==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=3-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 25-MAY-01 1H5T . COMPND 2 MOLECULE: GLUCOSE-1-PHOSPHATE THYMIDYLYLTRANSFERASE; . SOURCE 2 SYNTHETIC: YES; . AUTHOR C.ROSANO,S.ZUCCOTTI,M.BOLOGNESI . 1160 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 44886.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 838 72.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 106 9.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 117 10.1 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 . 8 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 4 0.3 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 . 81 7.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 170 14.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 306 26.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 21 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 7 5 2 6 9 7 5 2 0 0 0 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 2 4 10 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 . 2 7 5 4 4 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 ANTIPARALLEL BRIDGES PER LADDER . 8 0 0 0 0 0 0 3 1 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 2 A K 0 0 254 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -9.0 56.2 -7.1 26.5 2 3 A M - 0 0 65 47,-0.1 2,-0.2 46,-0.1 46,-0.1 -0.640 360.0-120.6 -70.0 140.1 54.4 -7.0 29.9 3 4 A R E -a 48 0A 115 44,-0.5 47,-2.2 -2,-0.3 46,-1.1 -0.588 31.8-127.2 -76.2 160.5 55.1 -3.8 31.9 4 5 A K E +ab 50 104A 30 99,-0.5 101,-1.6 -2,-0.2 2,-0.3 -0.663 31.7 162.7-122.3 145.3 56.6 -4.4 35.3 5 6 A G E -ab 51 105A 0 45,-1.8 47,-2.5 -2,-0.3 2,-0.4 -0.981 23.5-137.8-153.5 165.3 55.9 -3.4 38.8 6 7 A I E -ab 52 106A 0 99,-1.8 101,-2.6 -2,-0.3 2,-0.6 -0.980 4.4-153.2-127.3 136.7 56.7 -4.4 42.4 7 8 A I E -ab 53 107A 0 45,-2.7 47,-2.7 -2,-0.4 2,-0.8 -0.953 12.8-152.2-107.4 121.1 54.4 -4.6 45.4 8 9 A L E +ab 54 108A 15 99,-2.3 101,-3.1 -2,-0.6 102,-0.3 -0.848 30.0 157.9 -96.6 113.3 56.4 -4.0 48.6 9 10 A A + 0 0 0 45,-3.3 47,-0.4 -2,-0.8 17,-0.2 -0.226 