==== 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 30-JUN-06 2DSI . COMPND 2 MOLECULE: DIPHTHINE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS HORIKOSHII; . AUTHOR H.MIZUTANI,Y.MATSUURA,K.SARABOJI,S.M.MALATHY SONY,M.N.PONNUS . 531 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 21896.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 376 70.8 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 . 48 9.0 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 . 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 . 40 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 67 12.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 134 25.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 3.0 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 6 0 1 0 4 2 2 4 0 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 2 2 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 0 151 0, 0.0 106,-0.6 0, 0.0 2,-0.3 0.000 360.0 360.0 360.0 -13.4 55.8 98.0 54.7 2 2 A V E -ab 79 107A 11 76,-0.6 78,-3.1 104,-0.1 2,-0.4 -0.934 360.0-130.4-146.0 165.4 52.6 98.1 56.8 3 3 A L E -ab 80 108A 0 104,-2.3 106,-2.4 -2,-0.3 2,-0.4 -0.979 20.3-163.1-120.2 128.1 49.8 96.2 58.5 4 4 A Y E -ab 81 109A 34 76,-2.5 78,-3.4 -2,-0.4 2,-0.7 -0.928 11.0-153.8-112.9 132.6 46.2 97.2 58.2 5 5 A F E -ab 82 110A 0 104,-3.0 106,-3.1 -2,-0.4 2,-0.5 -0.938 25.7-175.5-102.0 111.7 43.4 96.0 60.5 6 6 A I E -ab 83 111A 0 76,-2.5 78,-1.4 -2,-0.7 2,-0.2 -0.957 17.2-140.7-117.9 124.3 40.3 96.3 58.3 7 7 A G E -a 84 0A 0 104,-2.3 10,-0.5 -2,-0.5 80,-0.2 -0.541 3.9-158.9 -80.5 145.9 36.8 95.6 59.5 8 8 A L - 0 0 4 76,-3.0 7,-0.4 78,-0.4 3,-0.2 0.506 38.2-131.5-100.8 -8.3 34.4 93.7 57.2 9 9 A G B -E 86 0B 1 77,-1.7 77,-3.8 75,-0.4 -1,-0.3 -0.333 32.6 -49.1 93.2-173.3 31.2 94.9 58.9 10 10 A L S S- 0 0 1 75,-0.2 30,-0.3 5,-0.2 -1,-0.1 0.886 109.1 -7.2 -73.7 -50.0 28.0 93.2 60.1 11 11 A Y S S+ 0 0 54 1,-0.3 30,-2.1 199,-0.2 31,-0.3 0.787 111.4 18.6-122.6 -57.3 26.4 90.9 57.5 12 12 A D S > S- 0 0 15 29,-0.2 3,-2.1 198,-0.2 -1,-0.3 -0.672 79.5 -92.5-119.9 177.0 27.8 90.7 54.0 13 13 A E G > S+ 0 0 34 1,-0.3 3,-0.9 28,-0.2 271,-0.1 0.714 118.3 65.1 -60.2 -20.5 30.9 91.5 52.0 14 14 A R G 3 S+ 0 0 63 1,-0.2 271,-2.7 270,-0.1 270,-0.4 0.455 78.8 81.5 -84.5 2.3 29.5 94.9 51.1 15 15 A D G < + 0 0 3 -3,-2.1 -1,-0.2 -7,-0.4 2,-0.2 0.406 68.4 104.0 -85.3 3.3 29.5 96.1 54.8 16 16 A I S < S- 0 0 1 -3,-0.9 268,-2.8 97,-0.1 269,-0.3 -0.540 82.3-110.1 -78.1 150.0 33.2 96.9 54.4 17 17 A T B > -F 283 0C 1 -10,-0.5 4,-2.4 95,-0.4 266,-0.3 -0.496 21.5-115.3 -79.8 157.0 33.8 100.7 54.0 18 18 A V H > S+ 0 0 12 264,-2.7 4,-3.0 262,-0.3 5,-0.3 0.907 119.6 54.1 -55.8 -41.8 35.0 102.0 