==== 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 26-MAR-07 2EL3 . COMPND 2 MOLECULE: DIPHTHINE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS HORIKOSHII; . AUTHOR Y.ASADA,Y.MATSUURA,N.ONO,H.SHIMADA,N.KUNISHIMA,RIKEN STRUCTU . 531 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21577.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 373 70.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 56 10.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 49 9.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.4 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 . 2 0.4 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 0.2 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 . 36 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 73 13.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 129 24.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 2.8 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 7 1 1 0 6 1 1 2 1 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 4 2 2 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 . 5 2 1 3 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 0 ANTIPARALLEL BRIDGES PER LADDER . 2 0 0 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 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 1 A M 0 0 134 0, 0.0 106,-0.6 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 57.1 56.3 97.6 56.7 2 2 A V E -ab 79 107A 23 76,-1.1 78,-3.2 104,-0.1 2,-0.5 -0.972 360.0-140.0-140.0 151.2 53.1 98.5 58.4 3 3 A L E -ab 80 108A 0 104,-2.5 106,-2.3 -2,-0.3 2,-0.5 -0.956 15.1-160.6-115.4 129.4 50.2 96.5 60.1 4 4 A Y E -ab 81 109A 33 76,-2.9 78,-3.0 -2,-0.5 2,-0.7 -0.935 8.8-157.3-112.3 125.6 46.6 97.5 59.6 5 5 A F E -ab 82 110A 0 104,-3.0 106,-3.2 -2,-0.5 2,-0.5 -0.906 25.7-175.0 -97.2 114.7 43.8 96.5 62.0 6 6 A I E -ab 83 111A 0 76,-2.5 78,-1.7 -2,-0.7 2,-0.2 -0.949 18.7-142.6-121.8 123.2 40.7 96.7 59.8 7 7 A G E -a 84 0A 0 104,-2.6 10,-0.5 -2,-0.5 80,-0.2 -0.546 4.5-162.7 -79.6 144.8 37.1 96.2 60.9 8 8 A L - 0 0 3 76,-2.4 7,-0.3 78,-0.4 3,-0.2 0.544 39.9-129.2-101.2 -14.0 34.7 94.5 58.4 9 9 A G B -E 86 0B 1 77,-1.5 77,-3.8 