==== 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 NUCLEOSIDE PHOSPHORYLASE 08-OCT-96 1VFN . COMPND 2 MOLECULE: PURINE-NUCLEOSIDE PHOSPHORYLASE; . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR G.KOELLNER,A.BZOWSKA . 270 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12454.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 179 66.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 35 13.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 21 7.8 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 . 1 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 . 20 7.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 31 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 59 21.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 8 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 2 0 0 0 0 3 0 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 1 1 1 0 1 1 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 . 0 1 1 0 1 1 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 . 0 0 0 0 0 0 0 0 0 1 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 4 A G 0 0 90 0, 0.0 2,-0.3 0, 0.0 85,-0.0 0.000 360.0 360.0 360.0-146.5 96.0 30.4 48.0 2 5 A Y - 0 0 43 83,-0.1 2,-0.2 3,-0.0 3,-0.0 -0.803 360.0-121.7-109.6 158.4 94.7 26.8 48.1 3 6 A T >> - 0 0 90 -2,-0.3 4,-1.6 1,-0.1 3,-0.6 -0.616 27.7-105.0 -99.3 166.3 96.2 24.0 45.8 4 7 A Y H >> S+ 0 0 33 1,-0.3 4,-2.4 -2,-0.2 3,-0.6 0.927 122.7 56.7 -51.1 -41.9 94.4 22.0 43.3 5 8 A E H 3> S+ 0 0 133 1,-0.3 4,-3.0 2,-0.2 -1,-0.3 0.837 97.9 58.9 -58.3 -41.6 94.6 19.2 45.8 6 9 A D H <> S+ 0 0 40 -3,-0.6 4,-2.0 2,-0.2 -1,-0.3 0.919 108.1 46.9 -59.2 -39.6 92.9 21.1 48.5 7 10 A Y H X S+ 0 0 0 -4,-1.8 3,-2.2 1,-0.2 4,-1.0 0.973 108.9 53.9 -59.0 -53.5 81.6 15.9 50.4 15 18 A L H 3< S+ 0 0 49 -4,-2.6 3,-0.3 1,-0.3 -1,-0.2 0.840 110.6 46.8 -55.9 -30.2 81.0 13.1 47.9 16 19 A S T 3< S+ 0 0 87 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.478 109.3 52.2 -96.3 8.9 81.6 10.5 50.5 17 20 A H T <4 S+ 0 0 88 -3,-2.2 2,-0.3 -4,-0.3 -1,-0.2 0.468 113.3 38.4-115.1 -7.6 79.4 11.9 53.2 18 21 A T < - 0 0 11 -4,-1.0 -1,-0.2 -3,-0.3 25,-0.0 -0.991 60.1-145.6-140.2 152.4 76.2 12.4 51.1 19 22 A E S S+ 0 0 121 -2,-0.3 -1,-0.1 -3,-0.1 -4,-0.0 0.684 