50.7 19 19 A K H > S+ 0 0 16 261,-2.6 4,-2.1 263,-0.3 5,-0.3 0.934 107.4 50.0 -57.5 -48.2 38.2 103.0 52.4 20 20 A G H > S+ 0 0 0 260,-0.3 4,-2.5 92,-0.2 -1,-0.2 0.901 113.4 46.1 -58.7 -42.1 38.7 99.5 53.6 21 21 A L H X S+ 0 0 12 -4,-2.4 4,-3.0 2,-0.2 5,-0.2 0.960 110.4 49.8 -67.6 -52.7 38.1 98.1 50.1 22 22 A E H X S+ 0 0 62 -4,-3.0 4,-0.7 1,-0.2 -1,-0.2 0.874 116.8 43.8 -55.6 -36.8 40.3 100.4 48.2 23 23 A I H >< S+ 0 0 28 -4,-2.1 3,-0.7 -5,-0.3 4,-0.4 0.921 112.7 50.4 -74.5 -44.0 43.1 99.8 50.7 24 24 A A H >< S+ 0 0 0 -4,-2.5 3,-1.6 -5,-0.3 -2,-0.2 0.908 103.8 60.3 -59.4 -42.8 42.6 96.0 50.8 25 25 A K H 3< S+ 0 0 84 -4,-3.0 -1,-0.2 1,-0.3 -2,-0.2 0.808 107.5 45.8 -54.8 -32.9 42.6 95.8 47.0 26 26 A K T << S+ 0 0 149 -4,-0.7 -1,-0.3 -3,-0.7 -2,-0.2 0.428 87.5 109.8 -93.8 -0.6 46.2 97.2 46.9 27 27 A C < - 0 0 0 -3,-1.6 53,-0.2 -4,-0.4 3,-0.1 -0.427 63.1-141.7 -75.6 152.5 47.7 95.0 49.7 28 28 A D S S+ 0 0 82 51,-2.4 2,-0.4 1,-0.3 52,-0.2 0.832 86.8 22.4 -81.3 -34.9 50.2 92.3 48.7 29 29 A Y E -c 80 0A 108 50,-1.5 52,-2.1 24,-0.1 2,-0.5 -0.998 67.2-162.1-136.4 137.9 48.9 89.8 51.2 30 30 A V E +cd 81 55A 5 24,-0.7 26,-2.1 -2,-0.4 2,-0.3 -0.973 11.0 175.9-126.1 120.7 45.5 89.5 52.9 31 31 A F E +cd 82 56A 12 50,-3.3 52,-2.6 -2,-0.5 2,-0.3 -0.723 6.6 177.3-112.5 167.6 44.8 87.5 56.0 32 32 A A E -cd 83 57A 0 24,-1.8 26,-3.1 50,-0.3 2,-0.3 -0.983 20.8-147.1-167.2 156.9 41.5 87.2 58.0 33 33 A E - 0 0 0 50,-2.1 26,-0.1 -2,-0.3 24,-0.0 -0.964 7.6-177.1-129.2 145.7 39.8 85.5 60.9 34 34 A F + 0 0 59 24,-0.5 5,-0.1 -2,-0.3 50,-0.1 -0.099 62.7 87.7-134.6 36.0 36.1 84.6 61.1 35 35 A Y S S+ 0 0 14 23,-0.1 135,-0.4 1,-0.1 3,-0.1 0.634 73.9 65.8-108.2 -20.0 35.8 83.2 64.7 36 36 A T S S- 0 0 14 1,-0.1 2,-0.3 133,-0.1 -1,-0.1 0.755 118.2 -2.4 -75.1 -23.8 35.1 86.4 66.7 37 37 A S S S- 0 0 3 496,-0.1 2,-0.5 49,-0.0 -1,-0.1 -0.972 73.0-107.7-158.3 169.2 31.7 86.9 65.0 38 38 A L - 0 0 28 -2,-0.3 2,-0.9 -3,-0.1 -3,-0.1 -0.921 13.0-162.5-114.0 122.6 29.5 85.5 62.3 39 39 A M > + 0 0 17 -2,-0.5 3,-0.6 -5,-0.1 -28,-0.2 -0.869 14.2 179.8 -99.4 101.4 28.8 87.1 58.9 40 40 A A T 3 + 0 0 40 -2,-0.9 -28,-0.1 -30,-0.3 -1,-0.1 0.326 68.0 59.4 -87.5 6.8 25.6 85.3 57.8 41 41 A G T 3 S+ 0 0 17 -30,-2.1 2,-0.2 -31,-0.1 -28,-0.2 0.275 104.3 33.5-119.8 14.0 25.1 87.1 54.5 42 42 A T < - 0 0 21 -3,-0.6 2,-0.3 -31,-0.3 3,-0.1 -0.778 62.9-132.6-147.8-170.2 28.3 86.3 52.6 43 43 A T > - 0 0 78 -2,-0.2 4,-1.7 1,-0.1 5,-0.2 -0.949 35.2-103.9-148.2 162.4 31.0 83.7 52.0 44 44 A L H > S+ 0 0 67 -2,-0.3 4,-3.0 1,-0.2 3,-0.4 0.942 120.9 56.2 -54.5 -47.4 34.8 83.7 51.8 45 45 A G H > S+ 0 0 43 1,-0.3 4,-2.7 2,-0.2 -1,-0.2 0.892 105.0 49.5 -51.6 -48.0 34.5 83.4 48.0 46 46 A R H > S+ 0 0 