==== 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 TRANSFERASE 09-JUL-05 2A8U . COMPND 2 MOLECULE: ABO BLOOD GROUP (TRANSFERASE A, ALPHA 1-3-N- . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR J.A.LETTS,N.L.ROSE,Y.R.FANG,C.H.BARRY,S.N.BORISOVA,N.O.SETO, . 263 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13762.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 165 62.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 35 13.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 17 6.5 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 . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 21 8.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 33 12.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 52 19.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.8 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 1 0 1 0 0 1 0 1 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 1 1 1 0 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 PARALLEL BRIDGES PER LADDER . 2 1 1 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 0 ANTIPARALLEL BRIDGES PER LADDER . 0 1 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 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 62 A F 0 0 235 0, 0.0 2,-0.5 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 117.4 20.8 41.0 10.5 2 63 A M - 0 0 86 49,-0.0 49,-0.1 1,-0.0 45,-0.0 -0.918 360.0-129.1-109.3 123.1 18.9 44.4 10.3 3 64 A V - 0 0 70 -2,-0.5 2,-0.2 47,-0.2 47,-0.1 -0.178 34.3 -94.8 -62.9 159.5 16.4 44.9 7.5 4 65 A S - 0 0 102 1,-0.1 -1,-0.1 46,-0.0 0, 0.0 -0.500 37.9-111.7 -79.7 147.1 16.7 48.0 5.4 5 66 A L - 0 0 65 -2,-0.2 2,-0.1 1,-0.1 -1,-0.1 -0.379 32.7-117.7 -72.8 153.9 14.6 51.1 6.2 6 67 A P - 0 0 63 0, 0.0 -1,-0.1 0, 0.0 40,-0.0 -0.404 47.6 -68.7 -86.6 170.4 11.9 52.1 3.7 7 68 A R - 0 0 217 -2,-0.1 2,-0.4 1,-0.0 0, 0.0 -0.356 60.8-175.5 -57.8 134.2 11.8 55.4 1.8 8 69 A M - 0 0 51 -3,-0.1 2,-0.6 2,-0.1 -3,-0.0 -0.998 19.7-147.3-138.0 140.3 11.2 58.2 4.3 9 70 A V + 0 0 116 -2,-0.4 -2,-0.0 3,-0.0 3,-0.0 -0.936 39.7 132.2-111.7 117.4 10.7 62.0 3.8 10 71 A Y - 0 0 104 -2,-0.6 -2,-0.1 32,-0.0 30,-0.0 -0.971 60.8 -64.0-155.6 164.9 12.1 64.3 6.5 11 72 A P - 0 0 115 0, 0.0 3,-0.0 0, 0.0 -2,-0.0 -0.270 56.9-113.2 -55.5 133.7 14.2 67.4 7.0 12 73 A Q - 0 0 142 1,-0.1 2,-0.1 -3,-0.0 -3,-0.0 -0.498 32.2-114.6 -70.2 131.7 17.7 67.0 5.8 13 74 A P - 0 0 100 0, 0.0 2,-0.7 0, 0.0 -1,-0.1 -0.415 26.8-133.2 -66.4 145.5 20.2 67.2 8.7 14 75 A K > - 0 0 116 3,-0.3 3,-2.1 1,-0.2 -2,-0.0 -0.867 13.2-163.8-108.9 106.7 22.5 70.2 8.6 15 76 A V T 3 S+ 0 0 140 -2,-0.7 -1,-0.2 1,-0.3 0, 0.0 0.821 93.5 44.3 -51.9 -38.2 26.2 69.5 9.1 16 77 A L T 3 S+ 0 0 161 1,-0.1 -1,-0.3 2,-0.1 -2,-0.0 0.226 100.9 77.6 -96.1 14.3 26.9 73.1 9.7 17 78 A T S < S- 0 0 88 -3,-2.1 -3,-0.3 3,-0.0 -1,-0.1 -0.910 81.9-132.9-125.4 102.2 23.9 73.8 12.0 18 79 A P - 0 0 69 0, 0.0 3,-0.2 0, 0.0 -2,-0.1 -0.188 9.3-132.0 -55.5 142.3 24.4 72.5 15.5 19 80 A C S S- 0 0 64 1,-0.3 2,-0.4 19,-0.1 19,-0.0 0.984 90.9 -1.0 -55.6 -64.3 21.5 70.5 17.0 20 81 A R - 0 0 12 3,-0.2 -1,-0.3 1,-0.1 5,-0.2 -0.984 57.0-170.3-129.8 138.7 21.5 72.4 20.3 21 82 A K S S+ 0 0 181 -2,-0.4 -1,-0.1 -3,-0.2 -2,-0.1 0.453 84.7 59.4-106.7 -4.5 23.8 75.2 21.1 22 83 A D S S+ 0 0 89 1,-0.1 2,-0.3 232,-0.1 -1,-0.1 0.595 106.4 35.8 -99.8 -13.5 22.8 75.4 24.7 23 84 A V S S- 0 0 27 12,-0.0 2,-0.5 231,-0.0 -3,-0.2 -0.945 82.2-101.0-141.2 160.9 23.6 71.9 25.9 24 85 A L - 0 0 95 -2,-0.3 3,-0.1 1,-0.1 -3,-0.1 -0.690 32.3-179.1 -79.4 123.4 26.1 69.0 25.5 25 86 A V + 0 0 46 -2,-0.5 8,-2.6 1,-0.2 2,-0.3 0.398 65.2 39.9-107.0 1.8 24.6 66.4 23.2 26 87 A V B S-A 32 0A 57 6,-0.3 -1,-0.2 8,-0.1 210,-0.0 -0.980 76.4-130.0-150.1 136.6 27.4 63.8 23.2 27 88 A T > - 0 0 3 4,-2.8 3,-2.0 -2,-0.3 6,-0.0 -0.324 35.7-100.2 -80.6 168.5 29.7 62.6 26.0 28 89 A P T 3 S+ 0 0 114 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 0.637 125.8 54.9 -64.3 -14.1 33.5 62.4 25.8 29 90 A W T 3 S- 0 0 66 2,-0.1 -2,-0.1 205,-0.1 204,-0.0 0.086 124.6-104.9-105.4 23.1 33.2 58.7 25.1 30 91 A L S < S+ 0 0 145 -3,-2.0 205,-0.0 1,-0.2 -4,-0.0 0.794 71.2 144.7 60.8 37.5 30.9 59.4 22.2 31 92 A A - 0 0 3 203,-0.1 -4,-2.8 205,-0.0 -1,-0.2 -0.888 52.8-115.3-102.2 131.1 27.6 58.4 23.8 32 93 A P B -A 26 0A 65 0, 0.0 205,-2.2 0, 0.0 2,-0.6 -0.347 16.9-142.8 -64.7 145.6 24.6 60.6 22.8 33 94 A I E -b 237 0B 4 -8,-2.6 2,-0.7 203,-0.2 205,-0.2 -0.971 26.2-127.5-109.7 115.7 23.0 62.7 25.5 34 95 A V E +b 238 0B 6 203,-2.5 205,-1.8 -2,-0.6 2,-0.3 -0.566 43.7 152.5 -76.4 106.8 19.3 62.6 24.8 35 96 A W > - 0 0 12 -2,-0.7 3,-2.0 203,-0.1 4,-0.4 -0.911 54.4 -88.6-126.1 154.4 