70.7 110.7 -87.7 -15.7 74.4 10.5 48.4 20 23 A Q - 0 0 10 21,-0.1 -2,-0.1 1,-0.1 43,-0.0 -0.234 47.3-170.6 -61.3 139.1 73.3 13.8 46.8 21 24 A R - 0 0 119 77,-0.0 47,-0.2 41,-0.0 -1,-0.1 -0.727 15.8-157.6-132.9 80.6 74.8 14.7 43.5 22 25 A P - 0 0 7 0, 0.0 47,-0.2 0, 0.0 3,-0.1 -0.139 21.5-173.9 -61.5 154.5 73.8 18.3 42.7 23 26 A Q S S+ 0 0 87 45,-2.2 77,-3.0 1,-0.2 78,-1.7 0.499 77.0 49.7-116.5 -24.3 73.8 19.8 39.2 24 27 A V E -ab 69 101A 1 44,-1.5 46,-1.7 75,-0.2 2,-0.4 -0.960 63.6-162.8-124.4 136.9 73.0 23.3 40.5 25 28 A A E -ab 70 102A 0 76,-2.5 78,-3.0 -2,-0.4 2,-0.5 -0.936 9.3-166.5-114.5 133.6 74.7 25.3 43.1 26 29 A V E -ab 71 103A 4 44,-2.4 46,-2.6 -2,-0.4 2,-0.6 -0.994 8.4-154.3-125.1 133.8 72.8 28.3 44.5 27 30 A I E -ab 72 104A 0 76,-3.0 78,-1.5 -2,-0.5 2,-0.5 -0.933 12.8-161.1-107.6 112.9 74.5 31.0 46.7 28 31 A C E -a 73 0A 5 44,-2.2 46,-1.0 -2,-0.6 2,-0.3 -0.768 14.5-167.6 -94.1 128.2 72.0 32.7 49.0 29 32 A G > - 0 0 2 -2,-0.5 3,-0.6 1,-0.2 77,-0.0 -0.881 40.4 -8.9-127.9 165.5 73.0 36.0 50.4 30 33 A S T 3 S- 0 0 56 -2,-0.3 -1,-0.2 1,-0.2 76,-0.0 0.793 131.4 -20.6 23.4 85.1 72.2 38.7 53.1 31 34 A G T 3 S+ 0 0 46 -3,-0.1 -1,-0.2 1,-0.1 227,-0.2 0.559 111.9 107.1 74.1 9.7 68.7 37.7 54.5 32 35 A L X + 0 0 15 -3,-0.6 2,-2.6 1,-0.1 3,-0.6 0.661 41.6 107.4 -88.3 -20.0 67.9 35.5 51.4 33 36 A G T 3 + 0 0 27 1,-0.2 -1,-0.1 -5,-0.1 -3,-0.1 0.022 37.1 113.5 -53.2 30.0 68.4 32.2 53.3 34 37 A G T > + 0 0 35 -2,-2.6 2,-1.0 1,-0.1 3,-0.9 0.869 51.6 84.6 -76.6 -35.1 64.8 31.2 53.5 35 38 A L T < + 0 0 13 -3,-0.6 3,-0.1 1,-0.2 -1,-0.1 -0.566 50.1 100.3 -76.4 100.7 65.0 28.1 51.2 36 39 A V T 3 S+ 0 0 68 -2,-1.0 3,-0.4 1,-0.2 -1,-0.2 0.246 81.2 61.6-142.5 -41.1 66.0 25.3 53.4 37 40 A N S < S+ 0 0 58 -3,-0.9 -1,-0.2 1,-0.2 3,-0.1 -0.356 92.0 47.8 -82.0 167.1 62.5 24.3 53.5 38 41 A K S S+ 0 0 97 1,-0.4 -1,-0.2 -3,-0.1 2,-0.1 0.034 90.3 115.5 83.0 -27.4 61.0 23.3 50.2 39 42 A L - 0 0 20 -3,-0.4 -1,-0.4 26,-0.1 2,-0.3 -0.432 56.8-150.8 -73.7 144.6 64.1 21.3 49.9 40 43 A T E S+C 63 0A 73 23,-2.0 23,-2.7 1,-0.2 3,-0.1 -0.875 72.8 12.8-116.7 152.8 63.6 17.6 49.8 41 44 A Q E S- 0 0 123 -2,-0.3 -1,-0.2 21,-0.2 -21,-0.1 0.823 91.0-170.4 50.8 35.6 66.0 14.9 51.0 42 45 A A E - 0 0 54 -3,-0.3 2,-0.4 21,-0.1 20,-0.3 -0.237 