==== 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 OXIDOREDUCTASE (CHOH(D)-NADP+(A)) 18-JUL-94 2PGD . COMPND 2 MOLECULE: 6-PHOSPHOGLUCONATE DEHYDROGENASE; . SOURCE 2 ORGANISM_SCIENTIFIC: OVIS ARIES; . AUTHOR M.J.ADAMS,C.PHILLIPS,S.GOVER . 473 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 22731.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 352 74.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 27 5.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 15 3.2 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 . 2 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 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 . 27 5.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 44 9.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 219 46.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 1.9 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 3 1 0 1 4 3 2 2 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 1 RESIDUES PER ALPHA HELIX . 1 2 1 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 PARALLEL BRIDGES PER LADDER . 4 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 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 A 0 0 90 0, 0.0 63,-0.2 0, 0.0 64,-0.1 0.000 360.0 360.0 360.0 113.0 1.2 3.1 42.2 2 2 A Q + 0 0 124 1,-0.8 2,-0.3 61,-0.6 25,-0.2 -0.106 360.0 79.7 174.5 -45.0 0.0 6.1 44.4 3 3 A A B -a 64 0A 0 60,-2.0 62,-2.2 1,-0.1 -1,-0.8 -0.659 64.3-154.3 -79.7 135.5 2.8 8.6 44.0 4 4 A D S S- 0 0 34 23,-2.6 2,-0.3 -2,-0.3 65,-0.3 0.717 77.2 -0.2 -77.1 -26.9 2.5 10.6 40.7 5 5 A I E -b 28 0B 0 22,-1.3 24,-2.0 63,-0.1 2,-0.3 -0.965 64.1-139.6-158.3 154.9 6.3 11.3 40.6 6 6 A A E -bc 29 70B 0 63,-1.9 65,-2.0 -2,-0.3 2,-0.4 -0.888 10.5-160.2-115.6 156.1 9.4 10.7 42.7 7 7 A L E -bc 30 71B 0 22,-1.7 24,-1.7 -2,-0.3 2,-0.5 -0.993 2.8-159.7-137.9 132.9 12.3 13.1 43.4 8 8 A I E +bc 31 72B 0 63,-2.5 65,-2.5 -2,-0.4 24,-0.2 -0.979 62.0 59.9-115.4 122.8 15.8 12.0 44.6 9 9 A G - 0 0 5 22,-1.8 2,-0.6 -2,-0.5 23,-0.2 0.551 55.1-160.6 122.6 91.5 17.9 14.6 46.3 10 10 A L + 0 0 2 4,-0.2 2,-0.2 3,-0.1 22,-0.1 -0.252 44.1 128.0 -99.3 46.6 16.7 16.2 49.5 11 11 A A S > S- 0 0 63 -2,-0.6 4,-2.5 62,-0.3 3,-0.3 -0.473 83.8 -85.4 -79.3 172.8 18.8 19.3 49.6 12 12 A V H > S+ 0 0 62 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.856 131.9 53.6 -54.3 -39.1 16.8 22.6 50.1 13 13 A M H > S+ 0 0 54 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.949 112.5 44.4 -59.7 -46.7 16.1 22.9 46.3 14 14 A G H > S+ 0 0 1 -3,-0.3 4,-2.3 2,-0.2 -2,-0.2 0.886 113.1 50.4 -65.3 -42.8 14.8 19.3 46.2 15 15 A Q H X S+ 0 0 13 -4,-2.5 4,-2.4 2,-0.2 -1,-0.2 0.933 111.5 47.9 -60.7 -48.9 12.7 19.8 49.4 16 16 A N H X S+ 0 0 26 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.878 110.4 51.6 -63.6 -39.6 11.1 23.0 48.1 17 17 A L H X S+ 0 0 7 -4,-2.2 4,-2.5 -5,-0.2 -1,-0.2 0.929 109.9 48.7 -63.9 -44.8 10.3 21.5 44.7 18 18 A I H X S+ 0 0 0 -4,-2.3 4,-2.7 2,-0.2 -2,-0.2 0.939 112.8 49.0 -59.6 -48.1 8.5 18.4 46.4 19 19 A L H X S+ 0 0 16 -4,-2.4 4,-2.8 2,-0.2 -2,-0.2 0.887 110.4 50.8 -57.5 -42.8 6.6 20.9 48.6 20 20 A N H X S+ 0 0 1 -4,-2.5 4,-0.8 2,-0.2 -2,-0.2 0.941 112.6 46.1 -61.1 -46.8 5.6 23.0 45.6 21 21 A M H ><>S+ 0 0 1 -4,-2.5 5,-1.6 2,-0.2 3,-0.6 0.903 112.0 51.0 -64.3 -40.2 4.4 19.9 43.7 22 22 A N H ><5S+ 0 0 18 -4,-2.7 3,-2.6 1,-0.2 4,-0.3 0.952 106.8 54.1 -61.4 -48.6 2.5 18.7 46.8 23 23 A D H 3<5S+ 0 0 93 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.671 105.9 55.3 -58.7 -21.5 0.8 22.1 47.1 24 24 A H T <<5S- 0 0 86 -4,-0.8 -1,-0.3 -3,-0.6 -2,-0.2 0.224 128.2 -97.3 -97.6 12.3 -0.3 21.6 43.5 25 25 A G T < 5S+ 0 0 49 -3,-2.6 2,-0.5 1,-0.3 -3,-0.2 0.801 78.9 133.3 81.3 33.4 -2.0 18.3 44.3 26 26 A F < - 0 0 37 -5,-1.6 2,-0.7 -4,-0.3 -1,-0.3 -0.972 53.8-133.5-117.9 131.4 0.6 15.8 43.3 27 27 A V - 0 0 27 -2,-0.5 -23,-2.6 -25,-0.2 -22,-1.3 -0.778 29.7-167.1 -81.7 110.5 1.6 12.9 45.5 28 28 A V E -b 5 0B 0 -2,-0.7 24,-2.8 -25,-0.2 2,-0.5 -0.828 14.0-149.6-101.6 140.4 5.4 12.9 45.5 29 29 A C E -bd 6 52B 0 -24,-2.0 -22,-1.7 -2,-0.4 2,-0.3 -0.975 20.5-150.4-110.0 119.8 7.5 10.0 46.8 30 30 A A E +bd 7 53B 1 22,-2.7 24,-2.2 -2,-0.5 2,-0.3 -0.717 20.9 168.3 -96.1 146.2 10.8 11.3 48.2 31 31 A F E -b 8 0B 16 -24,-1.7 -22,-1.8 -2,-0.3 2,-0.3 -0.953 7.3-179.0-149.0 157.3 14.2 9.5 48.3 32 32 A N - 0 0 8 -2,-0.3 6,-0.1 -24,-0.2 -24,-0.0 -0.959 38.2-117.1-154.8 150.1 17.8 10.5 49.1 33 33 A R S S+ 0 0 166 -2,-0.3 2,-1.5 1,-0.2 -1,-0.1 0.964 114.3 57.1 -59.4 -51.8 21.1 8.5 49.1 34 34 A T S > S- 0 0 73 1,-0.2 3,-1.3 -3,-0.1 4,-0.3 -0.671 84.2-162.5 -80.1 94.7 21.5 9.1 52.9 35 35 A V T >> S+ 0 0 51 -2,-1.5 3,-1.3 1,-0.2 4,-0.9 0.722 76.9 75.3 -55.0 -26.7 18.1 7.6 53.7 36 36 A S H >> S+ 0 0 77 1,-0.3 4,-1.8 2,-0.2 3,-1.2 0.920 86.9 63.7 -49.7 -43.5 18.0 9.2 57.2 37 37 A K H <> S+ 0 0 68 -3,-1.3 4,-2.5 1,-0.3 -1,-0.3 0.739 92.4 61.8 -58.5 -27.4 17.1 12.5 55.5 38 38 A V H <> S+ 0 0 0 -3,-1.3 4,-2.4 -4,-0.3 -1,-0.3 0.918 107.6 44.2 -66.0 -40.6 13.8 11.1 54.1 39 39 A D H S+ 0 0 0 -4,-2.5 5,-2.7 1,-0.2 6,-0.4 0.924 111.5 49.4 -60.0 -49.3 12.0 15.6 56.0 42 42 A L H <5S+ 0 0 56 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.829 114.0 45.8 -60.4 -34.1 8.7 13.7 56.7 43 43 A A H <5S+ 0 0 60 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.767 129.0 19.8 -79.3 -26.7 8.8 14.5 60.4 44 44 A N T ><5S+ 0 0 96 -4,-1.8 3,-2.2 -3,-0.3 -3,-0.2 0.632 129.4 16.1-109.4 -97.5 9.6 18.2 59.8 45 45 A E T 3 5S+ 0 0 100 1,-0.3 -3,-0.2 -5,-0.1 -4,-0.1 0.745 132.9 39.5 -58.1 -33.7 9.1 20.2 56.6 46 46 A A T > S- 0 0 41 1,-0.1 4,-2.4 -21,-0.0 -1,-0.3 -0.947 79.9-114.5-162.2 151.8 15.3 2.0 49.0 57 57 A L H > S+ 0 0 19 -2,-0.3 4,-2.9 1,-0.2 5,-0.2 0.904 116.9 56.5 -57.0 -42.3 15.2 2.7 45.2 58 58 A E H > S+ 0 0 112 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.887 108.2 46.3 -59.1 -39.0 13.1 -0.5 44.8 59 59 A E H > S+ 0 0 63 2,-0.2 4,-1.8 -3,-0.2 -1,-0.2 0.922 111.2 52.9 -70.7 -42.4 10.5 0.8 47.2 60 60 A M H X S+ 0 0 1 -4,-2.4 4,-0.9 1,-0.2 3,-0.4 0.943 109.8 47.5 -58.4 -48.5 10.4 4.2 45.5 61 61 A V H >< S+ 0 0 9 -4,-2.9 3,-0.7 1,-0.2 -1,-0.2 0.885 108.6 55.0 -65.4 -33.6 9.9 2.6 42.1 62 62 A S H 3< S+ 0 0 78 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.838 104.9 56.0 -62.4 -36.0 7.0 0.4 43.5 63 63 A K H 3< S+ 0 0 54 -4,-1.8 -60,-2.0 -3,-0.4 -61,-0.6 0.798 89.2 97.3 -66.7 -26.9 5.3 3.5 44.8 64 64 A L B << S-a 3 0A 5 -4,-0.9 -60,-0.2 -3,-0.7 2,-0.2 -0.315 71.2-129.8 -78.0 138.6 5.2 5.3 41.4 65 65 A K - 0 0 74 -62,-2.2 4,-0.3 2,-0.2 -1,-0.1 -0.525 52.3 -68.1 -74.8 152.7 2.1 5.3 39.0 66 66 A K S S+ 0 0 140 -2,-0.2 2,-0.1 2,-0.1 29,-0.1 -0.768 124.1 46.2 -92.2 139.7 2.9 4.2 35.4 67 67 A P S S- 0 0 35 0, 0.0 2,-0.2 0, 0.0 -2,-0.2 0.385 100.3-138.0 -64.5 126.4 4.6 5.8 33.3 68 68 A R - 0 0 42 -4,-0.2 28,-2.9 -2,-0.1 2,-0.5 -0.462 19.1-162.4 -64.4 126.5 6.9 6.1 36.4 69 69 A R E + e 0 96B 28 -4,-0.3 -63,-1.9 -65,-0.3 2,-0.4 -0.958 12.3 174.6-115.5 125.7 8.4 9.6 36.5 70 70 A I E -ce 6 97B 0 26,-1.8 28,-2.8 -2,-0.5 2,-0.4 -1.000 16.0-152.2-136.6 133.4 11.5 10.3 38.7 71 71 A I E -ce 7 98B 10 -65,-2.0 -63,-2.5 -2,-0.4 2,-0.5 -0.883 6.1-150.8-104.0 136.6 13.5 13.5 39.0 72 72 A L E +ce 8 99B 0 26,-3.0 28,-2.8 -2,-0.4 29,-0.4 -0.938 19.6 170.6-108.0 124.1 17.2 13.5 39.9 73 73 A L + 0 0 25 -65,-2.5 -62,-0.3 -2,-0.5 2,-0.2 -0.592 37.0 122.3-132.3 65.8 18.4 16.6 41.7 74 74 A V S S- 0 0 28 -2,-0.1 2,-0.2 -64,-0.1 3,-0.1 -0.671 74.6 -62.0-117.4 175.3 21.9 15.5 42.7 75 75 A K > - 0 0 158 -2,-0.2 5,-0.6 1,-0.1 4,-0.4 -0.426 64.0-107.6 -69.7 125.0 25.3 17.0 41.9 76 76 A A T 5S+ 0 0 33 -2,-0.2 2,-0.4 3,-0.1 3,-0.1 -0.199 84.2 31.1 -54.2 137.6 25.9 17.1 38.2 77 77 A G T >>5S+ 0 0 21 1,-0.2 4,-1.2 -3,-0.1 3,-0.8 -0.943 117.4 12.4 121.7-134.2 28.4 