==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=2-SEP-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 15-MAR-12 4AN4 . COMPND 2 MOLECULE: GLYCOSYL TRANSFERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STREPTOMYCES NOGALATER; . AUTHOR M.CLAESSON,V.SIITONEN,D.DOBRITZSCH,M.METSA-KETELA,G.SCHNEIDE . 1393 20 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 57933.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 967 69.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 215 15.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 0.4 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 . 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 . 104 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 168 12.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 410 29.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 25 1.8 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 10 11 8 0 3 14 4 4 0 0 0 4 0 0 0 0 0 0 0 1 0 2 1 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 5 25 16 3 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 PARALLEL BRIDGES PER LADDER . 3 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 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 4 0 1 1 3 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 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 11 A Q 0 0 207 0, 0.0 2,-0.6 0, 0.0 702,-0.0 0.000 360.0 360.0 360.0 10.4 -21.7 26.3 -11.6 2 12 A S - 0 0 45 29,-0.1 29,-0.1 1,-0.0 28,-0.1 -0.743 360.0-141.8 -94.8 120.1 -19.0 27.4 -14.2 3 13 A M - 0 0 13 -2,-0.6 29,-2.6 23,-0.1 2,-0.5 -0.264 9.7-136.7 -72.7 157.0 -18.3 31.1 -14.5 4 14 A R E -a 32 0A 51 27,-0.2 96,-2.4 94,-0.1 97,-1.2 -0.962 13.4-167.3-126.9 121.4 -17.6 32.8 -17.8 5 15 A A E -ab 33 101A 0 27,-3.0 29,-2.1 -2,-0.5 2,-0.6 -0.904 5.6-159.0-114.1 118.9 -14.9 35.4 -18.4 6 16 A L E -ab 34 102A 0 95,-3.0 97,-3.2 -2,-0.5 2,-0.7 -0.861 8.4-154.1 -99.3 118.1 -14.9 37.5 -21.6 7 17 A F E -ab 35 103A 0 27,-3.4 29,-3.3 -2,-0.6 2,-0.7 -0.821 11.8-176.6 -97.8 110.2 -11.5 39.0 -22.4 8 18 A I E + b 0 104A 0 95,-3.6 97,-1.0 -2,-0.7 2,-0.2 -0.846 18.9 172.6-112.7 96.6 -11.7 42.1 -24.4 9 19 A T - 0 0 0 -2,-0.7 29,-0.3 27,-0.3 7,-0.1 -0.530 37.8 -98.3-106.0 162.8 -8.2 43.3 -25.3 10 20 A S - 0 0 6 -2,-0.2 5,-0.1 