36.3 93.5-135.6 49.4 54.4 -6.0 51.2 10 11 A G + 0 0 15 45,-0.3 16,-0.1 15,-0.1 45,-0.1 0.126 34.9 117.8-115.4-139.7 56.8 -6.7 54.0 11 12 A G S S- 0 0 29 71,-0.2 14,-0.1 1,-0.1 45,-0.1 0.099 71.8 -79.3 96.0 159.1 57.6 -4.8 57.1 12 13 A S - 0 0 92 1,-0.1 -1,-0.1 73,-0.1 44,-0.1 0.988 37.2-157.8 -53.4 -78.6 57.3 -5.6 60.9 13 14 A G > + 0 0 18 11,-0.1 3,-2.6 12,-0.0 7,-0.2 0.302 47.1 135.0 105.7 -5.5 53.5 -5.1 61.5 14 15 A T G > + 0 0 70 1,-0.3 3,-1.6 2,-0.2 6,-0.1 0.719 58.7 67.1 -41.6 -37.4 54.3 -4.6 65.2 15 16 A R G 3 S+ 0 0 160 1,-0.3 555,-0.4 554,-0.1 -1,-0.3 0.807 101.0 47.8 -65.0 -24.6 52.1 -1.6 65.5 16 17 A L G X> S+ 0 0 3 -3,-2.6 3,-2.0 212,-0.1 4,-0.6 0.281 90.8 174.0-100.6 6.8 49.0 -3.7 64.9 17 18 A Y T <4 + 0 0 37 -3,-1.6 554,-0.3 1,-0.3 555,-0.1 -0.306 59.9 23.7 -49.1 142.1 49.9 -6.4 67.4 18 19 A P T >4 S+ 0 0 0 0, 0.0 3,-1.2 0, 0.0 4,-0.5 -0.958 119.3 59.6 -89.5 3.4 48.1 -8.8 68.3 19 20 A V T <4 S+ 0 0 1 -3,-2.0 3,-0.2 304,-0.3 -2,-0.2 0.841 112.0 43.0 -65.1 -27.4 46.1 -8.7 65.0 20 21 A T T 3< S+ 0 0 25 -4,-0.6 -1,-0.3 -7,-0.2 -3,-0.2 0.386 86.5 95.0 -98.5 9.9 49.3 -9.3 63.0 21 22 A M S < S+ 0 0 86 -3,-1.2 -1,-0.2 1,-0.2 -2,-0.1 0.942 107.1 11.3 -66.3 -45.7 50.7 -12.0 65.3 22 23 A A S S+ 0 0 7 -4,-0.5 2,-0.4 -3,-0.2 -1,-0.2 0.177 126.6 61.6-114.5 15.0 49.3 -14.9 63.2 23 24 A V S S- 0 0 12 -4,-0.1 2,-0.2 291,-0.1 -1,-0.1 -0.990 81.8-118.0-141.0 136.4 48.2 -13.0 60.1 24 25 A S >> - 0 0 3 -2,-0.4 3,-2.1 1,-0.1 4,-0.7 -0.510 26.5-128.4 -72.1 138.1 50.2 -10.9 57.6 25 26 A K G >4 S+ 0 0 33 1,-0.3 3,-1.2 -2,-0.2 10,-0.2 0.876 107.6 55.0 -51.0 -46.5 49.0 -7.3 57.6 26 27 A Q G 34 S+ 0 0 9 1,-0.2 10,-1.9 -17,-0.2 -1,-0.3 0.453 103.3 56.2 -75.5 -0.3 48.5 -7.2 53.8 27 28 A L G <4 S+ 0 0 5 -3,-2.1 -1,-0.2 8,-0.2 -2,-0.2 0.531 81.9 109.4-100.9 -6.2 46.2 -10.3 54.0 28 29 A L S << S- 0 0 0 -3,-1.2 7,-2.0 -4,-0.7 2,-0.1 -0.294 79.4 -98.4 -62.7 151.8 43.8 -8.6 56.5 29 30 A P E -I 34 0B 23 0, 0.0 2,-0.6 0, 0.0 207,-0.1 -0.391 23.4-163.1 -78.5 141.6 40.5 -7.7 54.9 30 31 A I E > S-I 33 0B 0 3,-2.8 3,-1.0 -2,-0.1 2,-0.6 -0.954 77.3 -58.1-116.6 96.8 