144 2,-0.2 4,-1.7 1,-0.2 -1,-0.3 0.836 112.7 48.2 -63.7 -32.3 32.4 86.5 47.7 47 47 A I H X S+ 0 0 4 -4,-1.7 4,-2.8 -3,-0.4 5,-0.3 0.930 111.8 48.4 -73.3 -46.3 34.8 88.5 49.9 48 48 A Q H X>S+ 0 0 57 -4,-3.0 4,-2.8 1,-0.2 5,-0.9 0.903 111.1 51.9 -59.2 -41.3 37.8 87.3 47.9 49 49 A K H <5S+ 0 0 182 -4,-2.7 -1,-0.2 -5,-0.3 -2,-0.2 0.906 111.8 46.5 -62.2 -41.4 36.0 88.2 44.7 50 50 A L H <5S+ 0 0 48 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.926 119.6 38.1 -67.2 -45.6 35.3 91.7 46.0 51 51 A I H <5S- 0 0 5 -4,-2.8 -2,-0.2 2,-0.2 -1,-0.2 0.771 99.2-136.2 -77.1 -27.9 38.8 92.3 47.3 52 52 A G T <5 + 0 0 58 -4,-2.8 2,-0.3 -5,-0.3 -3,-0.2 0.787 68.0 101.1 75.8 28.3 40.5 90.6 44.3 53 53 A K S - 0 0 52 -2,-0.3 4,-2.1 -26,-0.1 5,-0.2 -0.353 33.9 -98.3 -89.3 175.6 42.2 80.2 63.4 60 60 A R H > S+ 0 0 120 1,-0.2 4,-2.6 2,-0.2 5,-0.3 0.911 127.3 49.1 -61.6 -40.7 42.0 81.5 66.9 61 61 A E H >>S+ 0 0 127 1,-0.2 4,-2.3 2,-0.2 5,-0.9 0.896 106.1 55.9 -66.2 -40.5 45.2 79.7 67.7 62 62 A D H >5S+ 0 0 41 3,-0.2 4,-1.7 2,-0.2 7,-0.2 0.947 118.2 34.3 -55.8 -49.1 47.0 81.0 64.6 63 63 A V H X5S+ 0 0 1 -4,-2.1 4,-1.7 3,-0.2 5,-0.2 0.994 121.3 44.1 -68.2 -66.1 46.3 84.6 65.7 64 64 A E H <5S+ 0 0 78 -4,-2.6 -3,-0.2 1,-0.2 -2,-0.2 0.736 131.7 23.0 -53.9 -28.2 46.5 84.3 69.5 65 65 A L H <5S+ 0 0 100 -4,-2.3 -3,-0.2 -5,-0.3 -1,-0.2 0.762 136.4 22.5-111.0 -34.7 49.7 82.2 69.4 66 66 A N H >XS+ 0 0 0 -4,-1.7 4,-2.1 1,-0.3 5,-1.8 0.925 85.0 49.7 -60.5 -41.0 50.2 86.3 64.8 68 68 A E H 345S+ 0 0 78 -5,-0.2 -1,-0.3 1,-0.2 -2,-0.1 0.554 115.8 43.5 -73.7 -7.7 53.8 87.5 65.0 69 69 A N H <45S+ 0 0 102 -3,-1.2 -1,-0.2 -7,-0.2 -2,-0.2 0.618 123.6 31.9-109.6 -19.8 55.0 84.4 63.1 70 70 A I H <5S+ 0 0 30 -4,-2.0 4,-0.2 -8,-0.2 -3,-0.2 0.816 132.9 17.5-104.8 -44.2 52.4 84.2 60.4 71 71 A V T >X5S+ 0 0 0 -4,-2.1 4,-1.2 -5,-0.4 3,-0.7 0.891 117.4 55.6 -97.8 -51.0 51.3 87.8 59.6 72 72 A L H 3>4 S+ 0 0 58 0, 0.0 3,-0.9 0, 0.0 4,-0.3 0.923 107.4 43.8 -57.5 -39.7 57.0 88.7 59.1 74 74 A L H X> S+ 0 0 53 -3,-0.7 4,-1.4 -4,-0.2 3,-1.4 0.800 100.0 70.0 -73.6 -29.1 55.4 89.7 55.8 75 75 A A H 3< S+ 0 0 0 -4,-1.2 -1,-0.2 1,-0.3 32,-0.2 0.596 89.4 66.0 -65.5 -9.1 54.4 93.2 57.0 76 76 A K T << S+ 0 0 110 -3,-0.9 -1,-0.3 -4,-0.5 -2,-0.2 0.741 117.1 21.0 -84.8 -23.4 58.0 94.1 57.0 77 77 A E T <4 S+ 0 0 145 -3,-1.4 2,-0.3 -4,-0.3 -2,-0.2 0.384 127.3 37.5-122.5 -1.5 58.5 93.9 53.3 78 78 A N S < S- 0 0 40 -4,-1.4 2,-0.7 -76,-0.0 -76,-0.6 -0.939 83.0 -97.2-147.5 167.7 54.9 94.2 52.1 79 79 A D E -a 2 0A 50 -2,-0.3 -51,-2.4 -78,-0.2 -50,-1.5 -0.807 50.0-174.9 -88.2 115.6 51.5 95.9 52.5 80 80 A V E -ac 3 29A 0 -78,-3.1 -76,-2.5 -2,-0.7 2,-0.4 -0.906 13.2-159.3-119.0 145.5 49.5 93.4 54.6 81 81 A