19.5-177.3 -63.7 142.5 68.0 17.6 52.7 43 46 A Q E -C 61 0A 57 18,-2.4 18,-3.4 -3,-0.1 2,-0.4 -0.992 9.8-159.6-141.0 127.9 71.3 17.2 54.2 44 47 A T E -C 60 0A 65 -2,-0.4 2,-0.3 16,-0.3 16,-0.2 -0.842 10.0-173.6-116.4 148.8 73.1 19.9 55.9 45 48 A F E -C 59 0A 9 14,-2.0 14,-3.1 -2,-0.4 2,-0.3 -0.990 24.5-128.9-135.8 136.9 76.7 20.4 56.8 46 49 A D E >> -C 58 0A 67 -2,-0.3 3,-1.8 12,-0.2 4,-0.6 -0.663 25.1-124.2 -82.9 141.3 78.2 23.3 58.9 47 50 A Y G >4 S+ 0 0 16 10,-2.2 3,-1.0 -2,-0.3 6,-0.3 0.840 109.6 65.4 -56.1 -27.2 81.0 25.0 57.1 48 51 A S G 34 S+ 0 0 114 9,-0.3 -1,-0.3 1,-0.3 4,-0.1 0.730 97.5 52.0 -69.9 -20.4 83.1 24.2 60.2 49 52 A E G <4 S+ 0 0 92 -3,-1.8 -1,-0.3 2,-0.1 -2,-0.2 0.535 90.2 87.2 -93.6 -7.9 82.9 20.5 59.6 50 53 A I S X< S- 0 0 4 -3,-1.0 3,-2.1 -4,-0.6 -40,-0.1 -0.839 87.6-112.4 -97.7 118.1 84.0 20.5 56.0 51 54 A P T 3 S+ 0 0 57 0, 0.0 -2,-0.1 0, 0.0 -38,-0.1 -0.122 93.8 5.0 -49.4 139.2 87.7 20.4 55.6 52 55 A N T 3 S+ 0 0 64 1,-0.2 -4,-0.1 -4,-0.1 3,-0.1 0.344 90.6 141.2 70.0 -4.2 89.3 23.5 54.2 53 56 A F < - 0 0 21 -3,-2.1 -1,-0.2 -6,-0.3 2,-0.1 -0.423 58.8-102.0 -71.8 149.5 86.2 25.5 54.2 54 57 A P 0 0 1 0, 0.0 -1,-0.1 0, 0.0 28,-0.0 -0.414 360.0 360.0 -71.7 145.4 86.4 29.2 55.1 55 58 A E 0 0 93 -2,-0.1 -7,-0.0 -7,-0.1 -8,-0.0 -0.091 360.0 360.0 -43.7 360.0 85.2 30.2 58.6 56 ! 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 57 66 A G 0 0 57 0, 0.0 -10,-2.2 0, 0.0 2,-0.4 0.000 360.0 360.0 360.0 79.0 76.9 29.3 57.5 58 67 A R E -CD 46 73A 100 15,-1.9 15,-3.0 -12,-0.2 2,-0.6 -0.984 360.0-138.9-140.3 152.0 75.8 26.0 56.2 59 68 A L E -CD 45 72A 0 -14,-3.1 -14,-2.0 -2,-0.4 2,-0.5 -0.923 27.3-170.6-103.1 121.7 76.0 23.9 53.0 60 69 A V E -CD 44 71A 4 11,-2.6 11,-2.8 -2,-0.6 2,-0.3 -0.943 7.8-165.1-120.0 130.5 72.7 22.1 52.3 61 70 A F E +CD 43 70A 2 -18,-3.4 -18,-2.4 -2,-0.5 2,-0.3 -0.799 34.0 109.7-105.2 150.5 72.1 19.5 49.7 62 71 A G E - D 0 69A 0 7,-2.0 7,-3.1 -2,-0.3 2,-0.5 -0.973 63.0 -70.2 169.4-174.5 68.6 18.4 48.6 63 72 A I E -CD 40 68A 40 -23,-2.7 -23,-2.0 -2,-0.3 5,-0.2 -0.921 34.8-177.8-112.0 130.7 66.1 18.5 45.9 64 73 A L S S- 0 0 17 3,-3.3 2,-0.3 -2,-0.5 -1,-0.2 0.893 76.1 -13.1 -97.0 -77.3 64.3 21.6 44.9 65 74 A N S S- 0 0 78 2,-0.2 3,-0.1 -25,-0.0 -1,-0.1 -0.396 