75,-0.4 -1,-0.3 -0.461 31.4 -48.8 102.5-171.2 31.5 95.6 60.1 10 10 A L S S- 0 0 1 75,-0.2 30,-0.4 5,-0.2 -1,-0.1 0.831 110.3 -5.7 -78.5 -42.1 28.3 94.1 61.4 11 11 A Y S S+ 0 0 57 1,-0.4 30,-1.8 199,-0.2 31,-0.3 0.757 112.9 11.8-128.2 -52.4 26.7 91.8 58.8 12 12 A D S > S- 0 0 17 29,-0.2 3,-2.2 198,-0.2 -1,-0.4 -0.788 79.1 -90.0-130.2 175.2 28.2 91.4 55.3 13 13 A E G > S+ 0 0 35 1,-0.3 3,-0.9 -2,-0.2 271,-0.2 0.668 118.1 66.6 -60.7 -16.5 31.4 92.3 53.4 14 14 A R G 3 S+ 0 0 58 1,-0.2 271,-2.7 270,-0.1 272,-0.3 0.529 80.8 78.6 -83.4 -2.4 29.8 95.6 52.3 15 15 A D G < S+ 0 0 1 -3,-2.2 -1,-0.2 -7,-0.3 2,-0.2 0.419 71.1 103.2 -83.0 1.3 29.9 96.9 55.9 16 16 A I S < S- 0 0 1 -3,-0.9 268,-2.5 97,-0.1 269,-0.3 -0.527 81.4-109.7 -78.5 151.7 33.6 97.6 55.6 17 17 A T B > -F 283 0C 1 -10,-0.5 4,-2.4 95,-0.3 266,-0.3 -0.498 20.4-116.5 -81.5 157.1 34.5 101.3 55.1 18 18 A V H > S+ 0 0 8 264,-2.4 4,-2.8 262,-0.4 5,-0.3 0.903 118.8 53.0 -56.8 -41.3 35.7 102.6 51.8 19 19 A K H > S+ 0 0 2 261,-2.5 4,-2.3 263,-0.3 5,-0.3 0.961 109.0 47.7 -58.6 -52.6 38.9 103.5 53.5 20 20 A G H > S+ 0 0 0 260,-0.3 4,-2.2 92,-0.2 -1,-0.2 0.864 113.4 49.3 -57.7 -37.4 39.3 100.0 54.9 21 21 A L H X S+ 0 0 16 -4,-2.4 4,-2.9 2,-0.2 -2,-0.2 0.968 110.9 46.8 -67.0 -54.5 38.6 98.5 51.5 22 22 A E H X S+ 0 0 85 -4,-2.8 4,-0.7 1,-0.2 -2,-0.2 0.860 116.7 45.0 -57.0 -38.5 41.0 100.6 49.5 23 23 A I H >< S+ 0 0 19 -4,-2.3 3,-0.7 -5,-0.3 -1,-0.2 0.915 113.0 49.9 -73.2 -42.6 43.8 100.0 52.0 24 24 A A H >< S+ 0 0 0 -4,-2.2 3,-1.7 -5,-0.3 -2,-0.2 0.893 103.9 60.3 -62.0 -40.7 43.1 96.2 52.3 25 25 A K H 3< S+ 0 0 96 -4,-2.9 -1,-0.2 1,-0.3 -2,-0.2 0.782 109.2 44.1 -57.6 -28.6 43.1 95.9 48.5 26 26 A K T << S+ 0 0 166 -3,-0.7 -1,-0.3 -4,-0.7 2,-0.2 0.257 86.1 111.8-103.6 11.4 46.7 97.2 48.5 27 27 A C < - 0 0 0 -3,-1.7 53,-0.2 -4,-0.2 3,-0.1 -0.605 62.9-140.1 -84.6 147.0 48.2 95.2 51.4 28 28 A D S S+ 0 0 84 51,-1.9 2,-0.4 -2,-0.2 52,-0.2 0.905 87.5 23.8 -72.5 -41.5 50.7 92.5 50.5 29 29 A Y E -c 80 0A 111 50,-1.7 52,-2.3 24,-0.1 2,-0.5 -0.982 68.9-159.6-129.4 138.9 49.4 90.0 53.0 30 30 A V E +cd 81 55A 7 24,-0.5 26,-2.1 -2,-0.4 2,-0.3 -0.969 12.8 173.5-123.9 122.4 