2,-0.1 -1,-0.1 -0.428 42.2-113.5 -68.5 155.5 -6.4 45.9 -27.4 11 21 A P S S+ 0 0 10 0, 0.0 29,-2.1 0, 0.0 2,-0.2 0.718 84.2 107.3 -69.7 -22.4 -5.1 44.4 -30.7 12 22 A G S >> S- 0 0 22 1,-0.1 3,-2.5 27,-0.1 4,-1.4 -0.396 72.1-134.9 -64.5 128.1 -1.5 44.8 -29.7 13 23 A L H 3> S+ 0 0 77 1,-0.3 4,-2.6 -2,-0.2 3,-0.4 0.843 105.5 57.4 -40.7 -47.0 0.5 41.7 -28.9 14 24 A S H 34 S+ 0 0 69 1,-0.3 -1,-0.3 2,-0.2 -2,-0.1 0.584 107.0 47.9 -72.3 -12.0 2.0 43.5 -25.8 15 25 A H H <4 S+ 0 0 40 -3,-2.5 -1,-0.3 -5,-0.1 -2,-0.2 0.670 114.0 46.8 -95.5 -25.2 -1.5 44.1 -24.3 16 26 A I H >X S+ 0 0 0 -4,-1.4 3,-1.7 -3,-0.4 4,-0.7 0.900 101.6 62.8 -79.8 -49.2 -2.7 40.6 -24.9 17 27 A L G >< S+ 0 0 33 -4,-2.6 3,-1.4 1,-0.3 -3,-0.1 0.875 99.8 51.7 -50.2 -49.7 0.3 38.6 -23.5 18 28 A P G 34 S+ 0 0 21 0, 0.0 4,-0.3 0, 0.0 -1,-0.3 0.615 105.1 58.2 -72.0 -6.8 0.1 39.9 -19.9 19 29 A T G <> S+ 0 0 1 -3,-1.7 4,-1.8 -4,-0.2 3,-0.2 0.634 88.1 80.9 -85.3 -16.6 -3.6 38.9 -19.8 20 30 A V H S+ 0 0 15 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.904 111.3 47.5 -57.0 -39.9 -1.8 33.9 -17.2 22 32 A L H > S+ 0 0 1 -4,-0.3 4,-2.0 2,-0.2 -2,-0.2 0.874 110.8 51.6 -65.5 -39.6 -5.0 35.1 -15.7 23 33 A A H X S+ 0 0 0 -4,-1.8 4,-1.6 1,-0.2 -1,-0.2 0.909 112.8 45.7 -61.9 -41.2 -7.0 33.6 -18.6 24 34 A Q H X S+ 0 0 6 -4,-2.8 4,-2.0 1,-0.2 -2,-0.2 0.801 107.8 57.9 -73.8 -28.5 -5.2 30.3 -18.0 25 35 A A H X S+ 0 0 0 -4,-1.8 4,-1.4 -5,-0.3 -1,-0.2 0.912 105.1 50.5 -65.3 -43.2 -5.8 30.6 -14.2 26 36 A L H <>S+ 0 0 1 -4,-2.0 5,-2.3 1,-0.2 -2,-0.2 0.884 111.5 47.3 -64.9 -40.8 -9.5 30.8 -14.8 27 37 A R H ><5S+ 0 0 48 -4,-1.6 3,-2.0 1,-0.2 -1,-0.2 0.896 107.5 57.0 -63.7 -42.2 -9.5 27.7 -16.9 28 38 A A H 3<5S+ 0 0 3 -4,-2.0 684,-2.6 1,-0.3 685,-0.3 0.804 103.4 54.5 -62.6 -29.4 -7.4 25.9 -14.4 29 39 A L T 3<5S- 0 0 37 -4,-1.4 -1,-0.3 682,-0.2 -2,-0.2 0.418 127.3-101.7 -79.9 -5.6 -10.1 26.6 -11.8 30 40 A G T < 5S+ 0 0 11 -3,-2.0 -3,-0.2 1,-0.3 -2,-0.1 0.533 83.0 122.2 96.1 11.1 -12.6 24.9 -14.1 31 41 A H < - 0 0 21 -5,-2.3 2,-0.4 -6,-0.2 -1,-0.3 -0.332 60.4-101.0 -94.7-179.6 -14.2 28.1 -15.6 32 42 A E E -a 4 0A 52 -29,-2.6 -27,-3.0 -2,-0.1 2,-0.4 -0.868 29.2-171.6-114.5 144.7 -14.5 29.3 -19.0 33 43 A V E +a 5 0A 14 -2,-0.4 17,-0.3 -29,-0.2 2,-0.3 -0.971 7.4 170.8-134.7 137.1 -12.6 31.9 -21.0 