==== 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 10-JUL-08 3DR6 . COMPND 2 MOLECULE: YNCA; . SOURCE 2 ORGANISM_SCIENTIFIC: SALMONELLA TYPHIMURIUM; . AUTHOR A.U.SINGER,T.SKARINA,O.ONOPRIYENKO,A.M.EDWARDS,W.F.ANDERSON, . 511 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 23857.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 344 67.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 12 2.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 122 23.9 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 . 6 1.2 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 . 13 2.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 52 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 129 25.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 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 0 0 0 0 1 2 0 0 0 2 4 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 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 PARALLEL BRIDGES PER LADDER . 1 0 0 3 0 3 6 3 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 1 0 0 0 0 0 0 1 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 0 A A 0 0 73 0, 0.0 2,-0.4 0, 0.0 60,-0.2 0.000 360.0 360.0 360.0 174.6 31.8 -6.4 -22.1 2 1 A X + 0 0 88 57,-0.1 2,-0.3 55,-0.1 57,-0.2 -0.215 360.0 145.2 -61.9 105.1 30.7 -7.0 -18.5 3 2 A T E -A 58 0A 66 55,-2.1 55,-2.3 -2,-0.4 2,-0.4 -0.906 36.8-146.4-125.9 163.8 32.3 -10.2 -17.2 4 3 A I E +A 57 0A 28 -2,-0.3 2,-0.3 53,-0.2 53,-0.2 -0.998 31.0 156.5-126.9 132.6 33.7 -11.3 -13.8 5 4 A R E -A 56 0A 63 51,-2.3 51,-2.7 -2,-0.4 2,-0.2 -0.925 48.2 -77.6-144.0 167.0 36.7 -13.7 -13.8 6 5 A F E -A 55 0A 106 -2,-0.3 49,-0.3 49,-0.2 2,-0.0 -0.512 52.9-117.8 -65.6 140.3 39.5 -14.7 -11.5 7 6 A A - 0 0 11 47,-3.0 2,-0.3 -2,-0.2 47,-0.2 -0.312 26.6-161.2 -70.3 156.7 42.4 -12.2 -11.5 8 7 A D > - 0 0 76 -2,-0.0 3,-1.6 47,-0.0 4,-0.2 -0.824 38.8 -91.8-127.6 179.8 45.8 -13.1 -12.6 9 8 A K G > S+ 0 0 109 -2,-0.3 3,-1.8 1,-0.3 4,-0.3 0.810 120.7 65.6 -64.8 -27.5 49.2 -11.4 -12.0 10 9 A A G 3 S+ 0 0 90 1,-0.3 3,-0.5 2,-0.1 4,-0.3 0.749 94.5 63.3 -65.0 -19.5 48.9 -9.2 -15.1 11 10 A D G <> S+ 0 0 14 -3,-1.6 4,-2.5 1,-0.2 -1,-0.3 0.515 75.7 94.1 -77.3 -6.6 45.9 -7.6 -13.4 12 11 A C H <> S+ 0 0 10 -3,-1.8 4,-3.0 1,-0.2 -1,-0.2 0.859 79.1 52.9 -63.5 -37.6 48.0 -6.2 -10.5 13 12 A A H > S+ 0 0 63 -3,-0.5 4,-1.9 -4,-0.3 -1,-0.2 0.939 113.6 44.9 -59.5 -47.9 48.7 -2.7 -11.9 14 13 A A H > S+ 0 0 26 -4,-0.3 4,-1.8 2,-0.2 -2,-0.2 0.901 114.8 47.6 -61.4 -45.2 44.9 -2.2 -12.5 15 14 A I H X S+ 0 0 1 -4,-2.5 4,-2.8 2,-0.2 5,-0.2 