14.6 36.7 78 78 A Q H 3>5S+ 0 0 132 -2,-0.4 4,-2.2 1,-0.2 3,-0.3 0.819 120.3 57.9 -46.0 -51.0 29.2 11.2 38.1 79 79 A A H 3>5S+ 0 0 30 -4,-0.4 4,-2.7 1,-0.2 -1,-0.2 0.850 101.1 56.4 -58.4 -38.7 26.2 10.8 40.5 80 80 A V H <>X S+ 0 0 2 -4,-2.8 3,-1.3 1,-0.2 4,-0.6 0.834 95.3 68.8 -63.4 -40.0 17.3 2.8 38.1 88 88 A V H >< S+ 0 0 32 -4,-2.7 3,-1.4 1,-0.3 -1,-0.2 0.862 96.0 53.5 -57.0 -45.8 17.4 1.3 34.6 89 89 A P H 34 S+ 0 0 105 0, 0.0 -1,-0.3 0, 0.0 -2,-0.2 0.779 112.3 48.7 -47.8 -32.2 17.2 -2.5 35.9 90 90 A L H << S+ 0 0 61 -3,-1.3 2,-0.2 -4,-0.5 -2,-0.2 0.538 97.6 88.1 -91.7 -9.6 14.1 -1.4 37.9 91 91 A L << - 0 0 22 -3,-1.4 2,-0.2 -4,-0.6 3,-0.0 -0.616 64.7-133.0-102.8 151.5 12.1 0.4 35.1 92 92 A D > - 0 0 76 -2,-0.2 3,-1.7 1,-0.1 2,-0.2 -0.592 43.9 -85.5 -86.8 158.4 9.7 -0.6 32.5 93 93 A I T 3 S+ 0 0 146 1,-0.3 27,-0.2 -2,-0.2 26,-0.1 -0.457 118.5 33.4 -62.7 127.3 9.9 0.5 28.9 94 94 A G T 3 S+ 0 0 24 25,-2.8 -1,-0.3 1,-0.4 26,-0.2 0.435 85.9 131.0 101.1 -1.5 8.2 3.9 28.6 95 95 A D < - 0 0 3 -3,-1.7 26,-2.3 24,-0.2 2,-0.4 -0.486 50.4-130.2 -80.3 161.4 9.2 5.2 32.1 96 96 A I E -ef 69 121B 0 -28,-2.9 -26,-1.8 24,-0.2 2,-0.4 -0.942 17.9-169.4-122.7 128.3 10.8 8.6 32.4 97 97 A I E -ef 70 122B 0 24,-2.0 26,-2.2 -2,-0.4 2,-0.5 -0.966 13.2-163.3-116.0 134.5 13.9 9.9 34.3 98 98 A I E -ef 71 123B 0 -28,-2.8 -26,-3.0 -2,-0.4 2,-0.7 -0.977 6.8-155.5-121.2 127.4 14.3 13.7 34.5 99 99 A D E +ef 72 124B 0 24,-2.8 26,-2.3 -2,-0.5 -26,-0.2 -0.935 16.7 172.3-108.0 115.1 17.7 15.3 35.4 100 100 A G + 0 0 6 -28,-2.8 27,-0.3 -2,-0.7 -27,-0.2 0.327 44.0 104.1 -99.5 -1.4 17.2 18.7 36.9 101 101 A G S S- 0 0 7 -29,-0.4 2,-1.8 1,-0.1 24,-0.1 -0.197 90.7 -92.1 -72.3 175.9 20.8 19.4 38.0 102 102 A N + 0 0 73 24,-0.1 2,-0.2 81,-0.0 -1,-0.1 -0.619 63.8 176.7 -94.9 79.8 23.0 21.9 36.0 103 103 A S - 0 0 4 -2,-1.8 2,-0.2 22,-0.2 81,-0.1 -0.547 39.4 -96.6 -85.6 155.9 24.4 19.2 33.7 104 104 A E >> - 0 0 73 -2,-0.2 4,-1.9 1,-0.1 3,-0.7 -0.514 35.0-130.1 -64.0 127.8 26.8 19.6 30.7 105 105 A Y H 3> S+ 0 0 2 1,-0.2 4,-2.0 -2,-0.2 -1,-0.1 0.791 105.8 56.2 -59.7 -28.2 24.6 19.6 27.6 106 106 A R H 3> S+ 0 0 97 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.875 104.6 51.4 -72.3 -32.8 26.7 17.0 25.9 107 107 A D H <> S+ 0 0 43 -3,-0.7 4,-2.9 2,-0.2 5,-0.3 0.939 109.5 50.9 -66.8 -44.3 26.3 14.6 28.8 108 108 A T H X S+ 0 0 0 -4,-1.9 4,-2.6 1,-0.2 -2,-0.2 0.910 109.3 50.8 -60.6 -39.1 22.5 15.1 28.5 109 109 A M H X S+ 0 0 36 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.938 112.6 47.5 -60.7 -46.2 22.7 14.4 24.8 110 110 A R H X S+ 0 0 100 -4,-2.3 4,-2.4 1,-0.2 -2,-0.2 0.961 114.2 44.1 -56.9 -59.4 24.6 11.2 25.5 111 111 A R H X S+ 0 0 3 -4,-2.9 4,-2.5 1,-0.2 5,-0.3 0.846 110.1 56.6 -58.7 -38.7 22.3 9.9 28.2 112 112 A C H X S+ 0 0 9 -4,-2.6 4,-2.2 -5,-0.3 -1,-0.2 0.948 111.2 42.6 -62.3 -46.1 19.2 10.8 26.2 113 113 A R H X S+ 0 0 130 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.930 114.4 51.1 -62.6 -48.2 20.3 8.6 23.3 114 114 A D H X S+ 0 0 77 -4,-2.4 4,-0.8 1,-0.2 -2,-0.2 0.905 113.5 42.4 -58.0 -49.5 21.5 5.8 25.5 115 115 A L H ><>S+ 0 0 7 -4,-2.5 5,-2.6 1,-0.2 3,-0.9 0.865 107.6 61.3 -70.7 -33.9 18.3 5.5 27.5 116 116 A K H ><5S+ 0 0 114 -4,-2.2 3,-2.1 -5,-0.3 -1,-0.2 0.907 100.8 56.7 -55.2 -41.5 16.2 5.9 24.2 117 117 A D H 3<5S+ 0 0 145 -4,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.778 107.5 46.5 -60.3 -30.8 17.9 2.7 23.1 118 118 A K T <<5S- 0 0 112 -3,-0.9 -1,-0.3 -4,-0.8 -2,-0.2 0.234 121.6-107.8 -96.3 14.5 16.6 0.9 26.2 119 119 A G T < 5S+ 0 0 23 -3,-2.1 -25,-2.8 1,-0.2 2,-0.5 0.654 77.6 132.8 70.4 16.0 13.1 2.4 25.7 120 120 A I < - 0 0 5 -5,-2.6 2,-0.5 -27,-0.2 -1,-0.2 -0.906 55.2-132.2-104.5 128.3 13.4 4.8 28.7 121 121 A L E -f 96 0B 8 -26,-2.3 -24,-2.0 -2,-0.5 2,-0.4 -0.650 25.9-165.1 -82.2 116.7 12.3 8.4 28.1 122 122 A F E -f 97 0B 0 -2,-0.5 23,-2.8 -10,-0.2 2,-0.4 -0.901 