45.9 89.7 54.5 31 31 A F E +cd 82 56A 11 50,-3.4 52,-2.9 -2,-0.5 2,-0.3 -0.747 6.0 172.9-116.4 166.9 45.0 87.9 57.8 32 32 A A E -cd 83 57A 0 24,-1.5 26,-3.4 50,-0.3 2,-0.3 -0.981 21.0-144.4-168.3 160.6 41.7 87.7 59.7 33 33 A E - 0 0 0 50,-1.7 26,-0.1 -2,-0.3 24,-0.0 -0.981 7.6-175.9-133.6 145.9 39.9 86.1 62.6 34 34 A F + 0 0 54 24,-0.5 5,-0.1 -2,-0.3 50,-0.1 -0.122 65.2 87.2-132.4 36.4 36.2 85.2 62.8 35 35 A Y S S+ 0 0 18 23,-0.2 135,-0.4 1,-0.1 3,-0.1 0.620 75.8 64.3-108.9 -18.4 36.0 84.0 66.4 36 36 A T S S- 0 0 13 1,-0.1 2,-0.3 133,-0.1 -1,-0.1 0.646 119.0 -8.8 -80.3 -14.1 35.2 87.3 68.1 37 37 A S - 0 0 3 496,-0.1 2,-0.5 49,-0.0 -1,-0.1 -0.972 68.5-106.0-166.4 177.3 31.9 87.7 66.4 38 38 A L - 0 0 35 -2,-0.3 2,-1.0 -28,-0.1 3,-0.1 -0.973 11.2-161.6-124.6 122.9 29.6 86.4 63.6 39 39 A M > - 0 0 15 -2,-0.5 3,-1.3 1,-0.2 -28,-0.2 -0.807 14.7-174.0-100.6 90.2 29.0 88.1 60.3 40 40 A A T 3 S+ 0 0 41 -2,-1.0 -1,-0.2 -30,-0.4 -28,-0.1 0.682 71.9 55.3 -59.9 -24.2 25.7 86.4 59.3 41 41 A G T 3 S+ 0 0 17 -30,-1.8 2,-0.3 -31,-0.1 -1,-0.2 0.236 104.3 42.9-100.7 17.5 25.4 87.8 55.9 42 42 A T < - 0 0 22 -3,-1.3 2,-0.3 -31,-0.3 -3,-0.1 -0.879 60.0-137.4-148.0-180.0 28.7 87.0 54.2 43 43 A T > - 0 0 73 -2,-0.3 4,-2.2 1,-0.1 5,-0.2 -0.930 34.0-108.3-138.9 162.4 31.3 84.3 53.6 44 44 A L H > S+ 0 0 67 -2,-0.3 4,-2.8 1,-0.2 5,-0.2 0.907 120.4 54.9 -56.7 -41.6 35.1 84.2 53.5 45 45 A G H > S+ 0 0 42 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.923 107.4 47.5 -58.3 -48.0 34.9 83.8 49.7 46 46 A R H > S+ 0 0 145 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.874 112.0 50.4 -62.6 -38.3 32.8 86.9 49.3 47 47 A I H X S+ 0 0 4 -4,-2.2 4,-2.4 2,-0.2 5,-0.2 0.936 111.1 48.9 -65.5 -45.1 35.2 88.9 51.4 48 48 A Q H X>S+ 0 0 56 -4,-2.8 4,-2.6 1,-0.2 5,-1.2 0.895 110.3 51.2 -60.5 -42.4 38.1 87.7 49.4 49 49 A K H <5S+ 0 0 186 -4,-2.4 -1,-0.2 2,-0.2 -2,-0.2 0.928 111.5 47.0 -62.0 -45.6 36.4 88.5 46.1 50 50 A L H <5S+ 0 0 51 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.912 121.4 36.8 -62.0 -43.4 35.7 92.1 47.3 51 51 A I H <5S- 0 0 5 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.691 100.9-135.5 -83.7 -20.1 39.2 