17.6 66.0 24.6 36 97 A E T 3 S+ 0 0 47 -2,-0.3 220,-0.1 1,-0.3 221,-0.0 -0.420 116.0 33.5 -62.7 134.4 14.5 67.1 22.6 37 98 A G T 3 S+ 0 0 42 2,-0.3 -1,-0.3 -2,-0.1 -3,-0.0 0.217 96.2 87.6 103.6 -13.9 15.6 68.2 19.2 38 99 A T S < S+ 0 0 52 -3,-2.0 2,-0.3 1,-0.1 -2,-0.1 0.662 86.1 49.6 -91.0 -17.2 18.5 65.7 18.8 39 100 A F - 0 0 44 -4,-0.4 2,-0.8 4,-0.0 -2,-0.3 -0.927 64.7-140.7-130.2 149.9 16.5 62.9 17.4 40 101 A N > - 0 0 51 -2,-0.3 4,-1.8 1,-0.1 3,-0.5 -0.917 20.0-161.3-101.8 106.2 14.0 62.2 14.6 41 102 A I H > S+ 0 0 42 -2,-0.8 4,-2.7 1,-0.2 5,-0.2 0.744 84.9 62.6 -63.8 -23.7 11.6 59.7 16.4 42 103 A D H > S+ 0 0 98 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.919 105.8 44.8 -67.9 -42.9 10.2 58.5 13.0 43 104 A I H > S+ 0 0 36 -3,-0.5 4,-2.4 2,-0.2 -2,-0.2 0.953 116.2 46.7 -65.0 -48.3 13.6 57.1 12.0 44 105 A L H X S+ 0 0 29 -4,-1.8 4,-2.5 1,-0.2 5,-0.3 0.897 109.5 53.2 -62.1 -41.7 14.2 55.6 15.4 45 106 A N H X S+ 0 0 43 -4,-2.7 4,-2.6 1,-0.2 5,-0.2 0.920 109.9 49.7 -59.6 -42.1 10.7 54.0 15.6 46 107 A E H X S+ 0 0 64 -4,-1.9 4,-2.2 2,-0.2 -2,-0.2 0.936 109.7 50.6 -60.4 -49.4 11.3 52.4 12.2 47 108 A Q H < S+ 0 0 73 -4,-2.4 4,-0.4 1,-0.2 -2,-0.2 0.929 116.7 39.2 -57.3 -47.8 14.7 51.0 13.3 48 109 A F H ><>S+ 0 0 26 -4,-2.5 5,-1.9 1,-0.2 3,-0.7 0.837 113.3 53.1 -75.2 -32.1 13.3 49.5 16.4 49 110 A R H ><5S+ 0 0 103 -4,-2.6 3,-2.2 -5,-0.3 -1,-0.2 0.888 101.6 60.6 -68.9 -36.6 10.0 48.2 15.0 50 111 A L T 3<5S+ 0 0 61 -4,-2.2 -1,-0.2 1,-0.3 -47,-0.2 0.705 107.3 46.7 -62.1 -18.3 11.9 46.4 12.2 51 112 A Q T < 5S- 0 0 84 -3,-0.7 -1,-0.3 -4,-0.4 -2,-0.2 0.359 110.1-126.8-102.1 3.0 13.6 44.4 15.0 52 113 A N T < 5 - 0 0 67 -3,-2.2 -3,-0.2 1,-0.2 -2,-0.1 0.912 37.9-159.6 48.6 49.2 10.2 43.8 16.8 53 114 A T < - 0 0 5 -5,-1.9 32,-1.1 71,-0.1 2,-0.5 -0.304 11.4-157.0 -62.0 134.5 11.8 45.2 19.9 54 115 A T E -c 85 0B 6 -3,-0.1 70,-2.5 30,-0.1 71,-1.6 -0.968 5.7-158.3-116.2 126.2 10.2 44.3 23.3 55 116 A I E -cd 86 125B 0 30,-2.9 32,-2.6 -2,-0.5 2,-0.5 -0.902 3.1-152.9-108.5 128.6 10.8 46.7 26.2 56 117 A G E -cd 87 126B 0 69,-3.3 71,-2.5 -2,-0.5 2,-0.5 -0.838 6.8-161.9 -97.6 133.5 10.4 45.5 29.8 57 118 A L E -cd 88 127B 0 30,-2.5 32,-2.9 -2,-0.5 2,-0.4 -0.969 9.3-163.2-117.2 116.6 9.5 48.2 32.4 58 119 A T E +cd 89 128B 10 69,-2.9 71,-1.9 -2,-0.5 2,-0.3 -0.843 13.2 