10.4-179.6-111.2 133.4 15.0 10.9 29.3 123 123 A V E -fG 98 144B 0 -26,-2.2 -24,-2.8 -2,-0.4 2,-0.5 -0.994 12.2-160.5-133.1 133.3 14.6 14.6 29.9 124 124 A G E -fG 99 143B 0 19,-3.0 19,-2.0 52,-0.4 2,-0.4 -0.982 18.6-174.9-107.1 122.9 17.1 17.1 31.1 125 125 A S E - G 0 142B 2 -26,-2.3 2,-0.3 -2,-0.5 -22,-0.2 -0.961 23.8-134.4-124.1 139.0 15.6 20.4 32.5 126 126 A G E - G 0 141B 0 15,-1.9 15,-2.8 -2,-0.4 2,-0.4 -0.659 22.2-160.7 -76.3 144.1 17.2 23.5 33.7 127 127 A V E - G 0 140B 13 -2,-0.3 2,-0.3 -27,-0.3 13,-0.2 -0.988 14.0-179.9-126.2 136.2 15.6 24.6 36.9 128 128 A S E + G 0 139B 3 11,-2.2 11,-1.9 -2,-0.4 -2,-0.0 -0.991 41.2 70.5-139.9 150.1 16.1 28.2 37.9 129 129 A G S > S- 0 0 7 -2,-0.3 4,-1.4 9,-0.2 -1,-0.1 0.452 82.3-108.6 127.4 5.5 15.1 30.5 40.8 130 130 A G H > - 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0 0 14 -23,-2.8 3,-1.9 -2,-0.4 4,-0.6 -0.766 62.4-153.6 -86.5 107.9 13.0 12.9 24.5 146 146 A K T 34 S+ 0 0 113 -2,-0.8 3,-0.2 1,-0.3 -1,-0.1 0.697 85.6 76.1 -61.6 -17.4 9.6 14.6 23.7 147 147 A E T 34 S+ 0 0 122 1,-0.2 4,-0.5 2,-0.2 -1,-0.3 0.811 94.2 54.3 -62.0 -26.6 7.6 11.4 24.3 148 148 A A T X> S+ 0 0 0 -3,-1.9 3,-1.8 1,-0.2 4,-0.6 0.945 91.0 78.6 -66.9 -42.7 8.1 12.1 28.0 149 149 A W H >X S+ 0 0 11 -4,-0.6 4,-2.4 1,-0.3 3,-1.6 0.690 87.1 50.9 -46.6 -52.6 6.7 15.6 27.7 150 150 A P H 34 S+ 0 0 83 0, 0.0 4,-0.4 0, 0.0 -1,-0.3 0.852 111.0 53.1 -55.7 -29.9 2.8 14.9 27.6 151 151 A H H <4 S+ 0 0 75 -3,-1.8 -2,-0.2 -4,-0.5 4,-0.2 0.634 119.4 31.8 -80.4 -16.1 3.3 12.8 30.8 152 152 A I H S+ 0 0 66 -4,-0.4 4,-1.9 2,-0.2 -1,-0.2 0.905 114.8 42.3 -58.1 -49.9 0.9 19.0 34.1 155 155 A I H > S+ 0 0 4 -3,-0.4 4,-2.2 2,-0.2 5,-0.2 0.967 119.0 43.2 -65.1 -53.9 3.4 18.8 36.9 156 156 A F H X S+ 0 0 9 -4,-2.4 4,-1.2 1,-0.2 -2,-0.2 0.925 119.5 40.2 -61.8 -50.3 6.0 21.0 35.4 157 157 A Q H < S+ 0 0 41 -4,-2.8 -1,-0.2 -5,-0.3 -2,-0.2 0.752 113.0 57.0 -73.7 -26.0 3.8 23.7 34.1 158 158 A G H < S+ 0 0 20 -4,-1.9 -1,-0.2 -5,-0.4 -2,-0.2 0.861 113.5 37.2 -71.4 -41.0 1.6 23.6 37.2 159 159 A I H < S+ 0 0 5 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.643 98.5 104.1 -85.2 -14.3 4.5 24.3 39.7 160 160 A A S < S- 0 0 3 -4,-1.2 -21,-0.2 -5,-0.2 10,-0.1 -0.196 83.8 -95.6 -63.2 156.5 6.3 26.7 37.3 161 161 A A - 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0 0 30 -2,-0.3 -29,-0.2 1,-0.2 3,-0.1 -0.505 42.0-169.0 -67.5 126.1 9.3 22.0 26.0 173 173 A V - 0 0 8 -31,-3.1 2,-0.3 1,-0.3 180,-0.3 0.893 43.9 -85.9 -84.0 -51.2 12.5 23.5 24.8 174 174 A G E -h 143 0B 6 -32,-0.5 -30,-2.1 2,-0.1 5,-0.3 -0.979 59.9 -22.7 168.6-167.4 13.7 20.9 22.3 175 175 A D E > S-h 144 0B 80 -2,-0.3 3,-2.7 -32,-0.2 -30,-0.2 -0.136 93.4 -34.3 -68.7 162.3 15.6 17.6 21.7 176 176 A D T 3 S+ 0 0 18 -32,-0.7 3,-0.5 1,-0.3 -52,-0.4 0.053 132.1 8.6 23.0-102.8 18.3 16.0 23.8 177 177 A G T 3> S+ 0 0 0 1,-0.2 4,-2.4 2,-0.1 -1,-0.3 0.423 97.9 105.0 -82.6 3.7 20.5 18.6 25.4 178 178 A A H <> S+ 0 0 0 -3,-2.7 4,-2.6 1,-0.2 -1,-0.2 0.831 79.0 49.2 -54.2 -41.9 18.4 21.7 24.4 179 179 A G H > S+ 0 0 0 -3,-0.5 4,-2.1 -5,-0.3 -1,-0.2 0.936 115.7 43.9 -65.1 -45.3 16.9 22.3 27.9 180 180 A H H > S+ 0 0 1 -4,-0.3 4,-2.2 -56,-0.2 -2,-0.2 0.824 112.0 52.8 -68.9 -30.4 20.3 22.1 29.6 181 181 A F H X S+ 0 0 1 -4,-2.4 4,-2.4 2,-0.2 5,-0.2 0.942 109.8 48.7 -69.1 -45.2 21.9 24.3 26.9 182 182 A V H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.904 109.8 54.4 -60.8 -40.0 19.2 27.0 27.4 183 183 A K H X S+ 0 0 12 -4,-2.1 4,-1.9 2,-0.2 -1,-0.2 0.924 108.2 46.6 -59.3 -49.4 19.9 26.7 31.1 184 184 A M H X S+ 0 0 3 -4,-2.2 4,-2.3 1,-0.2 -2,-0.2 0.936 111.5 51.5 -66.3 -36.1 23.6 27.3 30.8 185 185 A V H X S+ 0 0 0 -4,-2.4 4,-2.8 1,-0.2 5,-0.2 0.911 105.6 57.4 -64.3 -38.0 23.0 30.3 28.4 186 186 A H H X S+ 0 0 0 -4,-2.5 4,-2.0 1,-0.2 -1,-0.2 0.933 109.4 44.2 -52.7 -49.0 20.6 31.7 31.1 187 187 A N H X S+ 0 0 20 