92.6 48.6 52 52 A G T <5 + 0 0 55 -4,-2.6 2,-0.3 1,-0.2 -3,-0.2 0.898 65.9 104.0 65.9 41.8 40.8 90.6 45.8 53 53 A K S - 0 0 39 -2,-0.3 4,-2.4 -26,-0.1 5,-0.2 -0.397 33.2-101.3 -87.4 169.1 42.3 80.8 65.2 60 60 A R H > S+ 0 0 107 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.869 126.1 50.0 -59.0 -35.5 42.1 82.3 68.7 61 61 A E H >>S+ 0 0 128 2,-0.2 4,-2.7 1,-0.2 5,-1.0 0.960 107.3 52.1 -68.3 -49.7 45.2 80.3 69.6 62 62 A D H >5S+ 0 0 42 3,-0.2 4,-1.2 2,-0.2 7,-0.2 0.914 119.5 37.4 -50.9 -46.2 47.1 81.5 66.5 63 63 A V H X5S+ 0 0 2 -4,-2.4 4,-1.5 3,-0.2 5,-0.2 0.978 119.6 42.7 -70.8 -60.3 46.3 85.1 67.5 64 64 A E H <5S+ 0 0 72 -4,-2.9 -3,-0.2 -5,-0.2 -2,-0.2 0.774 131.9 23.1 -62.1 -27.0 46.5 85.0 71.3 65 65 A L H <5S+ 0 0 103 -4,-2.7 -3,-0.2 -5,-0.3 -2,-0.2 0.800 135.3 24.6-108.1 -38.9 49.7 83.0 71.3 66 66 A N H >XS+ 0 0 0 -4,-1.5 4,-2.5 1,-0.3 5,-1.5 0.943 86.1 49.2 -52.1 -48.3 50.3 86.8 66.6 68 68 A E H 345S+ 0 0 73 -5,-0.2 -1,-0.3 1,-0.2 -2,-0.1 0.567 116.8 43.2 -68.8 -7.9 54.0 87.9 66.9 69 69 A N H <45S+ 0 0 102 -3,-1.8 -2,-0.2 -7,-0.2 -1,-0.2 0.701 124.2 30.8-106.2 -30.0 55.1 84.7 65.2 70 70 A I H <5S+ 0 0 29 -4,-3.0 4,-0.2 -8,-0.2 -3,-0.2 0.844 132.2 19.1 -97.7 -41.7 52.6 84.5 62.4 71 71 A V T >X5S+ 0 0 0 -4,-2.5 4,-1.2 -5,-0.4 3,-1.2 0.912 115.0 55.0 -98.1 -56.0 51.6 88.1 61.5 72 72 A L H 3>4 S+ 0 0 55 0, 0.0 3,-0.6 0, 0.0 -1,-0.2 0.854 106.7 45.1 -49.2 -36.3 57.3 89.1 61.1 74 74 A L H X> S+ 0 0 51 -3,-1.2 3,-1.9 1,-0.2 4,-1.3 0.852 101.7 64.1 -76.2 -36.3 55.7 89.9 57.7 75 75 A A H 3< S+ 0 0 0 -4,-1.2 -1,-0.2 -3,-0.3 32,-0.2 0.514 91.3 70.2 -66.7 -1.9 54.6 93.5 58.6 76 76 A K T << S+ 0 0 91 -3,-0.6 -1,-0.3 -4,-0.5 -2,-0.2 0.691 117.6 16.2 -87.9 -19.6 58.3 94.2 59.0 77 77 A E T <4 S+ 0 0 158 -3,-1.9 2,-0.3 -4,-0.2 -2,-0.2 0.293 128.9 39.3-132.9 3.4 59.0 94.0 55.3 78 78 A N S < S- 0 0 42 -4,-1.3 -76,-1.1 -76,-0.0 2,-0.7 -0.912 84.8 -94.7-147.5 172.6 55.4 94.3 53.9 79 79 A D E -a 2 0A 50 -2,-0.3 -51,-1.9 -78,-0.2 -50,-1.7 -0.858 50.1-171.6 -93.7 115.2 52.1 96.0 54.2 80 80 A V E -ac 3 29A 0 -78,-3.2 -76,-2.9 -2,-0.7 2,-0.4 -0.881 12.8-161.4-116.0 144.8 50.0 93.6 56.3 81 81 A A E -ac 4 30A 0 -52,-2.3 -50,-3.4 -2,-0.4 2,-0.5 -0.946 6.0-164.7-124.1 144.0 46.3 93.7 57.2 82 82 A F E -ac 5 31A 0 -78,-3.0 -76,-2.5 -2,-0.4 -50,-0.3 -0.974 17.8-160.5-127.9 110.4 44.4 91.9 60.0 83 83 A L E +ac 6 32A 0 -52,-2.9 -50,-1.7 -2,-0.5 -76,-0.2 -0.664 13.0 173.6 -94.9 149.6 40.7 91.9 59.5 84 84 A T E -a 7 0A 0 -78,-1.7 -76,-2.4 -2,-0.3 -75,-0.4 -0.970 37.1 -92.0-148.5 160.4 38.0 91.3 62.1 85 85 A P S S- 0 0 0 0, 0.0 -75,-0.2 0, 0.0 28,-0.1 -0.330 92.4 -14.3 -69.9 159.6 34.2 91.4 62.4 86 86 A G B S-E 9 0B 1 -77,-3.8 -77,-1.5 -79,-0.1 -78,-0.4 -0.142 130.0 -13.6 47.6-136.3 32.7 94.7 63.5 87 87 A D > - 0 0 0 446,-2.5 3,-1.5 -80,-0.2 25,-0.1 -0.882 67.7-134.6 -98.8 126.7 35.2 97.0 65.0 88 88 A P T 3 S+ 0 0 0 0, 0.0 6,-0.4 0, 0.0 -1,-0.1 0.679 100.1 41.8 -52.9 -23.8 38.6 95.3 65.8 89 89 A L T > S+ 0 0 9 444,-0.1 2,-0.6 5,-0.1 3,-0.5 0.460 88.4 100.7-108.1 0.5 39.0 96.8 69.2 90 90 A V T < S- 0 0 0 -3,-1.5 -3,-0.1 443,-0.3 3,-0.1 -0.767 103.2 -15.3 -92.7 119.9 35.5 96.6 70.6 91 91 A A T 3 S+ 0 0 41 -2,-0.6 2,-0.3 1,-0.3 -1,-0.2 0.875 117.8 94.7 59.6 39.3 34.8 93.8 73.0 92 92 A T S < S- 0 0 22 -3,-0.5 -1,-0.3 441,-0.1 3,-0.2 -0.863 79.9-124.4-143.2 174.2 38.0 92.0 72.0 93 93 A T S > S+ 0 0 82 -2,-0.3 3,-1.2 1,-0.1 4,-0.4 0.128 77.5 113.1-109.8 18.9 41.5 91.9 73.4 94 94 A H T > + 0 0 1 -6,-0.4 3,-1.0 1,-0.2 4,-0.5 0.700 59.3 74.3 -64.1 -19.9 43.0 92.9 70.1 95 95 A A T >> S+ 0 0 15 1,-0.3 3,-1.5 -3,-0.2 4,-0.6 0.872 89.8 59.5 -60.5 -35.5 44.1 96.3 71.5 96 96 A E H X> S+ 0 0 51 -3,-1.2 4,-1.1 1,-0.3 3,-0.8 0.773 92.1 68.9 -63.8 -25.0 46.8 94.5 73.3 97 97 A L H <> S+ 0 0 3 -3,-1.0 4,-1.8 -4,-0.4 -1,-0.3 0.733 89.5 61.8 -67.5 -21.2 48.1 93.3 69.9 98 98 A R H <> S+ 0 0 23 -3,-1.5 4,-2.1 -4,-0.5 -1,-0.3 0.796 99.6 55.8 -73.0 -27.5 49.1 96.9 69.1 99 99 A I H <>S+ 0 0 0 -4,-1.8 5,-3.1 1,-0.2 3,-0.9 0.942 109.7 47.3 -60.4 -46.8 53.4 95.3 67.2 102 102 A K H ><5S+ 0 0 90 -4,-2.1 3,-2.4 1,-0.3 -2,-0.2 0.928 108.6 53.1 -60.5 -47.2 55.2 98.2 68.8 103 103 A R H 3<5S+ 0 0 160 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.642 109.7 51.1 -65.1 -11.4 57.6 96.0 70.8 104 104 A A T <<5S- 0 0 33 -3,-0.9 -1,-0.3 -4,-0.8 -2,-0.2 