169.2-106.5 136.5 10.2 47.2 36.0 59 120 A V E -c 90 0B 2 30,-2.4 32,-2.8 -2,-0.4 2,-0.5 -0.994 23.7-142.2-142.5 145.4 8.8 48.9 39.0 60 121 A F E -c 91 0B 123 69,-0.5 71,-0.4 -2,-0.3 2,-0.4 -0.922 15.9-179.4-109.1 133.2 8.7 48.1 42.7 61 122 A A E +c 92 0B 0 30,-3.1 32,-0.7 -2,-0.5 33,-0.4 -0.806 13.3 166.4-135.0 91.5 5.6 48.9 44.7 62 123 A I > - 0 0 67 -2,-0.4 3,-2.0 30,-0.2 4,-0.1 -0.836 54.8 -24.7-109.4 145.7 5.9 47.9 48.4 63 124 A K G > S- 0 0 109 -2,-0.3 3,-1.3 1,-0.3 4,-0.1 -0.285 133.6 -4.8 56.8-132.4 3.7 48.9 51.3 64 125 A K G > S+ 0 0 105 1,-0.3 3,-1.5 2,-0.1 -1,-0.3 0.530 116.6 84.9 -71.4 -4.2 1.9 52.2 50.6 65 126 A Y G X + 0 0 84 -3,-2.0 3,-1.6 1,-0.3 4,-0.3 0.598 68.9 80.7 -73.4 -7.7 3.7 52.7 47.3 66 127 A V G X S+ 0 0 21 -3,-1.3 3,-1.1 1,-0.3 4,-0.4 0.751 78.4 72.0 -67.6 -20.4 1.1 50.5 45.7 67 128 A A G < S+ 0 0 85 -3,-1.5 4,-0.3 1,-0.2 -1,-0.3 0.660 91.1 57.1 -67.9 -16.7 -1.0 53.7 45.7 68 129 A F G <> S+ 0 0 46 -3,-1.6 4,-2.0 1,-0.2 -1,-0.2 0.587 84.0 85.3 -90.0 -11.9 1.2 55.2 42.9 69 130 A L H <> S+ 0 0 0 -3,-1.1 4,-3.1 -4,-0.3 5,-0.3 0.879 81.2 56.6 -59.8 -44.4 0.6 52.3 40.5 70 131 A K H > S+ 0 0 113 -4,-0.4 4,-2.5 1,-0.2 5,-0.2 0.948 113.9 37.9 -55.3 -53.9 -2.7 53.5 38.9 71 132 A L H > S+ 0 0 63 -4,-0.3 4,-2.3 2,-0.2 64,-0.3 0.897 116.7 53.3 -65.4 -40.5 -1.3 56.9 37.7 72 133 A F H X S+ 0 0 0 -4,-2.0 4,-1.7 1,-0.2 63,-0.3 0.955 115.3 38.8 -59.1 -52.5 2.1 55.4 36.8 73 134 A L H X S+ 0 0 0 -4,-3.1 4,-2.0 2,-0.2 -2,-0.2 0.890 114.7 53.2 -67.8 -40.7 0.6 52.7 34.6 74 135 A E H X S+ 0 0 71 -4,-2.5 4,-0.7 -5,-0.3 -1,-0.2 0.899 113.6 42.5 -62.5 -41.6 -2.1 54.9 33.1 75 136 A T H X S+ 0 0 15 -4,-2.3 4,-1.9 -5,-0.2 5,-0.3 0.811 109.4 57.8 -75.5 -29.2 0.4 57.6 32.0 76 137 A A H X S+ 0 0 0 -4,-1.7 4,-2.9 -5,-0.3 -2,-0.2 0.896 102.0 57.1 -65.7 -37.0 2.9 55.0 30.8 77 138 A E H < S+ 0 0 32 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.823 112.1 41.6 -62.0 -29.9 0.1 53.8 28.5 78 139 A K H < S+ 0 0 154 -4,-0.7 -1,-0.2 -3,-0.2 -2,-0.2 0.775 133.8 14.3 -88.9 -26.0 -0.1 57.2 27.0 79 140 A H H < S+ 0 0 51 -4,-1.9 60,-2.3 59,-0.1 2,-0.7 0.617 96.1 94.4-125.9 -16.7 3.6 58.1 26.8 80 141 A F B < S-i 139 0C 0 -4,-2.9 60,-0.2 -5,-0.3 4,-0.1 -0.746 107.5 -38.6 -94.9 113.7 5.8 55.0 27.2 81 142 A M S > S- 0 0 2 58,-2.7 3,-2.3 -2,-0.7 -1,-0.2 0.787 76.6-171.0 50.1 35.3 7.1 