0.933 108.0 57.1 -61.0 -45.8 44.0 -3.5 -9.0 16 15 A T H X S+ 0 0 6 -4,-3.0 4,-2.5 1,-0.2 19,-0.2 0.919 109.3 43.7 -54.2 -48.0 46.7 -1.4 -7.3 17 16 A E H X S+ 0 0 118 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.868 112.0 52.1 -73.6 -29.6 45.3 1.9 -8.7 18 17 A I H X S+ 0 0 3 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.933 112.0 48.2 -67.2 -44.7 41.7 1.0 -7.9 19 18 A Y H X S+ 0 0 21 -4,-2.8 4,-2.6 2,-0.2 -2,-0.2 0.937 110.8 50.8 -54.6 -48.6 42.8 0.2 -4.4 20 19 A N H X S+ 0 0 30 -4,-2.5 4,-1.9 -5,-0.2 -2,-0.2 0.896 108.4 51.5 -63.0 -40.1 44.6 3.5 -4.2 21 20 A H H X S+ 0 0 71 -4,-2.3 4,-1.0 1,-0.2 -1,-0.2 0.938 111.1 47.9 -59.7 -46.1 41.6 5.4 -5.3 22 21 A A H >< S+ 0 0 3 -4,-2.2 6,-1.8 1,-0.2 3,-0.5 0.894 110.8 51.7 -59.4 -43.5 39.5 3.7 -2.7 23 22 A V H 3< S+ 0 0 1 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.825 110.1 48.9 -63.8 -33.7 42.1 4.5 0.0 24 23 A L H 3< S+ 0 0 96 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.644 122.7 28.8 -82.6 -16.8 42.2 8.2 -1.0 25 24 A H S << S- 0 0 89 -4,-1.0 -3,-0.1 -3,-0.5 3,-0.0 -0.024 108.9 -66.9-120.5-140.8 38.4 8.5 -0.9 26 25 A T S > S+ 0 0 91 1,-0.1 3,-0.6 -2,-0.1 96,-0.2 0.587 106.5 77.4-102.1 -10.0 35.5 6.8 1.0 27 26 A A T 3 S+ 0 0 63 1,-0.3 2,-0.7 -5,-0.2 -4,-0.2 0.902 102.6 37.3 -69.4 -41.9 35.5 3.2 -0.3 28 27 A A T > S+ 0 0 5 -6,-1.8 3,-1.4 1,-0.2 -1,-0.3 -0.630 77.0 165.4-107.3 71.4 38.5 2.0 1.8 29 28 A I T < + 0 0 11 -2,-0.7 -1,-0.2 -3,-0.6 119,-0.1 0.633 64.3 57.9 -65.5 -17.9 37.6 4.0 4.8 30 29 A W T 3 S+ 0 0 15 -3,-0.1 220,-2.6 90,-0.1 2,-0.3 0.434 102.0 57.0 -98.3 -0.1 39.9 2.2 7.3 31 30 A N < + 0 0 27 -3,-1.4 -3,-0.1 218,-0.2 3,-0.0 -0.954 49.3 179.3-129.7 151.2 43.2 2.8 5.5 32 31 A D + 0 0 64 -2,-0.3 2,-0.5 2,-0.1 -1,-0.1 0.527 53.8 87.3-127.3 -9.7 44.9 6.0 4.4 33 32 A R - 0 0 146 1,-0.0 216,-0.1 -9,-0.0 -10,-0.1 -0.801 65.7-134.2-104.3 131.7 48.1 5.1 2.6 34 33 A T - 0 0 73 -2,-0.5 2,-0.3 -11,-0.1 -2,-0.1 -0.277 23.4-150.5 -69.3 163.1 48.5 4.3 -1.0 35 34 A V - 0 0 26 -19,-0.2 2,-0.1 3,-0.0 -15,-0.1 -0.867 8.4-117.7-131.8 164.7 50.6 1.3 -2.1 36 35 A D > - 0 0 97 -2,-0.3 4,-1.6 1,-0.1 5,-0.2 -0.453 36.1 -99.9 -96.6 173.6 52.8 0.2 -5.0 37 36 A T H > S+ 0 0 67 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.873 121.4 58.4 -62.7 -38.8 52.3 -2.7 -7.4 38 37 A D H > S+ 0 0 120 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.919 104.6 52.7 -54.9 -44.5 54.9 -4.9 -5.5 39 38 A N H > S+ 0 0 66 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.923 111.9 43.6 -57.6 -47.3 52.7 -4.5 -2.4 40 39 A R H X S+ 0 0 28 -4,-1.6 