A E -ac 4 30A 0 -52,-2.1 -50,-3.3 -2,-0.4 2,-0.5 -0.959 5.5-158.8-125.2 141.2 45.9 93.4 55.7 82 82 A F E -ac 5 31A 0 -78,-3.4 -76,-2.5 -2,-0.4 2,-0.3 -0.974 18.0-158.2-119.7 114.3 44.1 91.6 58.5 83 83 A L E +ac 6 32A 0 -52,-2.6 -50,-2.1 -2,-0.5 -76,-0.2 -0.705 15.0 171.0 -97.4 146.3 40.3 91.3 58.0 84 84 A T E -a 7 0A 0 -78,-1.4 -76,-3.0 -2,-0.3 -75,-0.4 -0.978 38.5 -95.9-147.3 155.7 37.7 90.6 60.7 85 85 A P S S- 0 0 0 0, 0.0 -75,-0.2 0, 0.0 28,-0.1 -0.335 92.8 -10.6 -68.0 160.3 33.9 90.7 60.9 86 86 A G B S-E 9 0B 0 -77,-3.8 -77,-1.7 -79,-0.1 -78,-0.4 -0.183 129.5 -13.3 51.5-137.6 32.4 93.9 62.2 87 87 A D > - 0 0 0 446,-2.2 3,-1.8 -80,-0.2 25,-0.1 -0.863 66.8-133.4 -99.2 126.5 34.9 96.3 63.6 88 88 A P T 3 S+ 0 0 0 0, 0.0 6,-0.4 0, 0.0 -1,-0.1 0.728 100.6 40.7 -49.5 -31.6 38.4 94.8 64.3 89 89 A L T 3 S+ 0 0 9 5,-0.1 2,-0.5 444,-0.1 304,-0.3 0.197 91.3 101.0-108.3 17.8 38.9 96.2 67.8 90 90 A V S < S- 0 0 0 -3,-1.8 3,-0.1 1,-0.2 -3,-0.1 -0.899 99.4 -14.3-108.2 127.3 35.4 95.8 69.2 91 91 A A S S+ 0 0 43 -2,-0.5 2,-0.2 1,-0.2 -1,-0.2 0.803 118.4 92.1 55.5 31.5 34.6 92.9 71.6 92 92 A T S S- 0 0 23 -3,-0.2 -1,-0.2 441,-0.1 301,-0.2 -0.759 81.4-124.1-136.4-177.7 37.8 91.2 70.6 93 93 A T S > S+ 0 0 88 -2,-0.2 3,-0.9 -3,-0.1 4,-0.4 0.026 75.1 115.8-118.5 20.8 41.3 91.2 72.0 94 94 A H T > + 0 0 1 -6,-0.4 3,-1.1 1,-0.2 4,-0.4 0.689 56.3 77.5 -65.0 -20.6 42.8 92.3 68.6 95 95 A A T >> S+ 0 0 18 1,-0.3 3,-2.3 2,-0.2 4,-0.6 0.910 87.6 58.7 -56.2 -43.4 44.0 95.6 70.1 96 96 A E H X> S+ 0 0 53 -3,-0.9 4,-1.5 1,-0.3 3,-0.8 0.773 91.9 70.0 -58.7 -25.7 46.9 93.8 71.7 97 97 A L H <> S+ 0 0 3 -3,-1.1 4,-1.9 -4,-0.4 -1,-0.3 0.738 90.2 61.3 -65.4 -20.8 48.0 92.6 68.3 98 98 A R H <> S+ 0 0 25 -3,-2.3 4,-2.2 -4,-0.4 -1,-0.3 0.813 100.6 53.4 -74.0 -29.4 49.0 96.3 67.5 99 99 A I H S+ 0 0 0 -4,-1.9 5,-3.2 2,-0.2 3,-0.3 0.937 110.4 49.2 -60.1 -46.6 53.2 94.9 65.5 102 102 A K H ><5S+ 0 0 98 -4,-2.2 3,-2.5 1,-0.2 -2,-0.2 0.955 109.9 49.3 -57.5 -54.4 55.0 97.7 67.2 103 103 A R H 3<5S+ 0 0 165 -4,-2.6 -1,-0.2 1,-0.3 -2,-0.2 0.756 109.4 53.4 -59.8 -23.8 57.5 95.5 68.9 104 104 A A T 3<5S- 0 0 30 -4,-1.5 -1,-0.3 -3,-0.3 -2,-0.2 0.329 122.5-109.0 -91.6 7.0 58.2 93.8 65.6 105 105 A G T < 5S+ 0 0 62 -3,-2.5 2,-0.5 1,-0.2 -3,-0.2 0.840 74.0 137.9 70.5 34.6 58.9 97.2 64.1 106 106 A V < - 0 0 4 -5,-3.2 -1,-0.2 -6,-0.1 2,-0.2 -0.952 48.8-139.2-118.1 121.6 55.7 97.2 62.0 107 107 A E E -b 2 0A 126 -106,-0.6 -104,-2.3 -2,-0.5 2,-0.3 -0.544 25.6-162.2 -73.6 138.9 53.5 100.3 61.6 108 108 A S E -b 3 0A 13 -2,-0.2 2,-0.3 -106,-0.2 -104,-0.2 -0.937 10.1-164.8-126.6 151.1 49.8 99.4 61.8 109 109 A Y E -b 4 0A 67 -106,-2.4 -104,-3.0 -2,-0.3 2,-0.5 -0.959 12.0-139.2-131.9 150.3 46.7 