53.2 24.1 82 143 A V T 3 S+ 0 0 85 1,-0.3 -1,-0.2 -3,-0.2 3,-0.1 -0.358 70.4 27.9 -60.8 128.8 3.7 53.6 22.3 83 144 A G T 3 S+ 0 0 59 1,-0.4 -1,-0.3 22,-0.2 2,-0.2 0.154 109.2 88.8 105.5 -17.0 3.7 51.5 19.2 84 145 A H S < S- 0 0 9 -3,-2.3 -1,-0.4 -4,-0.1 2,-0.4 -0.671 89.2 -89.2-111.0 165.9 6.1 49.0 20.5 85 146 A R E -c 54 0B 94 -32,-1.1 -30,-2.9 -2,-0.2 2,-0.4 -0.606 48.3-174.6 -75.4 126.8 5.8 45.8 22.5 86 147 A V E -ce 55 107B 1 20,-1.6 22,-2.4 -2,-0.4 2,-0.5 -0.980 16.5-169.5-128.4 136.6 5.9 46.5 26.3 87 148 A H E -ce 56 108B 4 -32,-2.6 -30,-2.5 -2,-0.4 2,-0.4 -0.968 12.9-155.4-126.0 113.1 6.0 44.2 29.2 88 149 A Y E -ce 57 109B 2 20,-3.3 22,-2.8 -2,-0.5 2,-0.5 -0.708 3.7-163.0 -86.9 138.6 5.4 45.7 32.6 89 150 A Y E -ce 58 110B 0 -32,-2.9 -30,-2.4 -2,-0.4 2,-0.7 -0.962 4.4-168.6-124.5 111.1 6.8 43.9 35.6 90 151 A V E -ce 59 111B 0 20,-2.8 22,-2.9 -2,-0.5 2,-0.7 -0.893 4.0-162.3-105.0 112.0 5.3 45.0 38.9 91 152 A F E +ce 60 112B 19 -32,-2.8 -30,-3.1 -2,-0.7 2,-0.3 -0.833 29.4 151.4 -94.0 116.8 7.1 43.7 42.0 92 153 A T E -ce 61 113B 0 20,-2.1 22,-1.9 -2,-0.7 -30,-0.2 -0.971 54.9-141.1-147.5 160.4 4.9 44.0 45.0 93 154 A D S S+ 0 0 65 -32,-0.7 -31,-0.1 -2,-0.3 20,-0.1 0.392 102.9 55.4 -97.0 -0.7 4.1 42.6 48.4 94 155 A Q > + 0 0 68 -33,-0.4 3,-2.1 1,-0.1 4,-0.4 -0.577 59.0 169.8-133.2 70.9 0.4 43.2 47.7 95 156 A P G > S+ 0 0 49 0, 0.0 3,-1.4 0, 0.0 -1,-0.1 0.861 81.0 55.5 -49.0 -41.6 -0.6 41.4 44.4 96 157 A A G 3 S+ 0 0 107 1,-0.3 -2,-0.0 3,-0.0 0, 0.0 0.667 99.6 62.1 -68.6 -15.7 -4.3 42.1 45.1 97 158 A A G < S+ 0 0 42 -3,-2.1 -1,-0.3 2,-0.1 -4,-0.0 0.522 73.4 112.5 -88.3 -6.3 -3.7 45.8 45.4 98 159 A V S < S- 0 0 22 -3,-1.4 -31,-0.1 -4,-0.4 -32,-0.0 -0.527 73.2-118.7 -69.4 125.9 -2.4 46.2 41.9 99 160 A P - 0 0 33 0, 0.0 2,-1.3 0, 0.0 -1,-0.1 -0.299 17.2-114.6 -67.4 149.1 -4.9 48.4 40.0 100 161 A R - 0 0 246 2,-0.0 2,-0.4 -2,-0.0 -30,-0.0 -0.715 44.2-179.1 -84.4 94.7 -6.8 47.0 36.9 101 162 A V - 0 0 27 -2,-1.3 2,-0.4 1,-0.0 -31,-0.0 -0.829 27.9-122.1-101.3 136.1 -5.4 49.3 34.2 102 163 A T - 0 0 131 -2,-0.4 2,-0.3 1,-0.0 -25,-0.1 -0.620 31.9-156.1 -77.3 127.1 -6.5 49.0 30.6 103 164 A L - 0 0 49 -2,-0.4 3,-0.1 4,-0.1 4,-0.1 -0.780 13.0-117.9-109.3 150.4 -3.6 48.3 28.3 104 165 A G > - 0 0 33 -2,-0.3 3,-1.2 1,-0.2 -1,-0.1 -0.284 51.9 -74.1 -74.4 166.9 -3.1 48.9 24.6 