==== 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 TRANSFERASE 25-DEC-06 2JCJ . COMPND 2 MOLECULE: N-ACETYLLACTOSAMINIDE . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR H.JAMALUDDIN,P.TUMBALE,S.G.WITHERS,K.R.ACHARYA,K.BREW . 284 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13370.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 192 67.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 35 12.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 19 6.7 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 . 20 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 14.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 65 22.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 2.1 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 1 0 0 0 0 1 0 0 1 0 0 0 1 0 1 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 1 1 0 1 0 2 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 1 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 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 82 A K 0 0 236 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 133.5 12.3 -25.4 -4.4 2 83 A L - 0 0 45 38,-0.0 2,-0.3 3,-0.0 3,-0.0 -0.373 360.0-169.7 -63.8 127.2 14.5 -22.5 -5.4 3 84 A K > - 0 0 111 -2,-0.2 3,-1.7 1,-0.1 4,-0.4 -0.842 33.9-118.6-115.5 153.0 18.2 -23.4 -6.1 4 85 A L G >> S+ 0 0 86 -2,-0.3 4,-2.6 1,-0.3 3,-1.4 0.897 116.6 56.3 -55.9 -40.3 21.0 -21.0 -6.7 5 86 A S G 34 S+ 0 0 86 1,-0.3 -1,-0.3 2,-0.2 -3,-0.0 0.604 89.6 76.3 -68.4 -13.5 21.4 -22.4 -10.2 6 87 A D G <4 S- 0 0 51 -3,-1.7 -1,-0.3 1,-0.1 -2,-0.2 0.737 121.4 -0.5 -70.0 -21.3 17.8 -21.6 -11.0 7 88 A W T <4 S+ 0 0 14 -3,-1.4 26,-1.5 -4,-0.4 2,-0.6 0.578 111.2 83.8-140.9 -23.4 18.6 -17.9 -11.4 8 89 A F B < +A 32 0A 8 -4,-2.6 24,-0.2 -5,-0.2 -1,-0.2 -0.828 37.3 170.7 -99.8 118.8 22.3 -17.1 -10.8 9 90 A N > + 0 0 54 22,-3.1 3,-1.8 -2,-0.6 4,-0.2 -0.708 2.8 171.6-123.0 76.7 24.7 -17.5 -13.7 10 91 A P G > + 0 0 42 0, 0.0 3,-1.9 0, 0.0 -1,-0.1 0.765 70.0 72.0 -56.3 -32.0 28.0 -15.9 -12.4 11 92 A F G 3 S+ 0 0 133 1,-0.3 20,-0.1 -3,-0.1 -3,-0.0 0.657 80.8 75.2 -61.7 -16.7 30.0 -17.2 -15.4 12 93 A K G < S+ 0 0 124 -3,-1.8 -1,-0.3 1,-0.3 19,-0.1 0.740 101.9 40.3 -67.2 -24.5 28.2 -14.6 -17.6 13 94 A R X + 0 0 22 -3,-1.9 3,-1.0 -4,-0.2 -1,-0.3 -0.680 69.8 161.2-126.4 75.2 30.4 -11.9 -16.0 14 95 A P T 3 + 0 0 93 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.671 65.8 65.4 -69.3 -19.7 33.9 -13.5 -15.8 15 96 A E T 3 S+ 0 0 160 2,-0.1 2,-0.3 3,-0.0 252,-0.1 0.395 101.8 48.8 -87.5 2.9 35.8 -10.2 -15.4 16 97 A V S < S- 0 0 22 -3,-1.0 2,-0.6 251,-0.0 -3,-0.1 -0.835 97.1 -83.0-134.7 172.1 34.3 -9.3 -12.0 17 98 A V + 0 0 76 -2,-0.3 3,-0.1 1,-0.1 -2,-0.1 -0.688 43.5 169.5 -79.7 117.9 33.6 -10.8 -8.6 18 99 A T + 0 0 26 -2,-0.6 8,-2.1 1,-0.3 2,-0.3 0.429 65.2 27.3-108.6 -2.2 30.4 -12.7 -8.8 19 100 A M B S-B 25 0B 62 6,-0.3 -1,-0.3 -9,-0.1 2,-0.1 -0.947 74.4-129.4-159.4 138.1 30.5 -14.5 -5.4 20 101 A T > - 0 0 7 4,-2.5 3,-1.9 -2,-0.3 6,-0.0 -0.271 35.4-100.6 -82.3 171.9 32.2 -13.8 -2.1 21 102 A K T 3 S+ 0 0 168 1,-0.3 -1,-0.1 2,-0.1 174,-0.0 0.864 125.9 53.2 -60.0 -35.3 34.5 -16.0 -0.0 22 103 A W T 3 S- 0 0 71 2,-0.1 -1,-0.3 1,-0.0 -2,-0.0 0.273 123.4-106.2 -85.9 13.0 31.5 -16.8 2.2 23 104 A K < + 0 0 138 -3,-1.9 -2,-0.1 1,-0.2 -1,-0.0 0.750 69.3 144.3 71.7 29.5 29.4 -17.8 -0.9 24 105 A A - 0 0 4 224,-0.1 -4,-2.5 226,-0.0 -1,-0.2 -0.831 52.3-117.3 -95.7 134.3 27.1 -14.8 -1.2 25 106 A P B -B 19 0B 11 0, 0.0 226,-2.1 0, 0.0 2,-0.7 -0.444 13.9-146.7 -71.8 145.8 26.3 -13.9 -4.8 26 107 A V E -c 251 0C 0 -8,-2.1 2,-0.6 224,-0.2 226,-0.2 -0.969 24.9-138.3-108.9 110.5 27.4 -10.5 -6.1 27 108 A V E +c 252 0C 0 224,-2.7 226,-2.2 -2,-0.7 2,-0.3 -0.645 30.4 168.9 -83.4 115.6 24.7 -9.7 -8.6 28 109 A W > - 0 0 2 -2,-0.6 3,-2.2 224,-0.1 4,-0.3 -0.817 46.9 -80.4-117.2 159.5 25.9 -8.1 -11.8 29 110 A E T 3 S+ 0 0 46 -2,-0.3 240,-0.1 1,-0.3 -1,-0.1 -0.350 119.1 24.3 -58.3 131.5 24.0 -7.4 -15.1 30 111 A G T 3 S+ 0 0 38 2,-0.2 -1,-0.3 -2,-0.0 -18,-0.1 0.219 102.8 85.1 97.0 -15.8 23.8 -10.6 -17.1 31 112 A T S < S+ 0 0 0 -3,-2.2 -22,-3.1 -19,-0.1 2,-0.4 0.471 79.4 73.2 -97.3 -2.9 24.2 -12.9 -14.1 32 113 A Y B -A 8 0A 33 -4,-0.3 2,-0.8 -24,-0.2 -2,-0.2 -0.901 60.6-151.9-122.6 144.7 20.6 -13.1 -13.2 33 114 A N > + 0 0 64 -26,-1.5 4,-1.5 -2,-0.4 5,-0.1 -0.833 20.4 176.9-106.1 88.5 17.4 -14.6 -14.6 34 115 A R H > S+ 0 0 53 -2,-0.8 4,-3.3 1,-0.2 5,-0.2 0.858 73.9 62.8 -64.0 -35.4 14.8 -12.2 -13.3 35 116 A A H > S+ 0 0 69 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.948 104.3 47.3 -54.8 -52.0 11.9 -14.0 -15.1 36 117 A V H > S+ 0 0 55 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.902 115.7 45.0 -57.1 -43.1 12.5 -17.2 -13.0 37 118 A L H X S+ 0 0 2 -4,-1.5 4,-3.1 2,-0.2 5,-0.3 0.897 109.2 55.9 -69.9 -39.7 12.7 -15.1 -9.7 38 119 A D H X S+ 0 0 45 -4,-3.3 4,-2.3 1,-0.2 -2,-0.2 0.943 111.6 43.3 -56.3 -49.6 9.6 -13.0 -10.6 39 120 A N H X S+ 0 0 101 -4,-2.3 4,-1.7 -5,-0.2 -1,-0.2 0.888 114.7 51.4 -63.7 -39.6 7.5 -16.2 -11.1 40 121 A Y H < S+ 0 0 68 -4,-1.9 4,-0.5 -5,-0.2 -2,-0.2 0.947 116.2 37.7 -63.5 -51.9 9.0 -17.7 -7.9 41 122 A Y H >X>S+ 0 0 23 -4,-3.1 5,-1.3 1,-0.2 3,-0.6 0.798 110.8 60.7 -71.7 -30.3 8.3 -14.8 -5.7 42 123 A A H ><5S+ 0 0 50 -4,-2.3 3,-1.2 -5,-0.3 -1,-0.2 0.907 101.0 54.9 -63.7 -39.6 4.9 -14.0 -7.3 43 124 A K T 3<5S+ 0 0 154 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.707 107.5 49.6 -66.1 -20.5 3.7 -17.4 -6.2 44 125 A Q T <45S- 0 0 118 -3,-0.6 -1,-0.3 -4,-0.5 -2,-0.2 0.501 107.3-130.5 -93.9 -6.8 4.6 -16.6 -2.6 45 126 A K T <<5 - 0 0 178 -3,-1.2 2,-0.2 -4,-0.5 -3,-0.2 0.977 39.2-176.9 56.2 59.3 2.8 -13.3 -2.9 46 127 A I < - 0 0 4 -5,-1.3 2,-0.4 91,-0.0 -1,-0.1 -0.559 16.2-153.9 -88.6 155.4 5.7 -11.3 -1.4 47 128 A T - 0 0 31 -2,-0.2 91,-2.8 31,-0.1 92,-1.2 -0.960 6.8-153.4-125.2 144.0 5.6 -7.6 -0.8 48 129 A V E -de 80 139C 0 31,-2.4 33,-2.3 -2,-0.4 2,-0.3 -0.966 4.9-156.3-123.2 136.8 8.6 -5.3 -0.7 49 130 A G E -de 81 140C 0 90,-2.4 92,-2.0 -2,-0.4 2,-0.4 -0.748 3.7-164.5-109.3 159.1 9.1 -2.1 1.2 50 131 A L E -de 82 141C 0 31,-2.1 33,-3.0 -2,-0.3 2,-0.4 -0.953 6.0-158.3-144.7 117.4 11.3 0.8 0.5 51 132 A T E +de 83 142C 1 90,-2.5 92,-2.6 -2,-0.4 2,-0.3 -0.799 15.9 171.7 -98.9 141.5 12.1 3.5 3.1 52 133 A V E -de 84 143C 0 31,-2.2 33,-2.5 -2,-0.4 2,-0.4 -0.980 18.3-149.9-150.0 134.9 13.4 6.9 2.0 53 134 A F E +d 85 0C 16 90,-0.6 92,-0.3 -2,-0.3 2,-0.3 -0.857 12.1 179.8-107.6 142.4 13.9 10.1 4.0 54 135 A A E +d 86 0C 1 31,-2.7 33,-0.8 -2,-0.4 2,-0.4 -0.848 12.6 165.5-143.9 100.2 13.6 13.6 2.6 55 136 A V > - 0 0 14 -2,-0.3 3,-1.0 31,-0.2 31,-0.1 -0.957 53.1 -17.0-119.6 137.1 14.3 16.4 5.0 56 137 A G T > S- 0 0 14 -2,-0.4 3,-2.4 1,-0.2 4,-0.4 -0.332 128.8 -7.9 72.1-154.2 14.9 20.0 4.1 57 138 A R T 3> S+ 0 0 138 1,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.680 120.1 81.8 -49.3 -22.7 15.9 21.1 0.6 58 139 A Y H <>>S+ 0 0 98 -3,-1.0 4,-2.8 1,-0.2 5,-1.3 0.818 83.6 60.4 -56.0 -32.6 16.2 17.4 -0.2 59 140 A I H <>>S+ 0 0 2 -3,-2.4 4,-1.1 3,-0.2 5,-0.7 0.988 111.3 35.6 -59.5 -60.6 12.4 17.2 -0.7 60 141 A E H 45S+ 0 0 95 -4,-0.4 -2,-0.2 1,-0.2 -1,-0.2 0.850 122.9 47.5 -62.1 -36.9 12.3 19.8 -3.6 61 142 A H H <5S- 0 0 118 -4,-2.4 -2,-0.2 1,-0.1 -1,-0.2 0.885 132.4 -3.0 -76.2 -40.9 15.6 18.6 -5.0 62 143 A Y H X5S+ 0 0 36 -4,-2.8 4,-2.4 -5,-0.2 5,-0.2 0.640 101.4 86.5-129.8 -18.7 15.3 14.8 -5.1 63 144 A L H X S+ 0 0 104 1,-0.2 4,-2.0 2,-0.2 84,-0.3 0.896 113.0 52.7 -61.4 -40.6 12.6 12.0 -9.2 66 147 A F H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 83,-0.3 0.938 115.1 39.9 -60.5 -48.0 13.4 9.3 -6.7 67 148 A L H X S+ 0 0 7 -4,-2.4 4,-3.0 -5,-0.2 5,-0.2 0.914 113.3 52.1 -69.5 -45.5 9.7 8.2 -6.4 68 149 A T H X S+ 0 0 67 -4,-2.9 4,-1.3 1,-0.2 -1,-0.2 0.902 115.7 42.3 -59.5 -41.4 8.8 8.6 -10.0 69 150 A S H X S+ 0 0 11 -4,-2.0 4,-2.5 -5,-0.3 5,-0.3 0.885 113.1 52.7 -72.7 -37.8 11.7 6.4 -11.1 70 151 A A H X S+ 0 0 0 -4,-2.0 4,-3.0 -5,-0.3 -2,-0.2 0.917 106.5 54.0 -61.3 -44.9 11.1 4.0 -8.2 71 152 A N H < S+ 0 0 34 -4,-3.0 -1,-0.2 1,-0.2 -2,-0.2 0.872 115.4 40.2 -55.0 -42.5 7.5 3.6 -9.3 72 153 A K H < S+ 0 0 135 -4,-1.3 -2,-0.2 -5,-0.2 -1,-0.2 0.792 131.3 21.1 -79.9 -30.5 8.7 2.7 -12.8 73 154 A H H >< S+ 0 0 13 -4,-2.5 80,-2.3 -5,-0.1 3,-0.6 0.693 89.5 100.7-117.1 -21.0 11.7 0.5 -11.9 74 155 A F B 3< S-j 153 0D 0 -4,-3.0 4,-0.2 -5,-0.3 80,-0.2 -0.595 106.1 -32.1 -79.5 116.3 11.5 -1.0 -8.4 75 156 A M T > S- 0 0 0 78,-2.5 3,-1.8 -2,-0.6 -1,-0.2 0.879 80.0-157.0 45.9 49.1 10.3 -4.6 -8.1 76 157 A V T < S+ 0 0 67 -3,-0.6 79,-0.2 1,-0.3 -1,-0.1 -0.278 74.2 27.3 -57.2 136.2 8.0 -4.3 -11.1 77 158 A G T 3 S+ 0 0 47 22,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.440 107.8 90.2 90.9 -0.3 5.3 -6.8 -11.0 78 159 A H S < S- 0 0 4 -3,-1.8 -1,-0.2 -4,-0.2 -31,-0.1 -0.966 88.1 -93.6-131.4 147.2 5.3 -7.1 -7.2 79 160 A P - 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