39.6 -4.2 53.6 31 32 A Y T 3 S- 0 0 18 -2,-0.6 205,-0.1 1,-0.2 206,-0.1 -0.432 126.2 -3.0 63.9-101.5 35.8 -4.8 53.5 32 33 A D T 3 S+ 0 0 0 -2,-0.6 278,-0.4 204,-0.1 -1,-0.2 0.158 126.1 45.5-110.4 19.5 35.3 -7.9 51.2 33 34 A K E < S-I 30 0B 0 -3,-1.0 -3,-2.8 276,-0.1 5,-0.1 -0.993 89.6 -86.2-157.4 153.9 38.8 -8.7 50.0 34 35 A P E > -I 29 0B 0 0, 0.0 3,-1.6 0, 0.0 4,-0.4 -0.331 44.2-114.1 -60.9 152.7 42.4 -9.0 51.3 35 36 A M T > S+ 0 0 0 -7,-2.0 3,-2.1 1,-0.3 -8,-0.2 0.838 111.2 62.9 -59.8 -38.9 44.3 -5.8 51.5 36 37 A I T 3> S+ 0 0 0 -10,-1.9 4,-1.8 1,-0.3 -1,-0.3 0.721 86.9 73.1 -66.8 -20.7 46.9 -6.7 48.8 37 38 A Y H <> S+ 0 0 4 -3,-1.6 4,-2.1 -11,-0.2 -1,-0.3 0.782 91.2 61.3 -58.4 -29.8 44.1 -6.9 46.2 38 39 A Y H <> S+ 0 0 2 -3,-2.1 4,-2.0 -4,-0.4 -2,-0.2 0.981 109.0 34.5 -69.1 -52.4 44.0 -3.1 46.3 39 40 A P H > S+ 0 0 0 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.853 116.3 58.3 -69.7 -33.7 47.5 -2.2 45.2 40 41 A L H X S+ 0 0 0 -4,-1.8 4,-2.3 1,-0.2 -2,-0.2 0.931 107.4 46.7 -55.6 -48.6 47.4 -5.2 42.9 41 42 A S H X S+ 0 0 0 -4,-2.1 4,-2.9 2,-0.2 -1,-0.2 0.863 108.2 57.4 -58.9 -38.2 44.4 -3.7 41.3 42 43 A T H X S+ 0 0 2 -4,-2.0 4,-1.1 2,-0.2 -2,-0.2 0.954 108.6 44.1 -60.9 -45.8 46.1 -0.3 41.1 43 44 A L H ><>S+ 0 0 0 -4,-2.6 5,-2.6 1,-0.2 3,-0.7 0.921 113.4 52.0 -64.3 -45.8 49.0 -1.8 39.1 44 45 A M H ><5S+ 0 0 0 -4,-2.3 3,-1.8 1,-0.3 -1,-0.2 0.932 106.4 53.6 -55.2 -42.2 46.6 -3.7 36.9 45 46 A L H 3<5S+ 0 0 45 -4,-2.9 -1,-0.3 1,-0.3 -2,-0.2 0.779 104.0 56.0 -63.3 -24.6 44.7 -0.5 36.3 46 47 A A T <<5S- 0 0 9 -4,-1.1 -1,-0.3 -3,-0.7 -2,-0.2 0.527 124.4-106.8 -83.0 -7.6 48.0 1.1 35.1 47 48 A G T < 5S+ 0 0 24 -3,-1.8 -44,-0.5 -4,-0.5 2,-0.5 0.705 73.8 143.0 88.2 20.1 48.3 -1.7 32.6 48 49 A I E < +a 3 0A 4 -5,-2.6 -1,-0.3 -6,-0.2 -44,-0.2 -0.862 13.7 159.9-100.2 129.2 51.0 -3.5 34.5 49 50 A R E + 0 0 72 -46,-1.1 27,-2.5 -2,-0.5 2,-0.7 0.522 54.4 75.4-122.5 -13.5 50.9 -7.3 34.4 50 51 A D E +ac 4 76A 14 -47,-2.2 -45,-1.8 25,-0.2 2,-0.4 -0.916 68.8 175.4-107.9 104.2 54.4 -8.6 35.3 51 52 A I E -ac 5 77A 0 25,-2.5 27,-1.9 -2,-0.7 2,-0.5 -0.955 