34 44 A R E -a 6 0A 24 -29,-2.1 -27,-3.4 -2,-0.4 2,-0.3 -0.981 19.9-140.8-146.0 140.6 -12.9 33.5 -24.3 35 45 A Y E -ac 7 51A 0 15,-2.6 17,-2.2 -2,-0.3 2,-0.4 -0.709 6.4-166.5 -95.0 147.2 -11.2 36.4 -26.0 36 46 A A E + c 0 52A 0 -29,-3.3 -27,-0.3 -2,-0.3 2,-0.2 -0.852 42.8 111.6-129.5 96.8 -12.7 39.1 -28.1 37 47 A T E - c 0 53A 0 15,-1.4 17,-2.2 -2,-0.4 18,-0.5 -0.834 46.5-133.0-145.6-176.1 -10.0 41.1 -30.0 38 48 A G + 0 0 1 -29,-0.3 2,-0.8 -2,-0.2 -2,-0.0 -0.797 65.9 22.8-131.4-178.5 -8.4 41.9 -33.3 39 49 A G S S+ 0 0 45 16,-0.3 3,-0.5 -2,-0.2 2,-0.3 -0.488 120.7 33.1 72.2-102.6 -5.0 42.2 -34.8 40 50 A D S > S+ 0 0 80 -29,-2.1 3,-2.1 -2,-0.8 4,-0.3 0.079 79.5 132.0 -82.6 31.8 -2.5 40.1 -32.9 41 51 A I T >> + 0 0 9 -2,-0.3 3,-1.5 1,-0.3 4,-1.4 0.688 53.3 75.2 -59.8 -26.9 -5.2 37.5 -32.1 42 52 A R H 3> S+ 0 0 148 -3,-0.5 4,-3.1 1,-0.3 -1,-0.3 0.838 84.9 67.0 -54.2 -36.0 -3.1 34.6 -33.1 43 53 A A H <4 S+ 0 0 9 -3,-2.1 -1,-0.3 1,-0.2 4,-0.2 0.819 99.0 50.6 -53.3 -36.6 -1.2 35.1 -29.9 44 54 A V H X4>S+ 0 0 0 -3,-1.5 5,-1.8 -4,-0.3 3,-1.2 0.937 112.0 46.4 -68.6 -48.6 -4.4 34.0 -28.1 45 55 A A H ><5S+ 0 0 11 -4,-1.4 3,-1.5 1,-0.3 505,-0.5 0.906 110.6 53.2 -55.5 -44.4 -4.7 30.9 -30.2 46 56 A E T 3<5S+ 0 0 95 -4,-3.1 364,-0.8 1,-0.3 148,-0.4 0.484 100.1 63.1 -78.3 -2.6 -1.1 30.2 -29.7 47 57 A A B < 5S-G 409 0B 0 -3,-1.2 -1,-0.3 -4,-0.2 362,-0.2 0.164 123.2-101.6-102.2 13.8 -1.6 30.4 -25.9 48 58 A G T < 5S+ 0 0 5 -3,-1.5 2,-0.3 360,-0.8 501,-0.2 0.745 87.8 117.9 72.5 23.7 -4.0 27.4 -26.0 49 59 A L < - 0 0 3 -5,-1.8 502,-1.6 -6,-0.1 2,-0.4 -0.789 62.4-114.8-119.4 166.3 -6.9 29.8 -25.7 50 60 A C E + d 0 551A 22 -17,-0.3 -15,-2.6 -2,-0.3 2,-0.3 -0.821 31.5 176.7-109.5 144.5 -9.9 30.6 -27.8 51 61 A A E -cd 35 552A 0 500,-2.4 502,-3.6 -2,-0.4 2,-0.5 -0.966 23.6-140.9-146.8 147.6 -10.7 33.9 -29.5 52 62 A V E -cd 36 553A 31 -17,-2.2 -15,-1.4 -2,-0.3 2,-0.9 -0.972 25.3-127.5-112.4 128.6 -13.2 35.6 -31.7 53 63 A D E -c 37 0A 50 500,-0.5 -15,-0.2 -2,-0.5 -17,-0.0 -0.642 24.6-176.4 -73.8 104.5 -12.0 38.1 -34.4 54 64 A V S S+ 0 0 6 -17,-2.2 35,-0.5 -2,-0.9 -16,-0.2 0.574 81.1 32.2 -77.5 -14.7 -14.1 41.2 -33.7 55 65 A S S > S- 0 0 7 -18,-0.5 3,-1.4 34,-0.1 -16,-0.3 -0.407 81.7-162.6-143.8 62.8 -12.6 43.1 -36.6 56 66 A P T 3 S- 0 0 96 0, 0.0 -18,-0.0 