4,-2.9 2,-0.2 -1,-0.2 0.839 109.7 57.1 -72.6 -30.4 49.6 -5.7 -4.2 41 40 A L H X S+ 0 0 45 -4,-2.6 4,-2.8 2,-0.2 -2,-0.2 0.930 108.8 46.4 -59.1 -44.6 51.5 -8.5 -5.8 42 41 A A H X S+ 0 0 55 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.926 112.6 50.5 -64.4 -39.2 52.5 -9.7 -2.3 43 42 A W H X S+ 0 0 38 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.912 110.8 49.2 -62.4 -45.4 48.9 -9.3 -1.2 44 43 A Y H X S+ 0 0 19 -4,-2.9 4,-2.4 2,-0.2 -2,-0.2 0.935 110.6 49.8 -58.6 -48.8 47.8 -11.3 -4.3 45 44 A E H X S+ 0 0 83 -4,-2.8 4,-2.0 1,-0.2 -2,-0.2 0.874 108.6 53.5 -60.7 -37.0 50.3 -14.1 -3.5 46 45 A A H X S+ 0 0 51 -4,-2.2 4,-1.3 2,-0.2 -1,-0.2 0.900 108.9 48.9 -66.6 -41.2 49.2 -14.2 0.1 47 46 A R H X>S+ 0 0 43 -4,-2.0 5,-2.5 1,-0.2 4,-0.8 0.935 109.6 51.8 -61.6 -46.5 45.5 -14.8 -1.0 48 47 A Q H ><5S+ 0 0 90 -4,-2.4 3,-0.9 1,-0.2 -2,-0.2 0.892 105.1 56.4 -59.0 -38.5 46.5 -17.5 -3.4 49 48 A L H 3<5S+ 0 0 157 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.866 109.6 45.2 -60.9 -35.0 48.4 -19.3 -0.6 50 49 A L H 3<5S- 0 0 87 -4,-1.3 -1,-0.3 -3,-0.5 -2,-0.2 0.580 114.4-118.7 -81.2 -11.5 45.2 -19.3 1.5 51 50 A G T <<5 + 0 0 51 -3,-0.9 -3,-0.2 -4,-0.8 -2,-0.1 0.707 65.1 147.3 73.0 22.6 43.2 -20.5 -1.6 52 51 A Y < - 0 0 18 -5,-2.5 -1,-0.3 -6,-0.2 -2,-0.1 -0.746 47.4-112.4 -93.5 142.6 41.1 -17.3 -1.3 53 52 A P - 0 0 7 0, 0.0 16,-0.7 0, 0.0 2,-0.5 -0.307 19.5-164.5 -78.3 147.0 39.8 -15.8 -4.6 54 53 A V E - B 0 68A 2 -47,-0.2 -47,-3.0 14,-0.2 2,-0.3 -0.990 21.9-173.0-121.7 120.0 40.8 -12.5 -6.2 55 54 A L E -AB 6 67A 0 12,-3.0 12,-2.3 -2,-0.5 2,-0.4 -0.827 9.2-162.0-109.9 151.1 38.1 -11.6 -8.8 56 55 A V E -AB 5 66A 0 -51,-2.7 -51,-2.3 -2,-0.3 2,-0.3 -0.982 12.9-141.0-126.5 145.7 38.1 -8.8 -11.4 57 56 A S E -AB 4 65A 0 8,-2.1 7,-2.6 -2,-0.4 8,-0.9 -0.789 29.6-171.6 -91.7 151.4 35.2 -7.3 -13.3 58 57 A E E -AB 3 63A 34 -55,-2.3 -55,-2.1 -2,-0.3 2,-0.3 -0.982 22.0-170.2-147.9 151.8 36.1 -6.4 -16.9 59 58 A E E > S- B 0 62A 70 3,-2.1 3,-1.7 -2,-0.3 -57,-0.1 -0.945 81.3 -17.3-146.0 118.6 34.7 -4.6 -19.9 60 59 A N T 3 S- 0 0 149 -2,-0.3 3,-0.1 1,-0.3 -58,-0.1 0.865 129.0 -51.0 48.9 43.8 36.4 -4.8 -23.4 61 60 A G T 3 S+ 0 0 62 1,-0.2 2,-0.4 -60,-0.2 -1,-0.3 0.601 113.8 116.8 74.9 13.7 39.7 -6.0 -21.8 62 61 A V E < -B 59 0A 81 -3,-1.7 -3,-2.1 -48,-0.0 2,-0.4 -0.957 69.0-121.6-112.8 132.1 39.8 -3.2 -19.2 63 62 A V E +B 58 0A 12 -2,-0.4 -5,-0.3 -5,-0.2 3,-0.1 -0.578 30.0 178.7 -71.5 125.0 39.6 -4.0 -15.4 64 63 A T E - 0 0 2 -7,-2.6 25,-2.8 1,-0.4 2,-0.3 0.454 60.4 -26.4-110.5 -3.0 36.6 -2.2 -14.0 65 64 A G E -BC 