101.3 60.7 110 110 A V E -b 5 0A 9 -2,-0.3 2,-0.5 -106,-0.2 -104,-0.2 -0.942 10.5-171.0-117.7 128.8 43.0 100.7 61.6 111 111 A I E -b 6 0A 3 -106,-3.1 -104,-2.3 -2,-0.5 -94,-0.1 -0.970 23.1-142.6-116.4 113.9 40.1 100.9 59.2 112 112 A H - 0 0 8 -2,-0.5 -95,-0.4 -106,-0.2 -92,-0.2 -0.183 16.8-172.1 -73.5 165.4 36.7 100.7 61.0 113 113 A A - 0 0 0 266,-0.1 268,-0.3 -97,-0.1 266,-0.1 -0.943 43.6 -62.9-149.9 163.9 33.5 99.0 59.8 114 114 A P - 0 0 0 0, 0.0 2,-0.3 0, 0.0 -105,-0.1 -0.265 56.6-158.2 -54.6 136.8 29.9 98.9 61.1 115 115 A S >> - 0 0 0 264,-0.3 4,-2.6 -29,-0.2 3,-1.0 -0.890 28.2-130.6-120.9 150.3 29.7 97.2 64.5 116 116 A I H 3> S+ 0 0 0 -2,-0.3 4,-1.5 1,-0.3 -1,-0.1 0.841 105.8 72.2 -63.9 -30.9 26.9 95.5 66.4 117 117 A Y H 34 S+ 0 0 1 1,-0.2 -1,-0.3 2,-0.2 46,-0.0 0.825 114.6 21.3 -54.5 -34.1 27.9 97.7 69.4 118 118 A S H X4 S+ 0 0 0 -3,-1.0 3,-2.1 2,-0.1 -1,-0.2 0.676 109.9 74.2-107.5 -24.0 26.4 100.7 67.5 119 119 A A H >< S+ 0 0 0 -4,-2.6 3,-2.7 1,-0.3 -2,-0.2 0.760 77.0 81.4 -60.7 -22.4 24.1 98.9 65.1 120 120 A V G ><> + 0 0 0 -4,-1.5 3,-2.1 1,-0.3 5,-0.5 0.637 68.8 85.5 -58.7 -10.0 21.8 98.3 68.1 121 121 A G G X 5S+ 0 0 1 -3,-2.1 3,-1.8 1,-0.3 -1,-0.3 0.787 73.8 70.9 -60.9 -24.5 20.7 101.9 67.5 122 122 A I G < 5S+ 0 0 3 -3,-2.7 -1,-0.3 1,-0.3 -2,-0.2 0.636 83.2 70.1 -67.8 -13.7 18.2 100.3 65.0 123 123 A T G < 5S- 0 0 0 -3,-2.1 -1,-0.3 2,-0.2 -2,-0.2 0.540 111.8-117.3 -79.9 -7.7 16.3 98.9 68.0 124 124 A G T < 5S+ 0 0 3 -3,-1.8 2,-0.3 1,-0.3 125,-0.2 0.325 73.1 132.0 88.8 -9.0 15.2 102.4 68.8 125 125 A L < - 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0 0 50 54,-0.0 -1,-0.3 49,-0.0 2,-0.3 -0.953 67.8-116.8-172.3 177.1 27.6 115.7 63.5 304 38 B L - 0 0 13 -2,-0.3 2,-0.8 -3,-0.1 3,-0.1 -0.889 14.8-127.9-131.6 162.3 30.0 116.6 60.7 305 39 B M > - 0 0 15 -2,-0.3 3,-1.5 1,-0.2 -28,-0.1 -0.796 30.4-179.9-108.8 83.7 32.4 115.0 58.3 306 40 B A T 3 S+ 0 0 34 -2,-0.8 -1,-0.2 -30,-0.3 -28,-0.1 0.736 72.6 56.9 -58.2 -28.1 35.5 116.9 59.0 307 41 B G T 3 S+ 0 0 19 -30,-2.0 -1,-0.3 -3,-0.1 2,-0.2 0.252 112.0 27.1 -93.4 14.6 37.7 115.1 56.5 308 42 B T S < S- 0 0 16 -3,-1.5 2,-0.3 -31,-0.2 -3,-0.1 -0.811 71.0-119.7-152.1-169.7 35.7 115.8 53.4 309 43 B T > - 0 0 71 -2,-0.2 4,-2.1 1,-0.1 5,-0.2 -0.913 30.9-108.2-138.4 164.9 33.2 118.2 51.8 310 44 B L H > S+ 0 0 63 -2,-0.3 4,-3.1 1,-0.2 5,-0.2 0.901 120.5 55.1 -61.0 -38.5 29.7 118.0 50.4 311 45 B G H > S+ 0 0 47 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.903 107.2 47.4 -61.7 -43.2 31.2 118.3 46.9 312 46 B R H > S+ 0 0 151 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.872 113.5 48.8 -67.5 -35.6 33.5 115.3 47.4 313 47 B I H X S+ 0 0 5 -4,-2.1 4,-2.4 2,-0.2 5,-0.3 0.946 