S+ 0 0 38 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.905 112.2 46.6 -56.7 -45.0 -28.1 -31.0 61.7 1099 511 B E H X S+ 0 0 13 -4,-2.1 4,-1.2 1,-0.2 -1,-0.2 0.844 110.5 53.2 -68.7 -35.2 -27.5 -28.1 64.0 1100 512 B V H X S+ 0 0 2 -4,-2.6 4,-1.5 2,-0.2 -1,-0.2 0.891 108.2 50.6 -67.5 -37.2 -28.6 -25.6 61.3 1101 513 B L H X S+ 0 0 7 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.850 106.3 54.8 -68.7 -34.2 -31.8 -27.5 60.8 1102 514 B K H X S+ 0 0 72 -4,-1.7 4,-2.9 1,-0.2 5,-0.2 0.808 107.0 52.3 -64.9 -28.1 -32.5 -27.4 64.6 1103 515 B M H < S+ 0 0 5 -4,-1.2 -2,-0.2 2,-0.2 -1,-0.2 0.834 106.4 51.8 -73.6 -36.9 -32.1 -23.6 64.2 1104 516 B V H < S+ 0 0 15 -4,-1.5 -2,-0.2 1,-0.2 -1,-0.2 0.923 115.2 41.7 -62.0 -48.1 -34.7 -23.5 61.4 1105 517 B E H < S+ 0 0 88 -4,-2.2 -2,-0.2 -5,-0.1 -3,-0.2 0.933 89.9 165.5 -66.4 -49.4 -37.1 -25.5 63.6 1106 518 B G < - 0 0 28 -4,-2.9 -3,-0.1 -5,-0.2 -4,-0.1 0.780 22.9-166.5 42.7 76.3 -36.0 -23.3 66.5 1107 519 B R - 0 0 140 -5,-0.2 2,-0.3 1,-0.0 -1,-0.1 0.752 61.8 -14.6 -68.6 -30.9 -38.5 -23.7 69.3 1108 520 B N S > S- 0 0 81 1,-0.1 4,-1.7 0, 0.0 5,-0.1 -0.911 75.8 -83.6-161.6-177.0 -37.4 -20.8 71.5 1109 521 B E H > S+ 0 0 95 -2,-0.3 4,-1.7 1,-0.2 5,-0.1 0.917 119.5 41.5 -70.4 -45.6 -34.7 -18.1 72.1 1110 522 B S H > S+ 0 0 81 2,-0.2 4,-1.4 1,-0.2 -1,-0.2 0.787 113.1 54.1 -78.5 -27.0 -32.3 -20.0 74.3 1111 523 B Y H > S+ 0 0 26 2,-0.2 4,-2.3 1,-0.2 3,-0.2 0.937 107.9 51.1 -65.0 -48.1 -32.5 -23.2 72.3 1112 524 B F H X S+ 0 0 10 -4,-1.7 4,-3.2 1,-0.2 -2,-0.2 0.890 109.5 49.4 -55.1 -45.2 -31.7 -21.3 69.1 1113 525 B L H X S+ 0 0 54 -4,-1.7 4,-2.5 2,-0.2 -1,-0.2 0.800 108.0 54.5 -67.1 -31.7 -28.6 -19.7 70.8 1114 526 B R H X S+ 0 0 153 -4,-1.4 4,-2.4 -3,-0.2 -2,-0.2 0.932 113.7 41.6 -63.6 -45.5 -27.5 -23.2 72.0 1115 527 B K H X S+ 0 0 17 -4,-2.3 4,-2.5 2,-0.2 -2,-0.2 0.928 114.1 52.2 -67.0 -47.7 -27.6 -24.4 68.4 1116 528 B Y H X S+ 0 0 17 -4,-3.2 4,-2.2 2,-0.2 -2,-0.2 0.891 111.4 46.7 -51.9 -48.1 -26.1 -21.2 67.1 1117 529 B N H X S+ 0 0 99 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.910 111.0 51.3 -66.1 -44.7 -23.2 -21.5 69.5 1118 530 B H H X S+ 0 0 81 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.896 