57 88A 0 -8,-0.9 -8,-2.1 23,-0.3 -1,-0.4 -0.937 56.7-138.8 170.7 171.3 36.8 -3.4 -10.3 66 65 A Y E -BC 56 87A 1 21,-2.4 21,-2.5 -2,-0.3 2,-0.3 -0.988 7.0-163.4-151.2 164.8 37.9 -6.2 -8.1 67 66 A A E +BC 55 86A 0 -12,-2.3 -12,-3.0 -2,-0.3 2,-0.3 -0.998 17.7 145.7-148.8 146.5 36.9 -8.3 -5.1 68 67 A S E -BC 54 85A 0 17,-2.1 17,-2.4 -2,-0.3 2,-0.3 -0.956 25.4-139.6-159.6 177.2 38.5 -10.6 -2.6 69 68 A F E - C 0 84A 0 -16,-0.7 2,-0.3 -2,-0.3 15,-0.2 -0.985 11.8-173.5-144.2 160.4 38.3 -11.7 1.0 70 69 A G E - C 0 83A 6 13,-2.2 13,-2.6 -2,-0.3 2,-0.1 -0.790 48.4 -59.0-135.2 179.8 40.7 -12.5 3.8 71 70 A D E - C 0 82A 77 -2,-0.3 11,-0.2 11,-0.2 8,-0.1 -0.402 44.1-140.3 -63.3 133.9 40.5 -13.8 7.3 72 71 A W S S+ 0 0 12 9,-1.9 2,-0.3 6,-0.4 -1,-0.1 0.939 79.3 12.8 -62.2 -47.7 38.4 -11.5 9.4 73 72 A R S S- 0 0 20 8,-0.4 2,-1.4 2,-0.2 -1,-0.2 -0.938 73.3-116.9-134.9 155.1 40.6 -11.7 12.6 74 73 A S S S+ 0 0 111 -2,-0.3 2,-0.3 -3,-0.1 3,-0.0 -0.464 83.0 92.8 -91.1 60.4 44.1 -13.0 13.5 75 74 A F S > S- 0 0 68 -2,-1.4 3,-1.8 1,-0.0 -2,-0.2 -0.958 78.6-126.1-145.3 143.2 43.0 -15.7 15.9 76 75 A D G > S+ 0 0 34 -2,-0.3 3,-1.6 1,-0.3 128,-0.2 0.765 103.3 72.8 -66.1 -22.5 42.5 -19.4 14.9 77 76 A G G 3 S+ 0 0 2 126,-2.8 244,-1.4 1,-0.3 3,-0.3 0.700 93.2 56.4 -64.1 -19.3 38.9 -19.4 16.4 78 77 A F G X + 0 0 2 -3,-1.8 3,-2.6 125,-0.3 -6,-0.4 0.215 69.1 121.1 -96.7 20.0 37.7 -17.2 13.5 79 78 A R T < S+ 0 0 76 -3,-1.6 -1,-0.2 1,-0.3 -2,-0.1 0.533 73.5 49.6 -69.6 -7.9 38.9 -19.6 10.8 80 79 A Y T 3 S+ 0 0 12 239,-0.3 35,-2.4 -3,-0.3 36,-1.8 0.325 100.3 83.1-103.5 6.7 35.4 -20.0 9.3 81 80 A T E < - d 0 116A 0 -3,-2.6 -9,-1.9 34,-0.2 -8,-0.4 -0.926 56.6-177.5-118.5 129.7 34.8 -16.2 9.1 82 81 A V E -Cd 71 117A 0 34,-2.6 36,-2.9 -2,-0.5 2,-0.5 -0.874 19.4-143.8-123.5 156.1 36.1 -13.9 6.4 83 82 A E E -Cd 70 118A 27 -13,-2.6 -13,-2.2 -2,-0.3 36,-0.2 -0.984 23.7-154.1-117.4 122.7 36.0 -10.1 5.7 84 83 A H E -C 69 0A 16 34,-1.2 36,-0.4 -2,-0.5 2,-0.4 -0.523 9.8-161.1 -91.1 162.5 35.6 -9.0 2.0 85 84 A S E -C 68 0A 26 -17,-2.4 -17,-2.1 -2,-0.2 2,-0.4 -0.988 7.1-176.5-137.3 138.6 36.6 -5.9 0.2 86 85 A V E -C 67 0A 32 -2,-0.4 2,-0.4 -19,-0.2 -19,-0.2 -0.993 6.0-178.1-133.3 123.5 35.0 -4.9 -3.1 87 86 A Y E -C 66 0A 34 -21,-2.5 -21,-2.4 -2,-0.4 2,-0.4 -0.988 10.8-154.2-129.2 134.3 36.3 -1.8 -5.0 88 87 A V E -C 65 0A 38 -2,-0.4 -23,-0.3 -23,-0.2 5,-0.1 -0.820 29.1-107.0-107.7 142.2 35.0 -0.4 -8.2 89 88 A H > - 0 0 40 -25,-2.8 3,-2.5 -2,-0.4 -71,-0.1 -0.469 30.5-128.3 -62.6 132.4 37.0 1.7 -10.7 90 89 A P G > S+ 0 0 43 0, 0.0 3,-0.6 0, 0.0 -1,-0.1 