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.863 109.3 56.2 -69.9 -33.5 23.5 31.6 33.6 188 188 A G H X S+ 0 0 0 -4,-2.3 4,-1.8 1,-0.2 -2,-0.2 0.944 109.6 46.7 -58.8 -46.3 25.9 33.1 31.0 189 189 A I H X S+ 0 0 0 -4,-2.8 4,-2.4 1,-0.2 -2,-0.2 0.888 107.3 57.3 -63.4 -39.2 23.5 36.0 30.7 190 190 A E H X S+ 0 0 30 -4,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.928 105.3 50.9 -57.1 -45.6 23.1 36.3 34.4 191 191 A Y H X S+ 0 0 10 -4,-2.1 4,-2.4 1,-0.2 -1,-0.2 0.901 109.0 52.4 -57.5 -45.8 26.9 36.8 34.7 192 192 A G H X S+ 0 0 0 -4,-1.8 4,-2.2 1,-0.2 -2,-0.2 0.916 109.8 46.5 -57.7 -48.1 26.7 39.5 32.1 193 193 A D H X S+ 0 0 6 -4,-2.4 4,-2.3 2,-0.2 -1,-0.2 0.884 110.7 53.0 -66.6 -38.7 24.0 41.5 33.9 194 194 A M H X S+ 0 0 71 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.952 110.8 46.6 -60.6 -48.9 25.8 41.3 37.3 195 195 A Q H X S+ 0 0 38 -4,-2.4 4,-2.2 2,-0.2 -2,-0.2 0.888 109.7 54.0 -61.8 -41.4 29.0 42.6 35.8 196 196 A L H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 -1,-0.2 0.950 109.5 48.1 -56.8 -47.0 27.2 45.5 34.0 197 197 A I H X S+ 0 0 15 -4,-2.3 4,-2.9 1,-0.2 -2,-0.2 0.934 109.3 54.1 -61.1 -45.8 25.6 46.5 37.3 198 198 A C H X S+ 0 0 66 -4,-2.5 4,-2.7 1,-0.2 -1,-0.2 0.865 108.7 49.0 -56.3 -38.1 29.1 46.3 39.0 199 199 A E H X S+ 0 0 2 -4,-2.2 4,-2.2 2,-0.2 -1,-0.2 0.914 111.4 47.9 -70.5 -40.0 30.5 48.7 36.3 200 200 A A H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 5,-0.2 0.951 112.9 50.6 -60.9 -46.6 27.6 51.2 36.8 201 201 A Y H X S+ 0 0 42 -4,-2.9 4,-2.4 1,-0.2 -2,-0.2 0.925 109.1 51.0 -54.3 -50.3 28.2 50.9 40.6 202 202 A H H X S+ 0 0 54 -4,-2.7 4,-2.6 1,-0.2 5,-0.4 0.874 108.8 50.3 -61.8 -40.0 31.9 51.6 40.0 203 203 A L H X>S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 5,-1.6 0.930 113.1 45.1 -65.7 -43.9 31.3 54.8 37.9 204 204 A M H <5S+ 0 0 0 -4,-2.2 6,-2.3 3,-0.2 -2,-0.2 0.918 117.1 46.5 -64.2 -42.4 28.9 56.3 40.5 205 205 A K H <5S+ 0 0 79 -4,-2.4 4,-0.4 -5,-0.2 -2,-0.2 0.969 127.2 22.8 -65.2 -52.4 31.2 55.4 43.4 206 206 A D H <5S+ 0 0 84 -4,-2.6 -3,-0.2 -5,-0.2 -2,-0.2 0.725 131.0 34.6 -96.8 -24.8 34.4 56.6 41.9 207 207 A V T <5S+ 0 0 21 -4,-2.5 104,-0.4 -5,-0.4 -3,-0.2 0.891 131.3 30.5 -91.0 -50.7 33.6 59.2 39.3 208 208 A L S - 0 0 27 -2,-0.1 4,-2.6 1,-0.1 5,-0.2 -0.539 31.8-100.4 -82.8 162.9 27.7 57.2 49.0 212 212 A H H > S+ 0 0 32 2,-0.2 4,-3.1 1,-0.2 5,-0.2 0.802 120.7 59.4 -57.8 -34.0 25.8 53.9 49.2 213 213 A K H > S+ 0 0 151 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.980 112.5 38.9 -55.5 -56.1 22.6 55.7 50.4 214 214 A E H > S+ 0 0 98 1,-0.2 4,-2.4 2,-0.2 -2,-0.2 0.882 115.7 53.6 -64.3 -38.1 22.5 57.8 47.2 215 215 A M H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 -1,-0.2 0.931 108.4 48.2 -64.4 -42.5 23.6 54.8 45.1 216 216 A A H X S+ 0 0 1 -4,-3.1 4,-2.6 1,-0.2 -1,-0.2 0.874 111.3 52.5 -63.2 -36.0 20.8 52.6 46.5 217 217 A K H X S+ 0 0 125 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.936 107.5 50.5 -63.2 -47.6 18.4 55.5 45.7 218 218 A A H X S+ 0 0 2 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.914 111.3 49.3 -58.8 -44.7 19.6 55.7 42.1 219 219 A F H X S+ 0 0 0 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.916 109.2 50.4 -65.7 -42.6 19.1 51.9 41.7 220 220 A E H < S+ 0 0 97 -4,-2.6 -1,-0.2 2,-0.2 -2,-0.2 0.881 110.9 51.0 -60.9 -36.0 15.5 52.0 43.1 221 221 A E H >< S+ 0 0 87 -4,-2.2 3,-1.7 1,-0.2 -2,-0.2 0.937 110.3 48.8 -63.7 -46.4 14.8 54.8 40.7 222 222 A W H ><>S+ 0 0 9 -4,-2.4 3,-2.3 1,-0.3 5,-0.5 0.814 98.7 66.7 -63.3 -32.1 16.2 52.7 37.8 223 223 A N T 3<5S+ 0 0 24 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.555 98.5 55.7 -69.0 -6.8 14.1 49.8 38.9 224 224 A K T < 5S+ 0 0 150 -3,-1.7 -1,-0.3 -4,-0.2 -2,-0.2 0.290 104.2 61.2-101.9 4.4 11.1 51.9 37.9 225 225 A T T X 5S- 0 0 47 -3,-2.3 3,-1.8 -4,-0.0 -3,-0.0 -0.283 119.9 -61.7-107.4-155.2 12.4 52.5 34.3 226 226 A E T 3 5S+ 0 0 89 