109.8 51.2 -52.3 -43.9 -22.6 -25.2 68.7 1119 531 B V H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.920 106.1 53.7 -66.7 -43.1 -22.6 -24.2 65.0 1120 532 B K H X S+ 0 0 32 -4,-2.2 4,-1.6 1,-0.2 -1,-0.2 0.910 109.4 49.7 -53.2 -47.5 -19.9 -21.5 65.6 1121 533 B A H X S+ 0 0 36 -4,-2.0 4,-2.2 2,-0.2 -1,-0.2 0.859 109.3 50.9 -57.5 -42.8 -17.8 -24.2 67.3 1122 534 B L H X S+ 0 0 2 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.836 107.0 54.7 -66.2 -36.2 -18.2 -26.6 64.4 1123 535 B Q H X S+ 0 0 9 -4,-2.3 4,-2.1 2,-0.2 55,-0.3 0.892 109.2 47.7 -59.9 -42.4 -17.1 -23.8 62.0 1124 536 B Q H X S+ 0 0 84 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.897 110.0 52.4 -68.5 -40.3 -13.9 -23.3 64.0 1125 537 B Q H X S+ 0 0 105 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.896 109.8 48.8 -60.4 -40.8 -13.3 -27.1 64.0 1126 538 B M H X S+ 0 0 17 -4,-2.2 4,-2.4 1,-0.2 -2,-0.2 0.899 109.2 53.3 -64.3 -41.3 -13.7 -27.2 60.2 1127 539 B F H X S+ 0 0 50 -4,-2.1 4,-0.7 2,-0.2 -2,-0.2 0.911 106.3 53.2 -57.8 -46.1 -11.3 -24.2 59.9 1128 540 B Y H >X S+ 0 0 156 -4,-2.2 4,-1.3 2,-0.2 3,-1.2 0.937 109.8 46.4 -55.7 -52.7 -8.7 -26.1 62.0 1129 541 B I H >X S+ 0 0 19 -4,-2.0 4,-2.6 1,-0.3 3,-0.8 0.937 110.1 55.0 -55.9 -45.2 -8.8 -29.2 59.8 1130 542 B D H 3< S+ 0 0 36 -4,-2.4 -1,-0.3 1,-0.2 -2,-0.2 0.635 115.4 39.3 -62.7 -16.1 -8.5 -26.8 56.7 1131 543 B Q H << S+ 0 0 95 -3,-1.2 -1,-0.2 -4,-0.7 -2,-0.2 0.521 122.9 37.5-109.6 -11.5 -5.4 -25.3 58.2 1132 544 B T H << S+ 0 0 65 -4,-1.3 3,-0.4 -3,-0.8 2,-0.2 0.760 104.9 65.6-113.3 -33.9 -3.7 -28.3 59.6 1133 545 B S S < S+ 0 0 32 -4,-2.6 8,-0.5 -5,-0.3 3,-0.1 -0.616 107.6 4.2 -93.5 149.2 -4.4 -31.1 57.1 1134 546 B N S S+ 0 0 41 -2,-0.2 7,-2.2 1,-0.2 2,-1.8 0.875 72.9 179.7 50.7 49.5 -3.2 -31.4 53.5 1135 547 B Q + 0 0 91 -3,-0.4 -1,-0.2 5,-0.2 -4,-0.0 -0.492 15.0 155.4 -86.8 73.3 -1.1 -28.2 53.7 1136 548 B N - 0 0 24 -2,-1.8 -200,-0.0 3,-0.1 -3,-0.0 -0.482 53.5-113.3 -90.5 165.7 0.4 -28.1 50.2 1137 549 B P S S+ 0 0 105 0, 0.0 -1,-0.1 0, 0.0 -2,-0.1 0.534 105.6 45.0 -78.7 -2.3 1.6 -24.9 48.6 1138 550 B Y S S- 0 0 147 1,-0.1 -205,-0.0 -206,-0.0 -3,-0.0 0.883 130.9 -2.1-108.8 -60.9 -1.1 -24.8 45.9 1139 551 B Q S S- 0 0 54 -5,-0.1 -3,-0.1 2,-0.1 -1,-0.1 -0.681 82.5-167.6-129.5 78.1 -4.6 -25.6 47.2 1140 552 B P + 0 0 56 0, 0.0 -5,-0.2 0, 0.0 -204,-0.2 -0.216 38.6 21.1 -68.7 156.2 -4.0 -26.3 50.8 1141 553 B G S S- 0 0 0 -7,-2.2 2,-0.4 -8,-0.5 -11,-0.1 -0.403 84.5 -57.1 98.8-159.2 -6.6 -27.9 53.1 1142 554 B V + 0 0 2 -16,-0.2 2,-0.4 -2,-0.1 -205,-0.2 -0.916 38.7 175.2-141.7 104.1 -9.8 -30.0 53.0 1143 555 B K + 0 0 60 -207,-2.9 -205,-0.4 -2,-0.4 2,-0.3 -0.883 10.8 172.3-108.5 145.5 -13.0 -29.2 51.2 1144 556 B T + 0 0 5 -2,-0.4 6,-0.2 -55,-0.1 -131,-0.2 -0.997 58.3 9.6-149.3 147.9 -15.9 -31.7 51.1 1145 557 B A S >S+ 0 0 0 -133,-1.4 5,-2.8 -2,-0.3 -132,-0.1 0.896 76.8 152.4 52.8 44.9 -19.6 -31.7 49.9 1146 558 B T T 5 + 0 0 37 -134,-0.2 -1,-0.1 3,-0.2 -133,-0.1 0.691 51.0 60.6 -87.3 -24.2 -19.0 -28.4 48.2 1147 559 B R T 5S- 0 0 109 -135,-0.2 -1,-0.2 3,-0.1 -119,-0.1 0.945 127.0 -9.4 -75.3 -47.9 -21.4 -28.4 45.3 1148 560 B V T >5S+ 0 0 16 3,-0.1 4,-2.0 -136,-0.1 5,-0.1 0.760 127.7 52.2-118.2 -44.5 -24.8 -28.7 47.1 1149 561 B I H >5S+ 0 0 0 2,-0.2 4,-2.6 1,-0.2 5,-0.2 0.954 109.0 42.3 -74.0 -53.8 -24.5 -29.4 50.8 1150 562 B K H > S+ 0 0 32 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.943 113.0 47.0 -53.9 -48.4 -23.7 -24.0 50.2 1152 564 B L H X S+ 0 0 4 -4,-2.0 4,-2.3 2,-0.2 -2,-0.2 0.901 114.6 45.4 -55.1 -49.2 -27.2 -25.1 51.4 1153 565 B I H X S+ 0 0 4 -4,-2.6 4,-2.4 2,-0.2 -1,-0.2 0.921 116.0 46.5 -62.9 -43.9 -26.0 -25.3 55.1 1154 566 B D H X S+ 0 0 19 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.886 114.4 46.3 -69.1 -45.4 -24.2 -22.0 54.9 1155 567 B R H X S+ 0 0 139 -4,-2.8 4,-2.0 -5,-0.3 -1,-0.2 0.849 112.6 50.3 -62.5 -39.9 -27.1 -20.2 53.2 1156 568 B T H X S+ 0 0 3 -4,-2.3 4,-2.7 -5,-0.2 5,-0.3 0.898 110.9 49.6 -68.5 -42.4 -29.6 -21.7 55.7 1157 569 B F H X S+ 0 0 1 -4,-2.4 4,-2.2 2,-0.2 5,-0.3 0.969 111.4 48.6 -55.7 -56.0 -27.5 -20.6 58.6 1158 570 B A H X S+ 0 0 35 -4,-2.5 4,-1.7 1,-0.2 -2,-0.2 0.887 114.5 47.5 -52.0 -43.3 -27.1 -17.0 57.2 1159 571 B T H X S+ 0 0 39 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.951 111.7 45.0 -69.0 -55.1 -30.9 -16.9 56.7 1160 572 B V H X S+ 0 0 9 -4,-2.7 4,-1.8 1,-0.2 -1,-0.2 0.793 113.7 52.3 -61.9 -28.8 -32.2 -18.2 