126.9 -53.7-128.0 66.9 61.8 21.2 42.3 66 75 A G S S+ 0 0 71 -2,-0.3 2,-0.5 1,-0.2 -3,-0.0 0.568 118.8 113.4 79.2 11.5 62.8 17.9 41.2 67 76 A R - 0 0 54 -44,-0.0 -3,-3.3 -45,-0.0 2,-0.5 -0.968 69.6-124.8-121.5 135.1 66.3 19.3 40.8 68 77 A A E + D 0 63A 12 -2,-0.5 -45,-2.2 -5,-0.2 -44,-1.5 -0.598 41.0 175.0 -77.5 120.9 69.3 18.3 42.9 69 78 A C E -aD 24 62A 0 -7,-3.1 -7,-2.0 -2,-0.5 2,-0.4 -0.858 31.7-153.8-126.6 163.5 70.9 21.3 44.4 70 79 A V E -aD 25 61A 0 -46,-1.7 -44,-2.4 -2,-0.3 2,-0.5 -0.999 24.7-160.1-132.3 126.5 73.5 22.4 46.8 71 80 A M E -aD 26 60A 2 -11,-2.8 -11,-2.6 -2,-0.4 2,-0.9 -0.952 17.0-142.5-120.4 135.3 72.9 25.6 48.6 72 81 A M E -aD 27 59A 2 -46,-2.6 -44,-2.2 -2,-0.5 2,-1.3 -0.782 14.6-163.8 -90.5 107.7 75.2 28.0 50.3 73 82 A Q E S+aD 28 58A 42 -15,-3.0 -15,-1.9 -2,-0.9 -44,-0.1 -0.720 73.5 4.7 -93.6 83.8 73.3 29.3 53.3 74 83 A G S S- 0 0 32 -2,-1.3 2,-0.2 -46,-1.0 -46,-0.1 0.075 77.1-147.7 111.3 136.6 75.5 32.3 54.0 75 84 A R - 0 0 17 -48,-0.1 2,-0.3 -2,-0.1 -45,-0.1 -0.673 17.9 -99.7-127.3-177.2 78.5 33.5 52.0 76 85 A F - 0 0 9 11,-0.3 2,-0.4 -2,-0.2 3,-0.1 -0.834 29.1-157.6-109.5 144.6 81.9 35.2 52.6 77 86 A H > > - 0 0 20 -2,-0.3 3,-1.7 1,-0.1 5,-1.0 -0.920 24.1-134.9-123.1 146.4 82.7 38.9 52.1 78 87 A M G > 5S+ 0 0 50 132,-0.4 3,-2.6 -2,-0.4 -1,-0.1 0.885 104.7 68.0 -62.9 -32.6 85.8 40.7 51.5 79 88 A Y G 3 5S+ 0 0 75 131,-0.3 -1,-0.3 1,-0.3 109,-0.0 0.607 89.1 66.8 -67.2 -4.0 84.8 43.2 54.1 80 89 A E G < 5S- 0 0 94 -3,-1.7 -1,-0.3 2,-0.1 -2,-0.2 0.508 126.0 -98.3 -88.4 -6.8 85.2 40.5 56.7 81 90 A G T < 5S+ 0 0 68 -3,-2.6 -2,-0.2 1,-0.3 -3,-0.2 0.351 80.3 136.9 103.4 0.5 88.9 40.4 56.1 82 91 A Y < - 0 0 47 -5,-1.0 -1,-0.3 -4,-0.1 -2,-0.1 -0.627 52.7-127.5 -83.9 135.6 88.9 37.4 53.7 83 92 A P >> - 0 0 47 0, 0.0 4,-2.0 0, 0.0 3,-2.0 -0.376 31.7-107.9 -70.7 154.7 91.0 37.5 50.5 84 93 A F H 3> S+ 0 0 7 1,-0.3 4,-2.1 2,-0.2 5,-0.1 0.777 116.3 66.2 -58.4 -24.9 89.1 36.7 47.4 85 94 A W H 34 S+ 0 0 100 1,-0.2 -1,-0.3 2,-0.2 -83,-0.1 0.741 107.4 42.0 -69.2 -18.9 90.7 33.3 47.1 86 95 A K H X4 S+ 0 0 57 -3,-2.0 3,-1.1 2,-0.2 -2,-0.2 0.826 109.9 55.5 -90.8 -40.7 88.9 32.3 50.2 87 96 A V H 3< S+ 0 0 4 -4,-2.0 -11,-0.3 1,-0.3 -2,-0.2 0.905 115.2 40.6 -59.5 -35.4 85.6 33.9 49.4 88 97 A T T >X