105 166 A T T 3 S+ 0 0 149 1,-0.2 -22,-0.2 -20,-0.0 -1,-0.2 -0.270 119.1 27.3 -61.8 146.4 -2.5 46.0 22.2 106 167 A G T 3 S+ 0 0 45 1,-0.2 -20,-1.6 -3,-0.1 2,-0.4 0.603 100.8 106.4 77.8 10.7 0.9 44.4 22.3 107 168 A R E < +e 86 0B 25 -3,-1.2 2,-0.3 -22,-0.2 -1,-0.2 -0.974 44.3 177.4-126.3 137.3 1.4 45.4 25.9 108 169 A Q E -e 87 0B 93 -22,-2.4 -20,-3.3 -2,-0.4 2,-0.4 -0.930 16.9-146.7-137.3 160.9 1.2 43.2 29.0 109 170 A L E -e 88 0B 51 -2,-0.3 2,-0.4 -22,-0.2 -20,-0.2 -0.994 8.3-168.2-133.5 132.5 1.6 43.3 32.7 110 171 A S E -e 89 0B 22 -22,-2.8 -20,-2.8 -2,-0.4 2,-0.5 -0.957 12.0-147.2-119.1 135.9 3.0 40.7 35.1 111 172 A V E -e 90 0B 58 -2,-0.4 2,-0.5 -22,-0.2 -20,-0.2 -0.893 12.5-169.4-103.7 127.9 2.7 40.9 38.9 112 173 A L E -e 91 0B 39 -22,-2.9 -20,-2.1 -2,-0.5 2,-0.3 -0.968 14.9-141.5-119.4 116.3 5.6 39.3 40.8 113 174 A E E e 92 0B 143 -2,-0.5 -20,-0.2 -22,-0.2 -22,-0.1 -0.594 360.0 360.0 -79.1 133.2 5.0 38.9 44.6 114 175 A V 0 0 95 -22,-1.9 -1,-0.0 -2,-0.3 0, 0.0 -0.739 360.0 360.0-116.5 360.0 8.1 39.6 46.7 115 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 116 197 A E >> 0 0 110 0, 0.0 4,-0.7 0, 0.0 3,-0.6 0.000 360.0 360.0 360.0 135.8 15.7 36.5 36.5 117 198 A R H 3> + 0 0 214 1,-0.2 4,-1.0 2,-0.2 5,-0.1 0.674 360.0 74.9 -70.5 -17.1 16.4 34.2 33.5 118 199 A R H >> S+ 0 0 84 1,-0.2 4,-1.3 2,-0.2 3,-0.6 0.906 87.9 56.7 -60.6 -45.6 12.8 35.1 32.6 119 200 A F H <> S+ 0 0 15 -3,-0.6 4,-2.4 1,-0.2 3,-0.3 0.869 99.9 58.1 -56.2 -42.7 13.9 38.6 31.4 120 201 A L H 3< S+ 0 0 91 -4,-0.7 -1,-0.2 1,-0.2 -2,-0.2 0.850 114.0 37.6 -59.0 -35.8 16.4 37.3 28.9 121 202 A S H << S+ 0 0 100 -4,-1.0 -1,-0.2 -3,-0.6 -2,-0.2 0.607 121.1 44.4 -93.1 -12.1 13.7 35.3 27.1 122 203 A E H < S+ 0 0 52 -4,-1.3 2,-0.3 -3,-0.3 -2,-0.2 0.781 114.2 24.3-103.5 -31.4 10.9 37.8 27.4 123 204 A V < - 0 0 6 -4,-2.4 -1,-0.2 -5,-0.2 -68,-0.2 -0.923 49.5-148.2-136.4 161.9 12.3 41.2 26.6 124 205 A D S S+ 0 0 81 -70,-2.5 69,-1.2 -2,-0.3 2,-0.3 0.782 88.1 26.7 -94.0 -34.6 15.2 42.9 24.7 125 206 A Y E -dF 55 192B 48 -71,-1.6 -69,-3.3 67,-0.3 2,-0.4 -0.958 66.7-148.1-131.4 149.0 15.7 45.9 26.9 126 207 A L E -dF 56 191B 5 65,-3.1 65,-2.1 -2,-0.3 2,-0.5 -0.970 8.1-168.6-119.6 131.9 15.0 46.5 30.6 127 208 A V E -dF 57 190B 0 -71,-2.5 -69,-2.9 -2,-0.4 2,-0.6 -0.987 7.1-163.2-121.3 121.2 14.0 49.9 32.0 