60.0 1161 573 B V H X S+ 0 0 0 -4,-2.2 4,-2.2 -5,-0.3 -1,-0.2 0.864 108.0 51.6 -70.1 -39.9 -29.7 -15.9 61.8 1162 574 B K H X S+ 0 0 108 -4,-1.7 4,-1.2 -5,-0.3 -2,-0.2 0.898 112.5 45.6 -61.7 -42.5 -31.0 -13.0 59.8 1163 575 B F H X S+ 0 0 77 -4,-2.2 4,-2.6 2,-0.2 -2,-0.2 0.843 111.8 50.9 -70.9 -37.6 -34.6 -13.8 60.8 1164 576 B F H X S+ 0 0 11 -4,-1.8 4,-2.8 2,-0.2 6,-0.3 0.882 108.6 52.2 -65.6 -41.8 -33.7 -14.3 64.5 1165 577 B N H <>S+ 0 0 33 -4,-2.2 5,-1.0 2,-0.2 -1,-0.2 0.793 114.1 43.6 -64.4 -32.3 -31.9 -10.9 64.5 1166 578 B Q H ><5S+ 0 0 116 -4,-1.2 3,-0.5 3,-0.2 -2,-0.2 0.885 117.9 44.4 -74.2 -46.0 -35.1 -9.3 63.1 1167 579 B K H 3<5S+ 0 0 161 -4,-2.6 -2,-0.2 1,-0.2 -3,-0.2 0.873 125.1 30.9 -68.5 -40.9 -37.4 -11.1 65.4 1168 580 B F T 3<5S- 0 0 63 -4,-2.8 -1,-0.2 -5,-0.2 -2,-0.1 0.113 103.4-120.0-110.4 19.1 -35.4 -10.7 68.6 1169 581 B N T < 5 + 0 0 143 -3,-0.5 -3,-0.2 1,-0.1 -4,-0.2 0.872 66.7 149.0 44.7 45.9 -33.9 -7.3 67.7 1170 582 B A < - 0 0 26 -5,-1.0 -1,-0.1 -6,-0.3 -5,-0.0 -0.424 52.6-139.3-109.2 177.6 -30.5 -9.1 68.1 1171 583 B H + 0 0 183 -2,-0.1 3,-0.1 -3,-0.1 -9,-0.1 -0.096 35.6 160.3-135.6 36.3 -27.0 -8.8 66.5 1172 584 B L - 0 0 37 -11,-0.2 2,-0.4 1,-0.1 -7,-0.1 -0.302 47.8-106.3 -62.3 141.9 -25.7 -12.4 66.0 1173 585 B D - 0 0 81 1,-0.1 -1,-0.1 2,-0.0 -2,-0.0 -0.578 27.5-166.4 -71.7 121.8 -22.8 -12.8 63.5 1174 586 B A + 0 0 39 -2,-0.4 -1,-0.1 -3,-0.1 -13,-0.1 0.335 43.4 127.3 -93.9 6.5 -24.2 -14.4 60.3 1175 587 B T - 0 0 74 1,-0.1 3,-0.1 -18,-0.1 -2,-0.0 -0.376 43.6-161.2 -73.2 147.5 -20.8 -15.3 58.8 1176 588 B T + 0 0 32 1,-0.1 2,-0.5 -2,-0.1 -1,-0.1 0.583 68.5 62.9-113.3 -17.9 -20.3 -18.9 57.7 1177 589 B D S S- 0 0 105 -51,-0.0 -1,-0.1 -23,-0.0 -53,-0.1 -0.963 85.9-119.3-112.2 124.1 -16.6 -19.5 57.6 1178 590 B Y - 0 0 79 -2,-0.5 -2,-0.1 -55,-0.3 -57,-0.0 -0.355 32.0-178.4 -59.6 133.5 -14.6 -19.1 60.8 1179 591 B M - 0 0 120 1,-0.1 -55,-0.0 -2,-0.1 -1,-0.0 -0.961 17.1-168.4-135.7 114.8 -12.0 -16.4 60.6 1180 592 B P 0 0 60 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 0.849 360.0 360.0 -70.5 -32.3 -9.7 -15.8 63.7 1181 593 B H 0 0 208 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 0.761 360.0 360.0 -94.3 360.0 -8.3 -12.5 62.3