1,-0.3 145,-0.3 -2,-0.1 -3,-0.1 0.726 128.4 72.4 -61.9 -22.2 13.2 49.9 31.5 227 227 A L T 3 < + 0 0 2 -5,-0.5 5,-0.3 143,-0.1 -1,-0.3 0.374 63.4 141.4 -79.3 6.1 15.8 48.4 33.8 228 228 A D < + 0 0 64 -3,-1.8 142,-1.4 -6,-0.1 143,-0.6 -0.318 29.5 134.1 -49.0 109.5 13.0 47.0 36.1 229 229 A S B > S-J 369 0D 9 -2,-0.3 4,-2.2 140,-0.2 140,-0.2 -0.985 70.1-107.9-159.7 159.4 14.5 43.6 37.0 230 230 A F H > S+ 0 0 49 138,-2.6 4,-2.6 -2,-0.3 5,-0.3 0.939 117.8 52.0 -58.4 -46.6 15.1 41.3 39.9 231 231 A L H > S+ 0 0 15 135,-0.5 4,-2.0 137,-0.4 -1,-0.2 0.877 109.0 47.6 -63.0 -37.7 18.9 42.0 39.8 232 232 A I H > S+ 0 0 3 -5,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.939 113.0 51.9 -65.9 -43.3 18.4 45.9 40.0 233 233 A E H X S+ 0 0 100 -4,-2.2 4,-1.7 1,-0.2 3,-0.3 0.942 111.3 43.1 -58.2 -55.2 15.9 45.5 42.8 234 234 A I H X S+ 0 0 50 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.854 109.1 60.1 -65.9 -30.3 18.2 43.3 45.0 235 235 A T H X S+ 0 0 20 -4,-2.0 4,-2.4 -5,-0.3 -1,-0.2 0.919 102.6 51.5 -61.9 -43.0 21.2 45.5 44.3 236 236 A A H X S+ 0 0 3 -4,-2.1 4,-1.5 -3,-0.3 -1,-0.2 0.947 112.3 47.6 -55.7 -45.5 19.3 48.5 45.8 237 237 A S H X S+ 0 0 71 -4,-1.7 4,-1.8 1,-0.2 -2,-0.2 0.882 110.5 50.8 -62.8 -42.4 18.7 46.3 48.9 238 238 A I H < S+ 0 0 82 -4,-2.5 12,-0.5 1,-0.2 11,-0.2 0.904 108.6 51.7 -64.1 -41.2 22.3 45.2 49.1 239 239 A L H < S+ 0 0 6 -4,-2.4 -1,-0.2 1,-0.2 -2,-0.2 0.802 113.2 44.9 -68.5 -30.8 23.6 48.8 48.9 240 240 A K H < S+ 0 0 82 -4,-1.5 -1,-0.2 -5,-0.2 -2,-0.2 0.825 86.8 117.8 -75.3 -39.6 21.3 49.9 51.8 241 241 A F < - 0 0 117 -4,-1.8 8,-1.8 -5,-0.2 2,-0.4 0.026 50.3-152.4 -44.1 130.0 22.0 46.9 54.0 242 242 A Q B -K 248 0E 103 6,-0.2 6,-0.2 7,-0.1 -1,-0.1 -0.874 6.3-135.0-114.7 136.5 23.6 47.6 57.4 243 243 A D > - 0 0 54 4,-3.3 3,-2.6 -2,-0.4 6,-0.0 -0.302 43.6 -84.7 -75.3 170.3 25.7 45.4 59.4 244 244 A A T 3 S+ 0 0 110 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.685 128.3 56.5 -51.6 -26.0 25.3 44.8 63.2 245 245 A D T 3 S- 0 0 83 2,-0.2 -1,-0.3 1,-0.0 3,-0.1 0.235 119.1-107.2 -91.3 9.4 27.4 47.9 63.9 246 246 A G S < S+ 0 0 42 -3,-2.6 -2,-0.1 1,-0.3 2,-0.1 0.302 85.3 117.7 81.4 -15.1 25.2 50.3 61.9 247 247 A K S S- 0 0 131 1,-0.1 -4,-3.3 -5,-0.1 -1,-0.3 -0.493 77.1 -88.6 -83.4 159.1 27.8 50.5 59.0 248 248 A H B -K 242 0E 44 -6,-0.2 -6,-0.2 -2,-0.1 4,-0.2 -0.455 29.7-149.9 -68.6 141.5 27.2 49.3 55.5 249 249 A L S > S+ 0 0 57 -8,-1.8 3,-2.5 -11,-0.2 4,-0.4 0.920 82.8 68.9 -80.6 -47.1 28.0 45.6 54.9 250 250 A L G > S+ 0 0 50 -12,-0.5 3,-1.9 -9,-0.4 -1,-0.1 0.807 94.6 56.0 -45.3 -47.4 29.0 45.6 51.1 251 251 A P G 3 S+ 0 0 78 0, 0.0 -1,-0.3 0, 0.0 -2,-0.1 0.671 103.6 58.4 -60.6 -17.7 32.3 47.6 51.6 252 252 A K G < S+ 0 0 105 -3,-2.5 2,-0.3 -4,-0.2 -2,-0.2 0.566 88.0 93.0 -87.9 -11.7 33.5 45.0 54.1 253 253 A I S < S- 0 0 107 -3,-1.9 2,-0.2 -4,-0.4 -4,-0.0 -0.639 81.8-102.7 -98.4 149.2 33.3 42.0 51.8 254 254 A R - 0 0 148 -2,-0.3 2,-1.5 1,-0.1 -1,-0.1 -0.408 20.5-136.3 -69.2 129.3 36.1 40.6 49.7 255 255 A D + 0 0 72 -2,-0.2 2,-0.5 2,-0.1 -1,-0.1 -0.410 67.3 113.3 -81.8 56.4 36.1 41.4 46.0 256 256 A S - 0 0 43 -2,-1.5 2,-0.2 35,-0.1 35,-0.1 -0.943 57.5-149.6-130.6 103.2 37.0 37.9 44.7 257 257 A A - 0 0 40 -2,-0.5 2,-0.1 30,-0.4 34,-0.1 -0.580 7.4-140.2 -79.0 137.8 34.0 36.5 42.8 258 258 A G - 0 0 56 -2,-0.2 2,-0.3 33,-0.0 -1,-0.1 -0.379 13.1-160.5 -87.9 172.0 33.4 32.8 42.8 259 259 A Q - 0 0 60 -2,-0.1 25,-0.0 28,-0.0 0, 0.0 -0.962 16.7-164.2-152.2 144.1 32.2 30.7 39.8 260 260 A K - 0 0 205 -2,-0.3 2,-0.2 0, 0.0 -1,-0.0 0.198 55.1 -97.3-114.2 8.7 30.5 27.3 39.5 261 261 A G S > S+ 0 0 10 -77,-0.0 4,-2.3 1,-0.0 5,-0.2 -0.230 96.8 94.9 113.8 -46.9 31.1 26.6 35.8 262 262 A T H > S+ 0 0 11 1,-0.2 4,-1.9 2,-0.2 -74,-0.2 0.853 89.5 49.0 -57.9 -43.2 28.0 27.5 33.7 263 263 A G H > S+ 0 0 0 2,-0.2 4,-2.1 1,-0.2 3,-0.3 0.951 111.3 50.3 -53.8 -55.4 29.2 31.0 32.7 