0, 0.0 -2,-0.0 -0.221 74.4 -2.6 -59.7 132.2 -11.8 40.6 -39.5 57 67 A G T 3 S+ 0 0 88 1,-0.2 2,-0.4 -18,-0.1 -19,-0.0 0.825 90.7 150.7 55.5 38.4 -9.4 42.0 -42.1 58 68 A V < - 0 0 62 -3,-1.4 2,-1.0 27,-0.0 -1,-0.2 -0.866 46.7-130.9 -98.2 135.6 -9.2 45.5 -40.5 59 69 A N > - 0 0 99 -2,-0.4 4,-0.7 1,-0.2 3,-0.5 -0.735 24.2-179.3 -89.4 101.1 -6.0 47.5 -41.0 60 70 A Y H >> S+ 0 0 24 -2,-1.0 4,-2.0 1,-0.2 3,-0.7 0.831 75.7 69.5 -73.2 -32.4 -5.0 48.7 -37.5 61 71 A A H 3> S+ 0 0 63 1,-0.3 4,-1.0 2,-0.2 -1,-0.2 0.881 100.6 48.8 -47.3 -44.2 -1.9 50.5 -38.8 62 72 A K H 34 S+ 0 0 138 -3,-0.5 -1,-0.3 1,-0.2 -2,-0.2 0.767 107.4 55.3 -70.5 -29.8 -4.3 53.0 -40.5 63 73 A L H << S+ 0 0 36 -3,-0.7 -1,-0.2 -4,-0.7 -2,-0.2 0.861 106.2 48.3 -75.8 -39.1 -6.4 53.5 -37.3 64 74 A F H < S+ 0 0 81 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.790 135.6 10.9 -70.6 -27.8 -3.5 54.5 -35.1 65 75 A V < + 0 0 88 -4,-1.0 -1,-0.3 -5,-0.3 -2,-0.1 -0.766 69.9 156.9-151.5 101.1 -2.4 56.9 -37.8 66 76 A P + 0 0 76 0, 0.0 3,-0.2 0, 0.0 -3,-0.1 0.892 43.8 92.5 -99.2 -39.8 -4.7 57.7 -40.8 67 77 A D S S- 0 0 131 1,-0.2 -2,-0.0 -5,-0.0 2,-0.0 0.141 94.7 -56.2 -50.1 168.3 -3.7 61.1 -42.2 68 78 A D 0 0 82 1224,-0.2 -1,-0.2 0, 0.0 0, 0.0 -0.227 360.0 360.0 -57.4 124.8 -1.2 61.5 -45.0 69 79 A T 0 0 181 -3,-0.2 -4,-0.0 -4,-0.1 0, 0.0 -0.960 360.0 360.0 168.2 360.0 2.2 59.9 -44.3 70 ! 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 71 91 A G >> 0 0 96 0, 0.0 4,-1.6 0, 0.0 3,-1.3 0.000 360.0 360.0 360.0-107.5 -2.3 65.8 -25.1 72 92 A E H 3> + 0 0 127 1,-0.3 4,-2.5 2,-0.2 5,-0.2 0.897 360.0 56.7 -45.6 -48.8 -4.6 63.4 -23.3 73 93 A G H 3> S+ 0 0 49 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.788 105.0 50.9 -56.8 -34.1 -7.5 64.4 -25.6 74 94 A F H <> S+ 0 0 126 -3,-1.3 4,-1.6 2,-0.2 -1,-0.2 0.933 112.6 42.8 -72.9 -49.4 -5.6 63.4 -28.7 75 95 A F H X S+ 0 0 112 -4,-1.6 4,-2.9 2,-0.2 5,-0.3 0.868 112.9 54.2 -66.3 -38.8 -4.6 59.9 -27.6 76 96 A A H X S+ 0 0 3 -4,-2.5 4,-3.0 -5,-0.3 5,-0.2 0.973 107.0 51.1 -55.0 -56.7 -8.0 59.3 -26.2 77 97 A E H X S+ 0 0 101 -4,-1.9 4,-1.4 1,-0.2 -1,-0.2 0.857 112.5 48.5 -45.0 -44.3 -9.5 60.2 -29.6 78 98 A M H X S+ 0 0 19 -4,-1.6 4,-2.0 2,-0.2 3,-0.2 0.939 111.1 46.0 -65.9 -54.0 -7.1 57.7 -31.1 79 99 A F H X S+ 0 0 33 -4,-2.9 4,-3.4 