112.8 47.3 -68.6 -45.5 30.6 113.3 48.8 314 48 B Q H X>S+ 0 0 41 -4,-3.1 4,-3.3 1,-0.2 5,-1.1 0.923 110.8 52.6 -59.3 -44.6 28.4 114.3 45.8 315 49 B K H <5S+ 0 0 172 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.897 111.1 46.7 -57.6 -43.2 31.2 113.5 43.4 316 50 B L H <5S+ 0 0 44 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.889 118.1 40.8 -67.1 -42.2 31.5 110.0 44.9 317 51 B I H <5S- 0 0 5 -4,-2.4 -2,-0.2 2,-0.2 -1,-0.2 0.833 97.9-138.8 -76.0 -33.6 27.8 109.3 44.9 318 52 B G T <5 + 0 0 61 -4,-3.3 2,-0.3 1,-0.3 -3,-0.2 0.843 66.4 104.4 76.1 33.7 27.3 110.9 41.5 319 53 B K S - 0 0 55 -2,-0.4 4,-1.8 -26,-0.1 5,-0.2 -0.197 34.6 -96.9 -81.1 179.7 18.7 121.7 58.4 326 60 B R H > S+ 0 0 102 2,-0.2 4,-2.7 1,-0.2 5,-0.4 0.949 127.2 46.4 -64.7 -48.6 17.6 120.5 61.8 327 61 B E H >>S+ 0 0 121 1,-0.2 4,-2.3 2,-0.2 5,-1.1 0.896 107.0 59.3 -61.2 -39.4 14.2 122.2 61.5 328 62 B D H >5S+ 0 0 39 3,-0.2 4,-1.1 2,-0.2 7,-0.2 0.937 116.6 33.1 -52.7 -49.0 13.8 120.7 58.0 329 63 B V H X5S+ 0 0 2 -4,-1.8 4,-1.6 3,-0.2 -2,-0.2 0.987 122.9 41.2 -73.0 -62.9 14.1 117.2 59.5 330 64 B E H <5S+ 0 0 68 -4,-2.7 -3,-0.2 1,-0.2 -2,-0.2 0.838 130.9 26.4 -58.4 -35.2 12.5 117.5 63.0 331 65 B L H <5S+ 0 0 99 -4,-2.3 -3,-0.2 -5,-0.4 -1,-0.2 0.848 135.5 21.1 -97.5 -39.4 9.6 119.7 61.7 332 66 B N H >XS+ 0 0 0 -4,-1.6 4,-1.9 1,-0.3 5,-1.6 0.878 82.3 50.5 -53.3 -41.6 10.6 115.5 57.3 334 68 B E H 345S+ 0 0 82 1,-0.2 -1,-0.3 -5,-0.2 -2,-0.1 0.634 115.0 44.0 -73.1 -13.5 7.3 114.1 56.2 335 69 B N H <45S+ 0 0 109 -3,-1.6 -1,-0.2 -7,-0.2 -2,-0.2 0.556 122.9 32.7-106.4 -11.1 6.8 117.1 53.8 336 70 B I H <5S+ 0 0 25 -4,-1.5 4,-0.3 -3,-0.4 -3,-0.2 0.792 131.8 17.1-110.2 -47.3 10.3 117.3 52.3 337 71 B V T X5S+ 0 0 0 -4,-1.9 4,-1.3 -5,-0.3 3,-0.2 0.886 116.5 56.4 -96.3 -49.6 11.6 113.7 52.1 338 72 B L H >> S+ 0 0 66 0, 0.0 3,-1.6 0, 0.0 4,-0.5 0.970 108.8 40.0 -55.2 -54.8 6.6 112.6 49.5 340 74 B L H >> S+ 0 0 56 -4,-0.3 3,-0.7 1,-0.3 4,-0.6 0.798 108.2 64.6 -63.2 -28.4 9.3 111.7 46.9 341 75 B A H 3< S+ 0 0 0 -4,-1.3 -1,-0.3 1,-0.2 -73,-0.2 0.657 90.6 67.8 -70.3 -14.8 9.9 108.4 48.8 342 76 B K H << S+ 0 0 90 -3,-1.6 -1,-0.2 -4,-0.8 -2,-0.2 0.837 117.5 18.9 -73.9 -33.6 6.4 107.3 48.0 343 77 B E H << S+ 0 0 161 -3,-0.7 2,-0.3 -4,-0.5 -2,-0.2 0.178 128.4 39.5-122.5 16.0 7.0 107.0 44.2 344 78 B N S < S- 0 0 46 -4,-0.6 -76,-1.4 -5,-0.1 2,-0.7 -0.925 85.1 -93.4-153.0 174.6 10.8 106.8 44.2 345 79 B D E -n 268 0H 59 -2,-0.3 -51,-1.9 -78,-0.2 -50,-1.5 -0.888 48.1-172.7 -96.8 116.1 13.9 105.4 45.9 346 80 B V E -np 269 295H 0 -78,-2.8 -76,-3.2 -2,-0.7 2,-0.4 -0.898 12.3-155.2-116.1 143.9 15.2 108.0 48.3 347 81 B A E -np 270 296H 0 -52,-2.2 -50,-3.6 -2,-0.4 2,-0.5 -0.920 2.9-163.8-116.6 