0.249 120.1-111.6-105.5 8.6 58.4 94.3 67.4 105 105 A G T < 5S+ 0 0 56 -3,-2.4 2,-0.6 1,-0.2 -3,-0.2 0.838 73.6 138.2 64.8 32.8 59.1 97.7 65.8 106 106 A V < - 0 0 3 -5,-3.1 -1,-0.2 -6,-0.2 -2,-0.2 -0.946 48.4-140.5-114.0 115.9 56.0 97.4 63.6 107 107 A E E -b 2 0A 123 -106,-0.6 -104,-2.5 -2,-0.6 2,-0.3 -0.483 23.7-164.1 -72.0 143.4 53.9 100.5 63.2 108 108 A S E -b 3 0A 14 -106,-0.2 2,-0.3 -2,-0.1 -104,-0.2 -0.963 10.9-165.2-132.6 150.7 50.1 99.8 63.2 109 109 A Y E -b 4 0A 61 -106,-2.3 -104,-3.0 -2,-0.3 2,-0.5 -0.918 14.3-135.4-130.0 156.9 47.0 101.7 62.2 110 110 A V E -b 5 0A 8 -2,-0.3 2,-0.7 367,-0.2 -104,-0.2 -0.963 10.5-169.0-122.2 124.4 43.4 101.2 63.0 111 111 A I E -b 6 0A 4 -106,-3.2 -104,-2.6 -2,-0.5 -94,-0.1 -0.932 22.8-146.0-109.5 108.7 40.6 101.4 60.4 112 112 A H - 0 0 8 -2,-0.7 -95,-0.3 -106,-0.2 -92,-0.2 -0.126 16.4-173.8 -70.3 167.9 37.2 101.4 62.2 113 113 A A - 0 0 0 266,-0.1 268,-0.3 -97,-0.1 266,-0.1 -0.948 44.0 -63.2-153.5 162.9 34.0 99.8 61.0 114 114 A P - 0 0 0 0, 0.0 2,-0.3 0, 0.0 -105,-0.1 -0.305 58.0-159.5 -57.8 135.7 30.4 99.8 62.3 115 115 A S >> - 0 0 0 264,-0.3 4,-2.2 -29,-0.2 3,-1.1 -0.868 31.0-123.7-120.5 152.7 30.1 98.1 65.6 116 116 A I H 3> S+ 0 0 0 -2,-0.3 4,-0.8 1,-0.3 -1,-0.1 0.805 108.9 69.0 -61.4 -27.0 27.4 96.4 67.6 117 117 A Y H 34 S+ 0 0 13 1,-0.2 -1,-0.3 2,-0.2 3,-0.1 0.865 111.4 28.3 -62.0 -36.9 28.3 98.9 70.4 118 118 A S H X4 S+ 0 0 0 -3,-1.1 3,-1.9 1,-0.2 -1,-0.2 0.733 108.2 72.4 -95.1 -25.1 27.0 101.9 68.5 119 119 A A H >< S+ 0 0 0 -4,-2.2 3,-2.4 1,-0.3 4,-0.2 0.664 73.5 84.8 -64.0 -15.8 24.4 100.0 66.5 120 120 A V G ><>S+ 0 0 1 -4,-0.8 3,-2.2 1,-0.3 5,-0.5 0.708 71.1 82.0 -59.1 -15.2 22.3 99.7 69.6 121 121 A G G X 5S+ 0 0 1 -3,-1.9 3,-1.7 1,-0.3 -1,-0.3 0.805 76.0 68.0 -59.4 -27.7 21.1 103.1 68.5 122 122 A I G < 5S+ 0 0 5 -3,-2.4 -1,-0.3 1,-0.3 -2,-0.2 0.614 86.5 69.9 -68.9 -8.5 18.7 101.4 66.2 123 123 A T G < 5S- 0 0 0 -3,-2.2 -1,-0.3 2,-0.2 -2,-0.2 0.576 109.5-120.0 -83.8 -10.1 16.8 100.2 69.3 124 124 A G T < 5S+ 0 0 2 -3,-1.7 2,-0.4 1,-0.3 125,-0.2 0.359 72.4 129.7 88.8 -7.2 15.6 103.7 70.0 125 125 A L S - 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