1,-0.2 30,-0.3 0.872 110.3 56.8 -60.8 -36.7 -7.8 54.8 -28.8 80 100 A A H X S+ 0 0 6 -4,-3.0 4,-2.2 -5,-0.3 -1,-0.2 0.871 107.4 47.6 -59.9 -41.7 -11.5 55.5 -29.2 81 101 A R H X S+ 0 0 74 -4,-1.4 4,-0.9 -5,-0.2 -1,-0.2 0.877 115.0 46.2 -66.1 -41.5 -11.1 55.1 -33.0 82 102 A V H < S+ 0 0 7 -4,-2.0 3,-0.4 1,-0.2 4,-0.2 0.915 116.2 44.2 -68.6 -44.8 -9.2 51.9 -32.5 83 103 A S H >X S+ 0 0 3 -4,-3.4 3,-2.1 1,-0.2 4,-1.0 0.855 101.0 71.0 -67.6 -36.8 -11.6 50.6 -30.0 84 104 A A H >X S+ 0 0 27 -4,-2.2 3,-0.7 1,-0.3 4,-0.5 0.843 91.9 56.5 -49.7 -41.1 -14.6 51.6 -32.1 85 105 A V H 3< S+ 0 0 47 -4,-0.9 4,-0.3 -3,-0.4 -1,-0.3 0.607 108.3 49.0 -72.6 -12.1 -13.9 48.9 -34.7 86 106 A A H <> S+ 0 0 0 -3,-2.1 4,-2.6 -4,-0.2 5,-0.3 0.641 87.3 86.0 -94.4 -22.1 -14.1 46.2 -32.0 87 107 A V H S+ 0 0 2 -35,-0.5 4,-3.0 -4,-0.3 5,-0.3 0.908 112.3 54.7 -63.7 -44.5 -18.0 42.1 -32.5 90 110 A A H X S+ 0 0 0 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.912 112.7 43.7 -56.5 -46.4 -17.4 42.4 -28.8 91 111 A L H X S+ 0 0 0 -4,-2.2 4,-2.6 -5,-0.3 -1,-0.2 0.892 112.1 54.1 -66.0 -42.4 -21.1 42.9 -28.2 92 112 A R H X S+ 0 0 155 -4,-2.2 4,-1.7 -5,-0.2 5,-0.2 0.965 114.3 38.8 -55.5 -55.5 -22.0 40.2 -30.6 93 113 A T H X S+ 0 0 11 -4,-3.0 4,-2.7 1,-0.2 5,-0.3 0.868 115.6 53.2 -71.2 -36.4 -19.9 37.5 -28.9 94 114 A A H X S+ 0 0 0 -4,-2.2 4,-2.1 -5,-0.3 -1,-0.2 0.912 108.0 51.6 -58.9 -44.4 -20.8 38.8 -25.5 95 115 A R H < S+ 0 0 115 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.865 119.1 34.3 -67.8 -36.4 -24.5 38.6 -26.3 96 116 A S H < S+ 0 0 65 -4,-1.7 -1,-0.2 -5,-0.2 -2,-0.2 0.846 122.4 43.7 -83.3 -40.4 -24.4 35.0 -27.5 97 117 A W H < S- 0 0 8 -4,-2.7 -3,-0.2 -5,-0.2 -2,-0.2 0.721 93.6-147.9 -84.6 -23.7 -21.7 33.6 -25.2 98 118 A R < - 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0 0 10 -5,-1.0 -1,-0.2 49,-0.2 -18,-0.2 -0.997 56.3-104.8-140.5 130.4 18.4 40.5 -12.6 288 316 A P - 0 0 1 0, 0.0 -18,-2.2 0, 0.0 2,-0.4 -0.302 41.2-145.4 -64.4 146.4 20.2 43.8 -12.9 289 317 A Q E -rs 270 310E 0 20,-2.0 22,-1.5 -20,-0.2 2,-0.4 -0.904 20.5-168.8-125.7 140.4 19.0 45.9 -15.9 290 318 A C E -rs 271 311E 1 -20,-2.5 -18,-2.8 -2,-0.4 2,-0.5 -0.988 15.2-156.1-123.7 124.4 20.4 48.3 -18.4 291 319 A V E -rs 272 312E 4 20,-2.3 22,-1.9 -2,-0.4 -18,-0.2 -0.839 9.7-155.1-104.1 