S+ 0 0 2 -4,-2.1 4,-1.0 -5,-0.2 3,-1.0 0.367 81.1 104.8 -95.9 4.6 85.5 31.9 46.2 89 98 A F H <> S+ 0 0 0 -3,-1.1 4,-1.4 1,-0.2 3,-0.5 0.857 76.0 57.3 -51.6 -42.0 86.8 28.6 47.4 90 99 A P H 3> S+ 0 0 1 0, 0.0 4,-2.1 0, 0.0 -1,-0.2 0.817 97.4 62.1 -64.5 -28.4 83.4 27.0 47.3 91 100 A V H <> S+ 0 0 1 -3,-1.0 4,-1.6 1,-0.2 -2,-0.2 0.860 104.5 48.1 -62.8 -36.3 82.8 27.8 43.7 92 101 A R H X S+ 0 0 29 -4,-1.0 4,-1.5 -3,-0.5 -1,-0.2 0.859 108.4 53.4 -73.3 -33.6 85.7 25.7 42.7 93 102 A V H X S+ 0 0 0 -4,-1.4 4,-0.9 1,-0.2 5,-0.2 0.936 104.8 55.6 -65.8 -41.8 84.6 22.8 44.9 94 103 A F H >X>S+ 0 0 0 -4,-2.1 5,-2.6 1,-0.2 3,-1.0 0.897 104.6 52.6 -55.0 -45.7 81.2 22.8 43.3 95 104 A R H ><5S+ 0 0 75 -4,-1.6 3,-0.7 1,-0.3 -1,-0.2 0.908 108.5 51.6 -59.0 -38.6 82.7 22.4 39.8 96 105 A L H 3<5S+ 0 0 44 -4,-1.5 -1,-0.3 1,-0.2 -2,-0.2 0.629 104.6 56.6 -73.1 -13.0 84.7 19.5 41.2 97 106 A L H <<5S- 0 0 19 -3,-1.0 -1,-0.2 -4,-0.9 -2,-0.2 0.618 126.4-101.9 -90.0 -15.5 81.4 18.0 42.5 98 107 A G T <<5 + 0 0 41 -4,-0.8 -3,-0.2 -3,-0.7 -2,-0.1 0.580 65.7 158.7 106.0 12.3 80.1 18.1 39.0 99 108 A V < - 0 0 0 -5,-2.6 -1,-0.2 -6,-0.2 -75,-0.2 -0.371 17.9-177.4 -67.6 149.3 77.9 21.1 39.3 100 109 A E + 0 0 113 -77,-3.0 125,-2.2 1,-0.3 2,-0.4 0.684 60.2 42.1-119.1 -25.6 77.1 22.8 36.0 101 110 A T E -be 24 225A 3 -78,-1.7 -76,-2.5 123,-0.2 2,-0.5 -0.966 59.8-159.5-128.5 145.1 75.1 25.9 36.8 102 111 A L E -be 25 226A 0 123,-2.9 125,-2.3 -2,-0.4 2,-0.5 -0.974 1.4-163.7-126.1 128.8 75.4 28.5 39.5 103 112 A V E -be 26 227A 4 -78,-3.0 -76,-3.0 -2,-0.5 2,-0.4 -0.917 12.1-169.2-109.8 126.9 72.7 30.7 40.7 104 113 A V E +be 27 228A 0 123,-2.4 125,-1.8 -2,-0.5 2,-0.3 -0.924 7.6 177.4-115.9 144.0 73.9 33.7 42.7 105 114 A T E + e 0 229A 9 -78,-1.5 2,-0.3 -2,-0.4 125,-0.2 -0.951 5.0 155.2-143.1 162.1 71.7 36.0 44.7 106 115 A N E - e 0 230A 1 123,-1.4 125,-3.3 -2,-0.3 2,-0.3 -0.986 38.4-101.8-170.5 177.2 72.0 39.0 46.9 107 116 A A E + e 0 231A 21 -2,-0.3 2,-0.3 123,-0.2 125,-0.2 -0.877 43.8 171.0-111.2 144.0 70.5 42.1 48.4 108 117 A A E - e 0 232A 4 123,-2.2 125,-2.9 -2,-0.3 2,-0.4 -0.986 36.1-104.3-153.7 161.5 71.5 45.5 47.0 109 118 A G E -F 208 0A 6 99,-2.7 99,-2.4 -2,-0.3 2,-0.4 -0.724 40.4-119.5 -88.7 138.4 70.7 49.1 47.1 110 119 A G E +F 207 0A 