264 264 A K H > S+ 0 0 99 1,-0.2 4,-2.6 2,-0.2 -2,-0.2 0.914 109.4 52.5 -46.8 -48.3 32.5 29.6 31.7 265 265 A W H X S+ 0 0 53 -4,-2.3 4,-2.9 2,-0.2 -1,-0.2 0.841 104.5 54.2 -64.6 -34.9 30.7 27.0 29.5 266 266 A T H X S+ 0 0 1 -4,-1.9 4,-2.2 -3,-0.3 -1,-0.2 0.975 112.1 45.1 -63.1 -47.4 28.6 29.6 27.7 267 267 A A H X S+ 0 0 15 -4,-2.1 4,-2.2 1,-0.2 -2,-0.2 0.935 113.2 49.9 -59.6 -47.2 31.8 31.5 26.7 268 268 A I H X S+ 0 0 76 -4,-2.6 4,-2.7 1,-0.2 -1,-0.2 0.909 110.8 50.3 -60.0 -43.8 33.5 28.2 25.7 269 269 A S H X S+ 0 0 2 -4,-2.9 4,-2.5 2,-0.2 -1,-0.2 0.876 107.8 52.7 -61.9 -39.4 30.5 27.2 23.6 270 270 A A H X>S+ 0 0 4 -4,-2.2 5,-2.6 2,-0.2 4,-0.8 0.917 111.5 47.2 -61.9 -43.7 30.5 30.6 21.8 271 271 A L H ><5S+ 0 0 141 -4,-2.2 3,-0.8 3,-0.2 -2,-0.2 0.930 111.3 50.6 -64.6 -47.5 34.2 30.0 21.0 272 272 A E H 3<5S+ 0 0 101 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.880 118.6 36.9 -58.1 -42.9 33.6 26.5 19.7 273 273 A Y H 3<5S- 0 0 45 -4,-2.5 -1,-0.2 -5,-0.1 -2,-0.2 0.394 112.8-115.8 -93.1 2.2 30.7 27.5 17.4 274 274 A G T <<5 + 0 0 64 -3,-0.8 -3,-0.2 -4,-0.8 -4,-0.1 0.833 61.1 149.2 70.4 39.7 32.3 30.8 16.4 275 275 A V < - 0 0 13 -5,-2.6 2,-2.4 -6,-0.2 -1,-0.2 -0.903 50.2-129.3-106.6 126.8 29.6 33.1 17.9 276 276 A P + 0 0 61 0, 0.0 2,-1.8 0, 0.0 3,-0.2 -0.380 43.0 158.6 -78.6 70.9 30.9 36.5 19.1 277 277 A V > + 0 0 9 -2,-2.4 4,-1.3 1,-0.2 -7,-0.1 -0.571 13.2 158.8 -92.3 73.5 29.3 36.4 22.6 278 278 A T H > + 0 0 47 -2,-1.8 4,-2.4 2,-0.2 -1,-0.2 0.853 58.1 54.3 -74.6 -33.5 31.8 39.0 23.8 279 279 A L H > S+ 0 0 0 -3,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.936 109.2 46.9 -74.0 -42.8 30.1 40.5 26.9 280 280 A I H > S+ 0 0 0 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.917 112.3 54.1 -60.5 -37.1 29.5 37.1 28.7 281 281 A G H X S+ 0 0 14 -4,-1.3 4,-2.7 1,-0.2 -2,-0.2 0.957 110.0 45.2 -58.1 -51.6 33.2 36.3 27.8 282 282 A E H X S+ 0 0 68 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.846 110.9 53.9 -60.5 -38.3 34.3 39.6 29.5 283 283 A A H X S+ 0 0 0 -4,-2.5 4,-1.9 2,-0.2 -2,-0.2 0.961 110.3 46.8 -62.8 -45.0 32.1 38.9 32.5 284 284 A V H >X S+ 0 0 11 -4,-2.8 4,-2.0 1,-0.2 3,-0.6 0.961 114.6 46.4 -62.8 -51.0 33.7 35.5 33.0 285 285 A F H 3X S+ 0 0 143 -4,-2.7 4,-2.6 1,-0.3 -1,-0.2 0.843 107.4 58.4 -62.4 -29.6 37.2 36.9 32.6 286 286 A A H 3X S+ 0 0 15 -4,-2.4 4,-2.0 2,-0.2 -1,-0.3 0.884 105.4 49.5 -69.0 -34.2 36.3 39.8 35.0 287 287 A R H < S+ 0 0 99 -4,-2.6 3,-1.1 1,-0.2 -1,-0.2 0.901 106.2 51.5 -61.0 -44.7 40.5 39.0 37.3 290 290 A S H 3< S+ 0 0 22 -4,-2.0 3,-0.5 1,-0.2 -1,-0.2 0.806 98.4 66.5 -67.2 -27.8 39.0 39.6 40.8 291 291 A S H 3< S+ 0 0 55 -4,-1.6 2,-1.2 -3,-0.3 3,-0.4 0.813 86.4 72.8 -58.7 -27.5 40.3 36.1 42.0 292 292 A L + 0 0 43 -2,-1.2 4,-2.2 -3,-0.5 -1,-0.2 0.867 68.0 45.7 -50.4 -52.0 43.3 39.7 44.7 294 294 A D H > S+ 0 0 111 -3,-0.4 4,-2.1 1,-0.2 -1,-0.2 0.905 111.7 52.4 -63.6 -41.2 46.8 39.5 46.1 295 295 A E H > S+ 0 0 135 1,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.921 109.1 50.2 -61.0 -42.2 48.3 40.2 42.7 296 296 A R H X S+ 0 0 67 -4,-2.5 4,-2.8 2,-0.2 -2,-0.2 0.882 106.0 55.0 -67.3 -37.1 46.1 43.3 42.3 297 297 A I H X S+ 0 0 67 -4,-2.2 4,-0.6 2,-0.2 -1,-0.2 0.935 112.0 45.2 -59.6 -43.2 47.2 44.6 45.8 298 298 A Q H >X S+ 0 0 110 -4,-2.1 3,-1.1 1,-0.2 4,-0.6 0.935 112.6 50.8 -65.1 -43.4 50.8 44.3 44.5 299 299 A A H >X S+ 0 0 36 -4,-2.7 4,-3.0 1,-0.2 3,-1.7 0.888 100.9 61.9 -63.5 -40.7 49.9 45.9 41.2 300 300 A S H 3< S+ 0 0 88 -4,-2.8 -1,-0.2 1,-0.3 -2,-0.2 0.672 102.8 52.6 -59.8 -20.2 48.2 48.9 42.9 301 301 A K H << S+ 0 0 134 -3,-1.1 -1,-0.3 -4,-0.6 -2,-0.2 0.691 121.6 28.5 -85.0 -22.9 51.5 49.9 44.5 302 302 A K H << S+ 0 0 180 -3,-1.7 2,-0.4 -4,-0.6 -2,-0.2 0.773 104.6 71.6-108.5 -42.8 53.4 49.8 41.2 303 303 A L < - 0 0 130 -4,-3.0 2,-0.3 -5,-0.1 -1,-0.1 -0.673 68.9-144.1 -88.1 135.2 51.1 50.7 38.3 304 304 A K - 0 0 