132.8 18.1 50.4 -20.6 292 320 A I - 0 0 27 -20,-2.7 22,-0.1 -2,-0.5 20,-0.1 -0.851 32.0-171.6 -97.6 94.9 19.0 51.8 -23.9 293 321 A P - 0 0 31 0, 0.0 22,-0.3 0, 0.0 2,-0.3 0.014 17.0-145.0 -84.1-166.2 16.6 54.7 -24.1 294 322 A H - 0 0 179 20,-0.1 2,-0.3 -21,-0.1 -2,-0.0 -0.840 59.3 -13.0-163.7 121.9 15.6 57.2 -26.9 295 323 A G 0 0 75 -2,-0.3 0, 0.0 1,-0.1 0, 0.0 -0.682 360.0 360.0 89.2-143.8 14.6 60.8 -26.6 296 324 A S 0 0 157 -2,-0.3 -1,-0.1 -3,-0.0 0, 0.0 0.454 360.0 360.0-141.1 360.0 13.7 62.5 -23.2 297 ! 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 0.0 298 327 A D >> 0 0 114 0, 0.0 4,-1.0 0, 0.0 3,-0.9 0.000 360.0 360.0 360.0 165.8 9.5 57.4 -19.7 299 328 A T H >> + 0 0 26 1,-0.2 3,-1.7 2,-0.2 4,-1.4 0.887 360.0 65.7 -46.6 -59.4 8.6 56.0 -16.3 300 329 A N H >> S+ 0 0 4 1,-0.3 4,-1.2 2,-0.2 3,-0.6 0.811 104.0 47.7 -33.6 -49.4 10.1 52.5 -16.8 301 330 A R H <> S+ 0 0 56 -3,-0.9 4,-1.3 1,-0.2 -1,-0.3 0.864 108.0 55.0 -62.5 -39.1 13.6 54.0 -17.0 302 331 A D H S+ 0 0 0 -4,-1.2 5,-1.7 1,-0.2 6,-1.3 0.901 113.3 42.5 -52.6 -48.6 15.5 51.4 -12.5 305 334 A T H <5S+ 0 0 91 -4,-1.3 3,-0.4 3,-0.2 -1,-0.2 0.950 115.3 49.9 -62.6 -51.6 17.2 54.5 -11.2 306 335 A G H <5S+ 0 0 45 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.914 117.3 38.2 -56.9 -50.0 14.8 54.9 -8.3 307 336 A L H <5S- 0 0 31 -4,-3.5 -1,-0.3 -5,-0.1 -2,-0.2 0.604 104.7-128.9 -76.5 -15.2 15.0 51.3 -7.1 308 337 A G T <5S+ 0 0 30 -4,-0.9 27,-0.3 -3,-0.4 28,-0.2 0.850 73.8 123.9 64.3 35.5 18.7 51.1 -7.8 309 338 A I S S- 0 0 4 -2,-0.9 4,-1.5 -94,-0.1 3,-0.5 -0.638 71.5 -72.7-134.7-170.8 30.5 49.8 -23.6 320 349 A A H > S+ 0 0 6 1,-0.2 4,-2.0 -2,-0.2 5,-0.2 0.773 118.2 66.2 -58.1 -32.4 32.4 47.3 -21.4 321 350 A E H > S+ 0 0 161 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.929 104.7 41.3 -57.8 -52.2 32.1 49.7 -18.5 322 351 A Q H > S+ 0 0 35 -3,-0.5 4,-2.1 1,-0.2 -1,-0.2 0.889 112.7 55.4 -62.3 -44.3 28.3 49.5 -18.2 323 352 A C H X S+ 0 0 1 -4,-1.5 4,-1.4 1,-0.2 -1,-0.2 0.836 108.3 47.0 -60.4 -37.9 28.4 45.7 -18.7 324 353 A R H X S+ 0 0 110 -4,-2.0 4,-1.8 2,-0.2 5,-0.4 0.803 107.0 57.5 -77.4 -29.9 30.8 45.1 -15.9 325 354 A R H X S+ 0 0 118 -4,-1.4 4,-2.2 -5,-0.2 7,-0.2 0.942 107.1 49.3 -61.8 -46.9 28.8 47.3 -13.6 326 355 A L H < S+ 0 0 2 