9 -2,-0.4 97,-0.3 97,-0.2 96,-0.1 -0.648 32.7 171.8 -83.0 130.6 68.9 50.5 44.1 111 120 A L + 0 0 12 95,-3.2 96,-0.2 -2,-0.4 -1,-0.2 0.725 59.8 86.6-100.7 -37.6 70.6 53.2 42.1 112 121 A N S > S- 0 0 22 94,-1.6 3,-2.9 1,-0.2 94,-0.1 -0.575 74.4-143.9 -72.7 115.4 68.1 53.3 39.3 113 122 A P T 3 S+ 0 0 101 0, 0.0 -1,-0.2 0, 0.0 -3,-0.0 0.677 97.2 65.7 -50.2 -27.1 65.3 55.7 40.2 114 123 A N T 3 S+ 0 0 115 2,-0.1 2,-0.1 0, 0.0 -2,-0.1 0.602 85.6 102.1 -72.8 -12.8 62.7 53.4 38.5 115 124 A F < - 0 0 17 -3,-2.9 2,-0.4 91,-0.1 -5,-0.0 -0.356 55.7-163.4 -73.7 150.2 63.5 50.8 41.1 116 125 A E > - 0 0 108 -2,-0.1 3,-2.5 116,-0.0 116,-0.2 -0.985 33.3 -93.4-134.4 144.5 61.3 50.2 44.2 117 126 A V T 3 S+ 0 0 60 -2,-0.4 116,-0.2 1,-0.3 3,-0.1 -0.273 116.3 34.6 -55.0 135.5 62.0 48.4 47.4 118 127 A G T 3 S+ 0 0 20 114,-2.1 -1,-0.3 1,-0.3 115,-0.1 0.245 90.0 134.6 100.0 -14.7 60.9 44.8 47.0 119 128 A D < - 0 0 9 -3,-2.5 113,-3.0 113,-0.1 2,-0.4 -0.281 48.1-140.5 -67.9 153.6 62.0 44.7 43.3 120 129 A I E -G 231 0A 8 57,-0.4 59,-2.3 111,-0.2 2,-0.5 -0.972 14.6-163.1-116.2 129.0 64.0 41.9 41.8 121 130 A M E -Gh 230 179A 0 109,-2.9 109,-2.4 -2,-0.4 2,-0.3 -0.953 13.0-142.4-122.9 117.7 66.7 42.6 39.3 122 131 A L E -Gh 229 180A 0 57,-2.4 59,-2.5 -2,-0.5 2,-0.8 -0.592 27.6-122.5 -70.8 136.5 68.1 40.1 37.0 123 132 A I E + h 0 181A 1 105,-2.2 105,-0.4 -2,-0.3 59,-0.2 -0.762 38.4 168.3 -86.8 111.0 71.8 40.8 36.8 124 133 A R E - 0 0 110 57,-2.2 33,-0.4 -2,-0.8 2,-0.3 0.714 69.5 -14.2 -90.3 -28.2 72.6 41.3 33.1 125 134 A D E - 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0 0 46 -126,-0.4 -117,-0.1 1,-0.1 -125,-0.0 -0.299 36.3-146.7-150.3-135.2 67.0 51.2 49.3 235 244 A K - 0 0 34 -2,-0.1 2,-0.3 1,-0.0 -1,-0.1 0.708 11.4-147.2-168.9 144.2 68.9 54.3 48.6 236 245 A V + 0 0 47 -44,-0.1 -39,-0.2 1,-0.1 6,-0.1 -0.269 28.2 148.3 -62.6 106.4 70.2 58.0 49.4 237 246 A I + 0 0 56 -2,-0.3 2,-0.4 -40,-0.1 -1,-0.1 0.282 53.1 74.0-124.4 20.4 71.0 60.6 46.7 238 247 A M 0 0 106 3,-0.2 -44,-0.0 1,-0.1 -43,-0.0 -0.982 360.0 360.0-134.0 145.5 70.1 64.0 48.2 239 248 A D 0 0 153 -2,-0.4 -1,-0.1 3,-0.0 3,-0.0 0.907 360.0 360.0 -89.4 360.0 71.8 66.1 50.7 240 ! 