128 209 A C E +dF 58 189B 17 61,-3.0 61,-1.9 -2,-0.5 2,-0.3 -0.922 20.3 158.9-111.6 117.7 14.1 50.3 35.8 129 210 A V E - F 0 188B 10 -71,-1.9 -69,-0.5 -2,-0.6 59,-0.2 -0.871 42.6 -97.9-135.3 166.5 12.2 53.2 37.4 130 211 A D - 0 0 74 57,-1.4 3,-0.1 -2,-0.3 -69,-0.1 -0.539 27.4-140.1 -78.9 150.1 10.7 54.5 40.6 131 212 A V S S+ 0 0 4 -71,-0.4 2,-2.3 1,-0.2 -59,-0.2 0.737 87.6 80.3 -86.0 -24.2 6.9 54.0 40.9 132 213 A D S S+ 0 0 44 -61,-0.1 131,-1.5 -60,-0.0 2,-0.3 -0.333 84.4 87.2 -81.6 59.9 6.1 57.4 42.5 133 214 A M E -J 262 0D 11 -2,-2.3 2,-0.3 129,-0.2 129,-0.2 -0.884 60.6-148.8-145.9 171.9 6.2 59.1 39.2 134 215 A E E -J 261 0D 47 127,-2.0 127,-2.6 -2,-0.3 2,-0.4 -0.992 21.1-120.3-149.1 144.8 4.0 59.9 36.2 135 216 A F E +J 260 0D 3 -64,-0.3 125,-0.3 -2,-0.3 124,-0.1 -0.729 29.8 170.8 -86.4 134.8 4.7 60.2 32.5 136 217 A R + 0 0 86 123,-3.0 2,-0.3 -2,-0.4 124,-0.2 0.494 64.5 8.1-118.3 -13.3 3.8 63.6 31.1 137 218 A D S S- 0 0 49 122,-1.6 -1,-0.2 120,-0.1 -58,-0.1 -0.939 101.5 -39.5-156.9 176.5 5.3 63.4 27.6 138 219 A H + 0 0 51 -2,-0.3 2,-0.4 -3,-0.1 -58,-0.2 -0.105 42.8 172.7 -48.0 129.5 7.0 61.0 25.1 139 220 A V B +i 80 0C 0 -60,-2.3 -58,-2.7 -63,-0.1 -57,-0.2 -0.892 30.2 142.9-138.5 100.8 9.5 58.5 26.5 140 221 A G > - 0 0 1 -2,-0.4 3,-2.0 -60,-0.2 4,-0.3 -0.410 62.3 -51.4-127.1-156.8 10.4 56.2 23.6 141 222 A V G > S+ 0 0 0 1,-0.3 3,-1.3 2,-0.2 -61,-0.0 0.614 107.1 86.5 -60.8 -13.7 13.0 54.2 21.8 142 223 A E G 3 S+ 0 0 3 1,-0.3 -1,-0.3 -103,-0.0 -108,-0.0 0.758 89.6 53.1 -58.1 -21.1 15.3 57.1 21.7 143 224 A I G < S+ 0 0 0 -3,-2.0 -1,-0.3 93,-0.0 -2,-0.2 0.692 83.9 109.3 -87.7 -17.7 16.5 55.9 25.1 144 225 A L < + 0 0 4 -3,-1.3 3,-0.1 -4,-0.3 -17,-0.0 -0.377 36.7 119.7 -68.2 132.8 17.2 52.3 24.1 145 226 A T S S- 0 0 15 -2,-0.2 3,-0.2 91,-0.1 47,-0.1 -0.944 77.1 -78.0-175.2 169.8 20.9 51.3 24.0 146 227 A P S S- 0 0 64 0, 0.0 46,-1.9 0, 0.0 2,-0.3 0.897 113.5 -0.7 -53.9 -40.5 23.1 48.7 25.7 147 228 A L E S+G 191 0B 7 44,-0.3 88,-2.2 48,-0.1 89,-1.1 -0.932 70.4 176.4-154.4 125.9 23.4 50.7 28.9 148 229 A F E -Gh 190 236B 0 42,-3.0 42,-1.8 -2,-0.3 2,-0.3 -0.969 9.1-170.9-135.8 150.7 22.0 54.1 29.9 149 230 A G E - h 0 237B 0 87,-1.1 89,-2.6 -2,-0.3 2,-0.4 -0.847 21.3-128.2-126.9 165.0 21.9 56.3 33.0 150 231 A T E - 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