141.4 18.3 108.1 50.4 348 82 B F E -np 271 297H 0 -78,-3.4 -76,-2.7 -2,-0.4 2,-0.4 -0.969 15.6-157.4-124.5 110.2 18.9 110.1 53.6 349 83 B L E +np 272 298H 0 -52,-3.0 -50,-2.3 -2,-0.5 -76,-0.2 -0.728 15.0 173.5 -93.2 137.6 22.6 110.4 54.5 350 84 B T E -n 273 0H 0 -78,-2.0 -76,-2.9 -2,-0.4 -75,-0.4 -0.988 36.5-101.4-139.5 148.5 23.8 111.1 58.0 351 85 B P S S- 0 0 8 0, 0.0 -75,-0.2 0, 0.0 2,-0.1 -0.274 89.1 -4.4 -64.3 157.4 27.3 111.2 59.5 352 86 B G B S-R 275 0I 15 -77,-3.1 -77,-1.8 -79,-0.1 29,-0.2 -0.322 122.6 -15.5 64.7-136.6 28.4 108.1 61.4 353 87 B D S >> S- 0 0 4 -80,-0.2 3,-1.8 -79,-0.1 4,-0.5 -0.906 75.3-112.2-107.5 126.9 25.9 105.3 61.9 354 88 B P T 34 S+ 0 0 0 0, 0.0 -233,-0.1 0, 0.0 25,-0.1 -0.229 99.8 21.1 -56.2 147.9 22.2 106.0 61.3 355 89 B L T 34 S+ 0 0 5 2,-0.1 -228,-0.3 1,-0.1 6,-0.2 0.425 91.6 101.0 74.5 -1.3 20.1 105.9 64.4 356 90 B V T <4 + 0 0 23 -3,-1.8 -229,-0.5 -230,-0.1 -228,-0.3 0.921 67.7 77.5 -75.7 -43.8 22.9 106.4 66.9 357 91 B A S >X S- 0 0 28 -4,-0.5 3,-1.9 1,-0.2 4,-0.5 -0.487 95.4-127.6 -62.2 124.5 21.9 110.1 67.1 358 92 B T T 34 S+ 0 0 61 -2,-0.3 4,-0.4 1,-0.3 3,-0.3 0.761 101.1 55.0 -48.5 -36.3 18.8 109.8 69.4 359 93 B T T 3> S+ 0 0 51 1,-0.2 4,-0.6 2,-0.1 -1,-0.3 0.611 90.6 74.8 -78.4 -12.2 16.4 111.7 67.2 360 94 B H H X> S+ 0 0 2 -3,-1.9 3,-1.5 1,-0.2 4,-0.6 0.913 82.5 65.0 -66.3 -45.9 16.8 109.5 64.1 361 95 B A H >X S+ 0 0 7 -4,-0.5 3,-2.5 -3,-0.3 4,-0.6 0.897 96.0 57.8 -42.2 -55.5 14.9 106.4 65.2 362 96 B E H >> S+ 0 0 57 -4,-0.4 4,-1.6 1,-0.3 3,-1.0 0.784 92.3 69.7 -49.0 -34.0 11.6 108.3 65.3 363 97 B L H <>S+ 0 0 0 -4,-1.6 5,-2.9 1,-0.2 3,-0.9 0.931 108.1 51.5 -61.7 -45.9 8.0 106.7 57.2 368 102 B K H ><5S+ 0 0 97 -4,-2.0 3,-1.9 1,-0.3 -2,-0.2 0.933 108.6 50.2 -56.3 -49.0 5.7 103.9 58.4 369 103 B R H 3<5S+ 0 0 173 -4,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.647 108.4 53.9 -66.9 -14.1 2.8 106.3 58.9 370 104 B A T <<5S- 0 0 35 -3,-0.9 -1,-0.3 -4,-0.8 -2,-0.2 0.386 119.6-110.9 -98.1 1.1 3.4 107.8 55.4 371 105 B G T < 5S+ 0 0 33 -3,-1.9 2,-0.4 -4,-0.3 -3,-0.2 0.788 74.9 135.1 74.7 27.9 3.1 104.3 53.9 372 106 B V < - 0 0 7 -5,-2.9 -1,-0.3 -6,-0.2 2,-0.2 -0.922 51.4-134.2-114.1 133.9 6.9 104.3 53.1 373 107 B E E -o 268 0H 98 -106,-2.1 -104,-2.8 -2,-0.4 2,-0.4 -0.563 24.4-164.6 -81.0 147.6 9.2 101.4 53.7 374 108 B S E -o 269 0H 16 -106,-0.2 2,-0.3 -2,-0.2 -104,-0.2 -0.995 9.8-172.3-138.1 144.2 12.6 102.2 55.2 375 109 B Y E -o 270 0H 42 -106,-2.0 -104,-2.7 -2,-0.4 2,-0.5 -0.957 18.4-132.4-132.5 151.3 15.8 100.3 55.6 376 110 B V E -o 271 0H 6 -2,-0.3 2,-0.7 -164,-0.2 -104,-0.2 -0.913 11.3-167.3-111.8 123.1 19.0 101.1 57.5 377 111 B I E -o 272 0H 3 -106,-3.3 -104,-2.2 -2,-0.5 -94,-0.1 -0.934 24.0-145.3-106.7 113.0 22.4 100.8 56.0 378 112 B H + 0 0 7 -2,-0.7 -95,-0.3 -106,-0.2 -92,-0.2 -0.192 20.0 179.1 -75.8 166.4 25.0 101.0 58.8 379 113 B A - 0 0 0 -266,-0.1 -264,-0.3 -25,-0.1 -266,-0.1 -0.951 44.7 -62.4-157.5 164.5 28.5 102.6 58.9 380 114 B P - 0 0 2 0, 0.0 2,-0.3 0, 0.0 -105,-0.1 -0.249 50.8-159.6 -56.6 140.7 31.2 103.0 61.5 381 115 B S >> - 0 0 5 -268,-0.3 4,-3.0 -29,-0.2 3,-0.9 -0.882 28.3-126.4-121.0 152.7 30.3 105.1 64.6 382 116 B I H 3> S+ 0 0 33 -2,-0.3 4,-1.4 1,-0.3 5,-0.1 0.841 109.9 71.2 -65.7 -28.5 32.6 106.9 67.0 383 117 B Y H 34 S+ 0 0 2 1,-0.2 -1,-0.3 2,-0.2 46,-0.0 0.860 114.5 23.4 -54.5 -37.4 30.6 104.9 69.6 384 118 B S H X4 S+ 0 0 0 -3,-0.9 3,-2.0 1,-0.1 -2,-0.2 0.757 111.8 69.8 -99.8 -30.3 32.4 101.8 68.4 385 119 B A H >< S+ 0 0 0 -4,-3.0 3,-2.3 1,-0.3 -2,-0.2 0.675 78.7 81.7 -62.1 -16.7 35.5 103.3 66.8 386 120 B V G ><> + 0 0 0 -4,-1.4 3,-2.5 1,-0.3 5,-0.5 0.652 68.0 86.3 -63.9 -10.9 36.7 104.2 70.4 387 121 B G G X 5S+ 0 0 2 -3,-2.0 3,-1.6 1,-0.3 -1,-0.3 0.750 73.2 72.0 -60.1 -20.3 37.8 100.6 70.4 388 122 B I G < 5S+ 0 0 5 -3,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.637 81.2 71.8 -70.9 -11.4 41.0 102.0 68.8 389 123 B T G < 5S- 0 0 0 -3,-2.5 -1,-0.3 2,-0.2 -2,-0.2 0.594 111.8-117.5 -78.4 -8.7 41.9 103.6 72.1 390 124 B G T < 5S+ 0 0 5 -3,-1.6 2,-0.3 1,-0.3 125,-0.2 0.389 73.5 132.1 88.7 -5.9 42.7 100.1 73.5 391 125 B L < - 0 0 3 -5,-0.5 -1,-0.3 1,-0.1 -2,-0.2 -0.655 68.0-105.6 -81.7 135.3 39.9 100.4 76.1 392 126 B H > - 0 0 35 -2,-0.3 3,-1.1 1,-0.1 4,-0.2 -0.397 21.9-141.7 -62.4 128.0 37.6 97.3 76.2 393 127 B I G > S+ 0 0 4 -304,-0.3 3,-1.5 1,-0.2 -1,-0.1 0.842 98.4 59.9 -61.1 -35.0 34.3 98.2 74.6 394 128 B Y G 3 S+ 0 0 104 1,-0.3 -261,-2.3 -262,-0.1 -1,-0.2 0.740 97.7 62.3 -67.4 -20.3 32.3 96.2 77.2 395 129 B K G < S+ 0 0 23 -3,-1.1 32,-2.6 -263,-0.2 2,-0.4 0.479 77.9 105.0 -84.6 -1.8 33.7 98.4 79.9 396 130 B F B < -s 427 0J 2 -3,-1.5 32,-0.2 30,-0.2 -263,-0.1 -0.647 52.3-172.0 -79.9 134.2 32.1 101.6 78.6 397 131 B G - 0 0 1 30,-2.8 32,-0.2 -2,-0.4 -267,-0.1 0.064 45.8 -18.1-101.7-146.8 29.2 102.7 80.6 398 132 B K - 0 0 63 19,-0.1 31,-0.4 -269,-0.1 -1,-0.4 -0.238 68.7-135.7 -56.6 147.4 26.6 105.5 80.0 399 133 B S - 0 0 1 -271,-2.0 2,-0.3 29,-0.1 31,-0.2 -0.667 22.0-173.9-104.4 163.0 27.6 108.1 77.5 400 134 B A E -t 430 0K 13 29,-1.9 31,-2.5 -2,-0.2 2,-0.4 -0.967 20.5-126.0-151.8 165.8 27.3 111.9 77.7 401 135 B T E -t 431 0K 76 -2,-0.3 2,-0.8 29,-0.2 13,-0.2 -0.962 15.4-141.0-119.8 131.7 27.8 115.1 75.7 402 136 B V E -t 432 0K 0 29,-2.7 31,-1.5 -2,-0.4 2,-0.4 -0.830 27.5-163.4 -91.8 110.6 29.9 118.0 76.9 403 137 B A - 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