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.872 117.1 41.5 -56.9 -41.8 25.8 45.0 -14.3 327 356 A L H < S+ 0 0 7 -4,-1.4 -1,-0.2 -5,-0.2 -2,-0.2 0.733 128.8 22.9 -79.4 -28.2 27.8 41.9 -13.6 328 357 A D H < S+ 0 0 89 -4,-1.8 2,-1.1 -3,-0.2 -3,-0.2 0.700 84.7 105.0-120.3 -31.9 29.8 43.0 -10.5 329 358 A D >X - 0 0 56 -4,-2.2 4,-1.4 -5,-0.4 3,-1.2 -0.478 51.6-163.2 -63.0 96.2 28.0 45.9 -8.7 330 359 A A H 3> S+ 0 0 46 -2,-1.1 4,-2.4 1,-0.3 5,-0.2 0.765 83.7 67.0 -52.7 -32.4 26.6 44.0 -5.7 331 360 A G H 3> S+ 0 0 36 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.871 101.2 46.2 -58.3 -42.9 24.3 46.9 -5.1 332 361 A L H <> S+ 0 0 6 -3,-1.2 4,-2.4 -7,-0.2 -1,-0.2 0.926 112.8 49.2 -67.0 -47.5 22.3 46.2 -8.3 333 362 A R H X S+ 0 0 101 -4,-1.4 4,-2.4 1,-0.2 5,-0.2 0.930 112.0 47.9 -58.4 -49.3 22.1 42.5 -7.7 334 363 A E H X S+ 0 0 120 -4,-2.4 4,-1.5 2,-0.2 -1,-0.2 0.910 112.7 47.6 -58.8 -47.9 20.9 42.9 -4.2 335 364 A A H X S+ 0 0 4 -4,-1.8 4,-1.8 -27,-0.3 -1,-0.2 0.882 112.1 51.2 -63.8 -41.8 18.2 45.5 -5.1 336 365 A A H X S+ 0 0 2 -4,-2.4 4,-2.3 1,-0.2 -2,-0.2 0.906 110.3 47.6 -59.2 -48.5 17.0 43.3 -8.0 337 366 A L H X S+ 0 0 82 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.773 108.8 56.9 -66.8 -27.4 16.7 40.2 -5.8 338 367 A R H X S+ 0 0 155 -4,-1.5 4,-1.8 -5,-0.2 -2,-0.2 0.890 108.9 43.8 -70.7 -42.2 14.8 42.4 -3.3 339 368 A V H X S+ 0 0 5 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.872 112.0 54.7 -71.2 -38.4 12.2 43.4 -5.9 340 369 A R H X S+ 0 0 122 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.941 108.8 47.1 -54.8 -51.7 12.0 39.8 -7.1 341 370 A Q H X S+ 0 0 100 -4,-2.0 4,-0.6 1,-0.2 -2,-0.2 0.914 111.8 51.9 -55.7 -46.6 11.2 38.6 -3.5 342 371 A E H >< S+ 0 0 45 -4,-1.8 3,-0.7 1,-0.2 -1,-0.2 0.879 109.9 48.3 -59.6 -43.0 8.6 41.4 -3.3 343 372 A M H >< S+ 0 0 5 -4,-2.5 3,-1.8 1,-0.2 -2,-0.2 0.900 105.9 57.3 -64.5 -40.5 7.0 40.2 -6.5 344 373 A S H 3< S+ 0 0 21 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.602 99.7 60.7 -68.6 -12.6 6.9 36.6 -5.3 345 374 A E T << S+ 0 0 135 -3,-0.7 -1,-0.3 -4,-0.6 -2,-0.2 0.445 84.5 97.4 -92.6 -5.7 4.9 37.8 -2.3 346 375 A M S < S- 0 0 13 -3,-1.8 -160,-0.1 -4,-0.2 -159,-0.1 -0.622 92.4 -93.9 -83.1 141.6 2.1 39.0 -4.5 347 376 A P - 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