27.5-155.1-126.8 136.3 54.6 -8.1 39.0 52 53 A L E -ac 6 78A 2 -47,-2.5 -45,-2.7 -2,-0.4 2,-0.6 -0.890 13.0-156.2-104.8 123.4 57.1 -8.9 41.7 53 54 A I E -ac 7 79A 0 25,-3.4 27,-2.0 -2,-0.5 2,-0.5 -0.899 9.2-167.4-102.4 126.9 55.8 -9.3 45.2 54 55 A I E +ac 8 80A 0 -47,-2.7 -45,-3.3 -2,-0.6 2,-0.2 -0.915 21.8 141.1-114.6 131.1 58.3 -8.7 48.0 55 56 A S E - c 0 81A 0 25,-1.6 27,-3.2 -2,-0.5 -45,-0.3 -0.751 48.8 -59.4-148.1-166.5 57.6 -9.6 51.6 56 57 A T > - 0 0 23 -47,-0.4 4,-2.5 -2,-0.2 -1,-0.1 -0.274 49.9-104.6 -79.3 169.8 59.2 -11.1 54.7 57 58 A P T 4 S+ 0 0 73 0, 0.0 -1,-0.1 0, 0.0 27,-0.0 0.943 123.4 42.3 -60.9 -43.4 60.7 -14.5 55.1 58 59 A Q T 4 S+ 0 0 135 1,-0.2 4,-0.3 2,-0.1 -34,-0.1 0.865 121.5 37.6 -71.4 -36.6 57.5 -15.6 57.0 59 60 A D T >> S+ 0 0 30 2,-0.1 4,-1.8 1,-0.1 3,-0.8 0.769 94.2 78.0 -93.2 -23.8 54.9 -13.9 54.8 60 61 A T H 3X S+ 0 0 7 -4,-2.5 4,-2.1 1,-0.3 3,-0.4 0.935 96.0 49.2 -53.7 -45.3 56.2 -14.3 51.2 61 62 A P H 3> S+ 0 0 57 0, 0.0 4,-2.3 0, 0.0 -1,-0.3 0.814 106.0 58.2 -67.5 -25.6 55.0 -17.9 51.0 62 63 A R H <> S+ 0 0 55 -3,-0.8 4,-1.4 -4,-0.3 -2,-0.2 0.853 107.3 46.8 -68.2 -37.3 51.6 -17.0 52.3 63 64 A F H X S+ 0 0 0 -4,-1.8 4,-2.7 -3,-0.4 5,-0.4 0.885 111.4 51.8 -66.6 -41.1 51.1 -14.5 49.5 64 65 A Q H X S+ 0 0 107 -4,-2.1 4,-2.3 -5,-0.2 -2,-0.2 0.919 108.0 51.9 -64.6 -38.0 52.4 -17.2 47.0 65 66 A Q H < S+ 0 0 145 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.842 115.2 42.9 -65.7 -32.8 49.8 -19.7 48.4 66 67 A L H < S+ 0 0 26 -4,-1.4 -2,-0.2 -5,-0.1 -1,-0.2 0.920 129.4 20.8 -78.8 -43.9 47.0 -17.2 47.9 67 68 A L H >< S- 0 0 3 -4,-2.7 3,-1.4 1,-0.2 5,-0.2 0.651 81.2-170.6-105.5 -21.7 47.8 -15.8 44.5 68 69 A G T 3< - 0 0 29 -4,-2.3 -1,-0.2 -5,-0.4 -2,-0.1 -0.192 66.8 -32.6 61.5-144.4 50.1 -18.3 42.8 69 70 A D T 3 S- 0 0 89 7,-0.1 8,-2.5 1,-0.1 -1,-0.2 0.468 81.4-129.0 -92.1 1.8 51.7 -17.3 39.5 70 71 A G S X >S+ 0 0 0 -3,-1.4 5,-2.2 6,-0.2 3,-1.8 0.485 70.2 127.8 73.3 8.8 48.7 -15.2 38.8 71 72 A S G > 5 + 0 0 75 1,-0.3 3,-1.9 3,-0.2 -1,-0.1 0.796 62.8 73.1 -80.7 -3.8 48.0 -16.4 35.3 72 73 A Q G 3 5S+ 0 0 54 