0.707 108.9 56.4 -61.6 -21.0 35.7 5.4 -10.3 91 90 A A G 3 S+ 0 0 72 1,-0.2 -2,-0.1 -27,-0.0 -27,-0.0 0.461 105.6 55.2 -81.4 -4.6 35.2 5.6 -14.1 92 91 A H G X S+ 0 0 26 -3,-2.5 3,-0.6 -28,-0.2 5,-0.3 -0.000 76.1 130.1-123.7 27.8 32.9 2.6 -13.9 93 92 A Q T < + 0 0 141 -3,-0.6 -4,-0.0 1,-0.2 0, 0.0 -0.322 57.0 40.4 -76.4 161.1 30.3 3.6 -11.3 94 93 A G T 3 S+ 0 0 42 1,-0.1 419,-0.4 -2,-0.1 -1,-0.2 0.498 85.7 99.6 83.2 3.9 26.6 3.2 -11.8 95 94 A K S < S- 0 0 78 -3,-0.6 -2,-0.1 417,-0.1 -1,-0.1 0.195 96.1-110.9-108.7 9.8 26.9 -0.1 -13.6 96 95 A G S > S+ 0 0 3 1,-0.1 4,-2.3 3,-0.1 5,-0.2 0.667 73.5 137.5 70.7 18.2 26.0 -2.4 -10.6 97 96 A L H > + 0 0 4 -5,-0.3 4,-2.9 1,-0.2 5,-0.3 0.876 64.1 56.1 -68.3 -38.6 29.5 -3.7 -10.4 98 97 A G H > S+ 0 0 16 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.941 113.2 42.4 -55.4 -47.4 29.8 -3.6 -6.6 99 98 A R H > S+ 0 0 87 2,-0.2 4,-2.9 1,-0.2 -2,-0.2 0.933 115.1 48.8 -66.8 -45.6 26.7 -5.7 -6.2 100 99 A K H X S+ 0 0 85 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.896 113.8 46.7 -60.6 -44.0 27.7 -8.1 -9.0 101 100 A L H X S+ 0 0 0 -4,-2.9 4,-2.6 2,-0.2 -2,-0.2 0.933 113.9 47.5 -65.5 -46.0 31.2 -8.6 -7.6 102 101 A L H X S+ 0 0 1 -4,-2.5 4,-2.1 -5,-0.3 -2,-0.2 0.919 110.0 53.3 -62.5 -42.4 29.9 -9.1 -4.0 103 102 A S H X S+ 0 0 53 -4,-2.9 4,-1.5 1,-0.2 -1,-0.2 0.951 112.5 44.0 -57.7 -47.5 27.3 -11.6 -5.3 104 103 A R H X S+ 0 0 61 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.916 110.7 55.7 -65.5 -37.3 30.0 -13.7 -7.0 105 104 A L H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.856 102.3 55.8 -62.1 -36.9 32.3 -13.4 -4.0 106 105 A I H X S+ 0 0 11 -4,-2.1 4,-2.0 2,-0.2 -1,-0.2 0.934 106.1 51.7 -63.1 -45.4 29.6 -14.9 -1.7 107 106 A D H X S+ 0 0 67 -4,-1.5 4,-1.9 1,-0.2 -2,-0.2 0.921 111.2 47.1 -53.9 -48.2 29.5 -17.9 -4.0 108 107 A E H X S+ 0 0 16 -4,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.844 106.7 57.4 -64.4 -36.3 33.3 -18.3 -3.8 109 108 A A H <>S+ 0 0 0 -4,-2.3 5,-2.2 2,-0.2 -1,-0.2 0.898 108.1 47.6 -62.1 -40.9 33.2 -17.9 0.1 110 109 A R H ><5S+ 0 0 117 -4,-2.0 3,-1.8 1,-0.2 -2,-0.2 0.906 109.2 53.4 -63.1 -41.1 30.8 -20.9 0.2 111 110 A R H 3<5S+ 0 0 160 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.827 104.9 55.6 -64.0 -31.9 33.1 -22.8 -2.1 112 111 A C T 3<5S- 0 0 43 -4,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.398 119.0-114.0 -78.5 2.4 36.0 -22.0 0.4 113 112 A G T < 5 + 0 0 37 -3,-1.8 -3,-0.2 1,-0.2 57,-0.2 0.676 60.8 158.1 75.7 18.0 33.9 -23.6 3.2 114 113 A K < - 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