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 0.0 241 251 A S 0 0 131 0, 0.0 2,-0.3 0, 0.0 -3,-0.2 0.000 360.0 360.0 360.0 143.7 66.7 66.0 53.1 242 252 A Q - 0 0 72 -5,-0.1 2,-0.2 -6,-0.1 -3,-0.0 -0.988 360.0-120.0 175.9 180.0 67.0 62.3 53.9 243 253 A G - 0 0 54 -2,-0.3 2,-0.2 0, 0.0 -7,-0.1 -0.723 42.5-109.1-129.6 171.1 67.2 59.3 56.2 244 254 A K - 0 0 169 -2,-0.2 2,-0.1 -9,-0.1 -2,-0.0 -0.776 29.9 -93.6-113.3 163.5 70.2 56.8 56.3 245 255 A A - 0 0 31 -2,-0.2 2,-0.4 -53,-0.2 -54,-0.1 -0.444 42.7-162.3 -72.1 140.8 70.8 53.2 55.1 246 256 A N - 0 0 75 -2,-0.1 -1,-0.0 2,-0.1 0, 0.0 -0.965 32.0-138.8-126.1 140.0 70.3 50.5 57.7 247 257 A H S S+ 0 0 107 -2,-0.4 2,-2.4 1,-0.2 4,-0.1 0.821 95.8 87.0 -64.7 -21.7 71.3 46.9 58.0 248 258 A E + 0 0 131 1,-0.2 -1,-0.2 2,-0.2 -2,-0.1 -0.503 61.4 88.4 -76.5 70.0 67.7 46.5 59.3 249 259 A E + 0 0 46 -2,-2.4 -1,-0.2 2,-0.1 -2,-0.1 -0.335 54.7 93.2-165.2 36.3 66.6 46.1 55.8 250 260 A V S S+ 0 0 63 2,-0.1 4,-0.5 3,-0.1 -2,-0.2 0.361 79.6 68.3-102.8 -24.9 67.3 42.5 56.3 251 261 A L S >> S+ 0 0 73 1,-0.3 4,-4.0 2,-0.2 3,-2.6 0.943 90.7 52.5 -60.7 -54.5 63.7 43.1 57.0 252 262 A E T 34>S+ 0 0 39 1,-0.3 5,-0.8 2,-0.3 4,-0.4 0.794 100.0 63.9 -56.2 -29.3 62.9 43.9 53.4 253 263 A A T 34>S+ 0 0 3 1,-0.2 5,-1.1 2,-0.1 -1,-0.3 0.748 118.5 26.1 -68.7 -18.7 64.6 40.6 52.7 254 264 A G T <45S+ 0 0 38 -3,-2.6 2,-0.6 -4,-0.5 5,-0.4 0.788 97.5 95.3-101.7 -46.6 61.6 39.1 54.7 255 265 A K T <5S- 0 0 132 -4,-4.0 -3,-0.2 1,-0.3 -2,-0.1 0.374 124.1 -43.6 -25.2 -18.5 59.1 41.9 54.1 256 266 A Q T >5S+ 0 0 88 -2,-0.6 4,-1.4 -4,-0.4 -1,-0.3 0.121 122.8 94.9 165.3 -15.0 57.6 40.0 51.2 257 267 A A H >> S+ 0 0 113 -5,-0.4 4,-2.3 1,-0.2 -1,-0.3 0.903 120.6 38.3 -48.3 -52.1 57.7 34.1 49.7 260 270 A K H < S+ 0 0 70 -4,-3.7 3,-1.0 1,-0.2 -1,-0.2 0.887 109.8 58.2 -59.8 -38.7 59.8 27.6 39.6 268 278 A L H >< S+ 0 0 9 -4,-2.2 3,-2.8 -5,-0.3 4,-0.4 0.806 87.5 74.0 -61.8 -32.2 63.1 28.4 37.9 269 279 A M H >< S+ 0 0 3 -4,-1.6 3,-1.3 -3,-0.5 -1,-0.3 0.878 89.9 60.3 -52.3 -38.8 64.6 25.1 38.8 270 280 A A T << S+ 0 0 65 -3,-1.0 -1,-0.3 -4,-0.6 -2,-0.2 0.537 100.1 60.9 -69.4 -0.2 62.4 23.5 36.1 271 281 A S T < 0 0 36 -3,-2.8 -1,-0.3 -4,-0.1 -2,-0.2 0.615 360.0 360.0-109.1 -0.5 64.1 25.7 33.6 272 282 A I < 0 0 64 -3,-1.3 -1,-0.1 -4,-0.4 -3,-0.1 -0.124 360.0 360.0 -54.2 360.0 67.8 24.8 33.7