1,-0.3 -1,-0.3 -5,-0.2 199,-0.1 0.767 105.7 39.8 -66.4 -25.5 44.5 -17.1 36.3 73 74 A W G < 5S- 0 0 7 -3,-1.8 -1,-0.3 2,-0.1 -2,-0.2 0.185 124.1-105.0-105.2 12.0 44.2 -13.3 36.2 74 75 A G T < 5S+ 0 0 12 -3,-1.9 -3,-0.2 1,-0.2 2,-0.2 0.742 86.0 118.5 68.7 26.7 46.3 -13.0 33.1 75 76 A L < - 0 0 4 -5,-2.2 2,-0.4 -25,-0.0 -1,-0.2 -0.585 63.0-134.3-111.4 177.7 49.2 -11.7 35.2 76 77 A N E -c 50 0A 70 -27,-2.5 -25,-2.5 -2,-0.2 2,-0.4 -0.956 30.6-173.9-136.4 95.9 52.8 -13.1 35.8 77 78 A L E +c 51 0A 8 -8,-2.5 2,-0.3 -2,-0.4 -25,-0.2 -0.866 7.9 174.1-100.5 139.3 53.5 -12.9 39.5 78 79 A Q E -c 52 0A 60 -27,-1.9 -25,-3.4 -2,-0.4 2,-0.4 -0.886 16.1-140.6-135.6 167.1 56.8 -13.7 41.1 79 80 A Y E +c 53 0A 30 -2,-0.3 2,-0.3 -27,-0.2 -25,-0.2 -0.981 16.5 175.9-133.5 147.3 58.0 -13.5 44.7 80 81 A K E -c 54 0A 115 -27,-2.0 -25,-1.6 -2,-0.4 2,-0.3 -0.989 26.8-123.8-148.7 146.2 61.2 -12.5 46.6 81 82 A V E -c 55 0A 62 -2,-0.3 -25,-0.2 -27,-0.2 3,-0.1 -0.711 7.6-149.8 -90.0 141.0 62.0 -12.2 50.3 82 83 A Q - 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0 0 62 12,-0.1 -1,-0.1 73,-0.1 13,-0.0 0.741 39.1-137.5 -76.7 -31.8 35.2 -23.2 55.7 304 14 B G > + 0 0 22 11,-0.1 3,-1.8 1,-0.0 7,-0.3 0.676 46.1 153.6 79.0 21.1 34.2 -19.6 55.8 305 15 B T G > + 0 0 63 1,-0.3 3,-1.4 2,-0.2 -28,-0.1 0.723 63.6 63.3 -49.6 -42.7 32.7 -19.6 52.2 306 16 B R G 3 S+ 0 0 129 1,-0.2 -1,-0.3 -28,-0.1 -27,-0.2 0.792 107.7 47.6 -56.7 -21.6 30.2 -16.8 52.8 307 17 B L G X> S+ 0 0 5 -3,-1.8 3,-1.1 212,-0.1 4,-0.9 0.345 91.1 167.2-104.7 8.5 33.3 -14.6 53.4 308 18 B Y T <4 + 0 0 48 -3,-1.4 -28,-0.3 1,-0.3 -27,-0.1 -0.419 56.9 25.2 -60.3 147.3 35.4 -15.6 50.4 309 19 B P T >> S+ 0 0 0 0, 0.0 3,-1.7 0, 0.0 4,-0.9 -0.995 121.1 55.9 -89.7 1.8 37.9 -14.4 49.3 310 20 B V H X> S+ 0 0 1 -3,-1.1 4,-2.0 -278,-0.4 3,-1.2 0.936 110.8 48.5 -53.6 -47.6 38.8 -12.8 52.6 311 21 B T H 3< S+ 0 0 11 -4,-0.9 -1,-0.3 -7,-0.3 -3,-0.2 0.420 97.1 68.2 -81.1 3.6 38.7 -16.2 54.3 312 22 B M H <4 S+ 0 0 78 -3,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.708 112.1 34.9 -77.8 -28.0 40.8 -17.8 51.6 313 23 B A H << S+ 0 0 19 -3,-1.2 2,-0.4 -4,-0.9 -2,-0.2 0.829 131.3 20.5 -91.4 -36.1 43.6 -15.7 53.0 314 24 B V S < S- 0 0 7 -4,-2.0 -1,-0.3 -5,-0.2 5,-0.1 -0.990 82.0-109.7-142.1 133.3 42.7 -15.7 56.7 315 25 B S >> - 0 0 10 -2,-0.4 3,-2.2 1,-0.1 4,-0.7 -0.235 34.4-118.4 -58.2 143.4 40.6 -18.0 58.9 316 26 B K G >4 S+ 0 0 30 1,-0.3 3,-1.5 2,-0.2 10,-0.3 0.880 112.9 55.6 -49.8 -42.5 37.4 -16.3 60.0 317 27 B Q G 34 S+ 0 0 10 1,-0.3 10,-2.7 -17,-0.2 -1,-0.3 0.531 104.1 54.4 -79.0 -1.6 38.3 -16.6 63.7 318 28 B L G <4 S+ 0 0 4 -3,-2.2 -1,-0.3 8,-0.2 -2,-0.2 0.486 81.3 113.5 -99.8 -7.2 41.7 -14.8 63.1 319 29 B L S << S- 0 0 2 -3,-1.5 7,-2.5 -4,-0.7 2,-0.2 -0.336 76.2-103.8 -67.0 146.2 40.0 -11.8 61.5 320 30 B P E -S 325 0E 18 0, 0.0 2,-0.6 0, 0.0 207,-0.2 -0.451 22.3-162.7 -72.0 138.6 40.4 -8.6 63.5 321 31 B I E > S-S 324 0E 0 3,-2.6 2,-1.3 -2,-0.2 3,-1.0 -0.923 75.7 -59.8-114.6 94.6 37.5 -7.2 65.5 322 32 B Y T 3 S- 0 0 23 -2,-0.6 -90,-0.1 1,-0.2 205,-0.1 -0.494 126.3 -2.3 61.7 -97.5 38.9 -3.8 66.0 323 33 B D T 3 S+ 0 0 3 -2,-1.3 -304,-0.3 204,-0.1 -1,-0.2 0.261 125.6 42.0-112.4 9.2 42.2 -4.5 67.8 324 34 B K E < S-S 321 0E 0 -3,-1.0 -3,-2.6 -306,-0.1 -305,-0.1 -0.990 89.8 -83.9-150.4 160.9 42.4 -8.2 68.5 325 35 B P E > -S 320 0E 3 0, 0.0 3,-1.7 0, 0.0 4,-0.4 -0.243 42.8-113.7 -65.4 148.3 41.6 -11.4 66.6 326 36 B M T > S+ 0 0 0 -7,-2.5 3,-1.9 -10,-0.3 -8,-0.2 0.887 112.2 64.9 -52.4 -40.0 38.0 -12.6 66.7 327 37 B I T 3> S+ 0 0 0 -10,-2.7 4,-2.1 1,-0.3 -1,-0.3 0.770 86.4 71.6 -60.9 -19.7 38.9 -15.7 68.8 328 38 B Y H <> S+ 0 0 2 -3,-1.7 4,-1.5 -11,-0.2 -1,-0.3 0.824 92.7 58.3 -60.6 -28.1 40.0 -13.5 71.7 329 39 B Y H <> S+ 0 0 1 -3,-1.9 4,-1.7 -4,-0.4 3,-0.2 0.984 111.2 35.4 -75.0 -53.3 36.3 -12.7 72.4 330 40 B P H > S+ 0 0 0 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.873 115.1 58.5 -66.5 -32.0 34.8 -16.2 72.9 331 41 B L H X S+ 0 0 1 -4,-2.1 4,-1.8 1,-0.2 -2,-0.2 0.894 106.7 50.8 -62.7 -26.0 38.1 -17.1 74.6 332 42 B S H X S+ 0 0 0 -4,-1.5 4,-2.2 -3,-0.2 -1,-0.2 0.840 102.9 56.0 -77.3 -35.4 37.2 -14.3 76.9 333 43 B T H X S+ 0 0 2 -4,-1.7 4,-1.1 2,-0.2 -1,-0.2 0.945 109.0 48.8 -61.8 -42.8 33.7 -15.5 77.6 334 44 B L H ><>S+ 0 0 0 -4,-2.1 5,-2.2 1,-0.2 3,-0.7 0.923 111.2 48.6 -65.3 -43.6 35.2 -18.9 78.8 335 45 B M H ><5S+ 0 0 0 -4,-1.8 3,-1.7 1,-0.3 -1,-0.2 0.887 108.2 53.9 -61.2 -42.2 37.8 -17.2 81.1 336 46 B L H 3<5S+ 0 0 45 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.711 104.1 56.2 -64.2 -29.8 35.1 -14.9 82.6 337 47 B A T <<5S- 0 0 17 -4,-1.1 -1,-0.3 -3,-0.7 -2,-0.2 0.403 124.8-106.6 -77.1 -4.1 33.1 -18.1 83.4 338 48 B G T < 5S+ 0 0 40 -3,-1.7 2,-0.6 1,-0.3 -3,-0.2 0.477 71.5 144.9 93.3 10.2 36.2 -19.4 85.4 339 49 B I < + 0 0 5 -5,-2.2 -1,-0.3 -6,-0.2 -2,-0.1 -0.684 15.1 162.6 -90.3 119.1 37.2 -21.9 82.8 340 50 B R + 0 0 109 -2,-0.6 27,-3.1 -46,-0.3 2,-0.7 0.517 57.8 75.1-107.0 -11.5 41.0 -22.4 82.4 341 51 B D E + m 0 367D 33 -47,-0.4 -45,-2.9 25,-0.2 2,-0.4 -0.906 66.6 171.7-110.1 111.7 41.1 -25.8 80.6 342 52 B I E -lm 296 368D 0 25,-2.3 27,-2.8 -2,-0.7 2,-0.5 -0.962 29.2-155.6-139.6 134.0 40.2 -25.4 77.0 343 53 B L E -lm 297 369D 0 -47,-3.0 -45,-2.7 -2,-0.4 2,-0.5 -0.899 13.4-156.5-103.9 128.6 40.1 -27.3 73.8 344 54 B I E -lm 298 370D 0 25,-3.2 27,-2.3 -2,-0.5 2,-0.5 -0.898 6.6-162.8-106.7 124.9 40.2 -25.4 70.5 345 55 B I E +lm 299 371D 0 -47,-2.4 -45,-3.1 -2,-0.5 2,-0.3 -0.930 22.0 155.4-109.6 120.7 38.8 -27.2 67.5 346 56 B S E - 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0 0 86 -2,-0.3 4,-2.3 -3,-0.1 3,-0.5 -0.456 34.0 -92.8-102.4 174.3 38.2 38.2 50.1 1138 266 D V H 3> S+ 0 0 63 1,-0.3 4,-2.4 2,-0.2 5,-0.2 0.834 122.3 52.9 -45.5 -44.9 40.7 37.2 52.9 1139 267 D E H 3> S+ 0 0 148 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.866 109.4 49.2 -62.6 -49.0 39.4 39.9 55.3 1140 268 D Q H <> S+ 0 0 53 -3,-0.5 4,-2.0 2,-0.2 -2,-0.2 0.918 109.7 51.5 -53.6 -46.5 35.9 38.6 54.9 1141 269 D V H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 3,-0.2 0.952 108.8 51.5 -62.8 -41.1 36.9 35.0 55.5 1142 270 D R H X S+ 0 0 72 -4,-2.4 4,-1.6 1,-0.2 -1,-0.2 0.893 107.9 51.1 -60.6 -40.1 38.7 36.0 58.7 1143 271 D K H < S+ 0 0 157 -4,-1.8 -1,-0.2 1,-0.2 -2,-0.2 0.832 112.4 47.2 -65.5 -39.1 35.7 37.8 60.0 1144 272 D L H < S+ 0 0 28 -4,-2.0 4,-0.3 -3,-0.2 -1,-0.2 0.787 109.2 55.6 -65.2 -40.0 33.5 34.7 59.3 1145 273 D A H >< S+ 0 0 0 -4,-2.2 3,-1.8 -5,-0.2 4,-0.3 0.867 92.5 70.0 -64.7 -35.5 36.0 32.4 60.9 1146 274 D V G >< S+ 0 0 81 -4,-1.6 3,-1.8 1,-0.3 4,-0.2 0.898 95.2 49.6 -59.8 -45.7 36.2 34.1 64.3 1147 275 D P G 3 S+ 0 0 82 0, 0.0 -1,-0.3 0, 0.0 3,-0.2 0.697 119.5 41.5 -66.8 -10.2 32.8 33.2 65.6 1148 276 D L G X S+ 0 0 13 -3,-1.8 6,-1.7 -4,-0.3 3,-1.2 0.216 84.5 106.3-110.7 1.4 33.5 29.6 64.6 1149 277 D I T < + 0 0 62 -3,-1.8 -1,-0.1 -4,-0.3 -3,-0.1 0.613 56.7 78.7 -72.4 -3.7 37.1 29.6 65.8 1150 278 D K T 3 S+ 0 0 151 -4,-0.2 -1,-0.3 -3,-0.2 2,-0.2 0.886 100.4 37.5 -68.0 -38.2 36.6 27.5 68.9 1151 279 D N S <> S- 0 0 24 -3,-1.2 4,-1.9 -555,-0.2 3,-0.4 -0.502 102.0 -88.4-110.8 179.0 36.5 24.3 66.8 1152 280 D N H > S+ 0 0 109 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.764 116.0 67.3 -53.9 -27.5 38.2 23.0 63.8 1153 281 D Y H > S+ 0 0 4 -554,-0.3 4,-1.8 1,-0.2 -1,-0.2 0.961 107.8 36.3 -65.7 -46.2 35.7 24.6 61.4 1154 282 D G H > S+ 0 0 0 -6,-1.7 4,-2.5 -3,-0.4 -5,-0.3 0.863 115.6 54.5 -76.1 -36.4 36.7 28.2 62.1 1155 283 D Q H X S+ 0 0 81 -4,-1.9 4,-2.1 -7,-0.5 -1,-0.2 0.915 106.3 53.5 -61.5 -37.5 40.4 27.4 62.5 1156 284 D Y H X S+ 0 0 28 -4,-2.5 4,-1.1 -5,-0.2 -2,-0.2 0.956 111.0 45.0 -63.0 -42.2 40.3 25.8 59.1 1157 285 D L H >< S+ 0 0 0 -4,-1.8 3,-0.5 1,-0.2 4,-0.5 0.923 110.1 54.7 -68.2 -41.8 38.9 28.9 57.5 1158 286 D Y H >< S+ 0 0 90 -4,-2.5 3,-1.1 1,-0.2 4,-0.4 0.909 108.1 49.7 -56.8 -40.6 41.3 31.3 59.4 1159 287 D K H >< S+ 0 0 115 -4,-2.1 3,-0.8 1,-0.3 -1,-0.2 0.721 92.1 72.3 -78.1 -17.0 44.3 29.4 58.1 1160 288 D M T << S+ 0 0 20 -4,-1.1 -1,-0.3 -3,-0.5 -2,-0.2 0.711 96.1 58.4 -65.4 -21.9 43.2 29.4 54.5 1161 289 D T T < S+ 0 0 21 -3,-1.1 -1,-0.3 -4,-0.5 -2,-0.2 0.717 128.3 9.5 -73.4 -39.7 44.2 33.1 54.9 1162 290 D K < 0 0 165 -3,-0.8 -3,-0.1 -4,-0.4 -2,-0.1 0.576 360.0 360.0 -97.3 -93.6 47.7 32.2 55.9 1163 291 D D 0 0 168 -995,-0.0 -3,-0.2 -5,-0.0 -4,-0.1 -0.332 360.0 360.0 172.6 360.0 48.3 28.4 55.3