181 -2,-0.4 -3,-0.1 1,-0.1 -4,-0.0 -0.731 6.3-147.8-102.9 145.5 49.9 54.3 38.0 305 305 A G - 0 0 64 -2,-0.3 3,-0.1 1,-0.2 111,-0.1 -0.209 39.2 -63.2 -93.2-171.7 46.5 55.4 36.7 306 306 A P - 0 0 73 0, 0.0 -1,-0.2 0, 0.0 2,-0.2 -0.059 67.6 -72.7 -68.8 173.6 45.6 58.6 34.8 307 307 A Q - 0 0 161 1,-0.1 2,-0.9 107,-0.1 0, 0.0 -0.522 57.0-111.2 -70.6 132.1 46.0 62.2 36.0 308 308 A N + 0 0 145 -2,-0.2 -1,-0.1 -3,-0.1 107,-0.1 -0.593 43.6 176.0 -70.0 101.6 43.3 62.8 38.6 309 309 A I - 0 0 117 -2,-0.9 3,-0.1 105,-0.1 2,-0.0 -0.966 28.6-128.9-111.6 112.1 40.8 65.2 36.9 310 310 A P - 0 0 99 0, 0.0 2,-0.3 0, 0.0 -102,-0.1 -0.336 34.0 -94.0 -58.7 142.3 37.8 65.8 39.3 311 311 A F - 0 0 67 -104,-0.4 2,-0.6 1,-0.1 4,-0.1 -0.440 42.8-174.2 -66.6 120.9 34.3 65.3 37.6 312 312 A E + 0 0 187 -2,-0.3 2,-0.3 -3,-0.1 -1,-0.1 -0.962 48.1 69.5-120.4 98.2 33.3 68.7 36.4 313 313 A G S S- 0 0 54 -2,-0.6 2,-0.7 0, 0.0 3,-0.1 -0.938 93.0 -51.7 171.8-177.5 29.7 68.3 35.2 314 314 A D > - 0 0 90 -2,-0.3 4,-2.6 1,-0.2 3,-0.2 -0.748 36.1-153.5 -88.3 121.5 26.2 67.7 36.4 315 315 A K H > S+ 0 0 109 -2,-0.7 4,-2.8 1,-0.2 5,-0.2 0.893 95.1 53.4 -56.3 -44.5 25.9 64.6 38.7 316 316 A K H > S+ 0 0 167 2,-0.2 4,-1.3 1,-0.2 -1,-0.2 0.877 110.3 45.8 -62.2 -41.9 22.2 64.1 37.7 317 317 A S H > S+ 0 0 60 -3,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.918 113.7 48.9 -67.9 -42.4 22.9 64.1 33.9 318 318 A F H X S+ 0 0 4 -4,-2.6 4,-2.4 1,-0.2 -2,-0.2 0.922 107.0 55.0 -65.2 -41.1 25.9 61.8 34.3 319 319 A L H X S+ 0 0 30 -4,-2.8 4,-1.9 1,-0.2 -1,-0.2 0.858 108.4 50.8 -59.0 -32.7 23.8 59.4 36.5 320 320 A E H X S+ 0 0 68 -4,-1.3 4,-2.2 2,-0.2 -1,-0.2 0.881 106.6 53.5 -70.4 -39.7 21.3 59.4 33.6 321 321 A D H X S+ 0 0 12 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.911 107.2 51.1 -61.0 -41.1 24.1 58.6 31.1 322 322 A I H X S+ 0 0 0 -4,-2.4 4,-2.7 2,-0.2 5,-0.2 0.940 107.8 54.6 -63.3 -43.0 25.1 55.6 33.3 323 323 A R H X S+ 0 0 20 -4,-1.9 4,-2.4 1,-0.2 -2,-0.2 0.933 113.6 40.5 -51.0 -53.4 21.4 54.4 33.2 324 324 A K H X S+ 0 0 46 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.835 111.6 55.8 -70.1 -34.2 21.4 54.5 29.4 325 325 A A H X S+ 0 0 0 -4,-2.6 4,-1.9 2,-0.2 -1,-0.2 0.921 110.3 46.6 -65.5 -41.2 24.9 53.0 29.1 326 326 A L H X S+ 0 0 4 -4,-2.7 4,-2.5 2,-0.2 -2,-0.2 0.950 113.7 48.4 -64.1 -51.0 23.8 50.0 31.2 327 327 A Y H X S+ 0 0 7 -4,-2.4 4,-2.0 -5,-0.2 -2,-0.2 0.922 112.8 46.1 -58.4 -49.1 20.5 49.6 29.2 328 328 A A H X S+ 0 0 0 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.898 114.1 49.5 -58.4 -43.4 22.2 49.7 25.8 329 329 A S H X S+ 0 0 0 -4,-1.9 4,-2.4 -5,-0.2 -1,-0.2 0.879 108.2 52.6 -65.4 -39.9 24.9 47.3 26.9 330 330 A K H X S+ 0 0 8 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.904 106.2 55.0 -63.6 -38.7 22.3 44.9 28.3 331 331 A I H X S+ 0 0 0 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.953 108.6 47.7 -59.3 -47.2 20.6 45.0 24.9 332 332 A I H X S+ 0 0 0 -4,-2.0 4,-2.6 1,-0.2 -2,-0.2 0.913 109.2 54.4 -62.7 -41.1 23.8 43.9 23.2 333 333 A S H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.924 111.5 43.9 -57.6 -46.7 24.4 41.1 25.7 334 334 A Y H X S+ 0 0 0 -4,-2.3 4,-2.5 2,-0.2 -1,-0.2 0.869 110.0 54.7 -70.5 -36.9 21.0 39.6 25.1 335 335 A A H X S+ 0 0 0 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.945 111.6 46.6 -58.7 -44.1 21.3 40.0 21.3 336 336 A Q H X S+ 0 0 0 -4,-2.6 4,-1.9 2,-0.2 -2,-0.2 0.894 110.1 53.8 -63.6 -42.0 24.6 38.0 21.6 337 337 A G H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.933 110.3 45.1 -58.7 -48.9 22.9 35.4 23.8 338 338 A F H X S+ 0 0 7 -4,-2.5 4,-2.7 1,-0.2 -1,-0.2 0.825 107.4 59.8 -70.1 -24.2 20.2 34.7 21.3 339 339 A M H X S+ 0 0 39 -4,-1.9 4,-2.4 -5,-0.2 -1,-0.2 0.924 107.5 46.3 -63.6 -42.1 22.8 34.6 18.5 340 340 A L H X S+ 0 0 0 -4,-1.9 4,-2.8 2,-0.2 -2,-0.2 0.936 112.8 49.1 -63.2 -48.8 24.4 31.7 20.4 341 341 A L H X S+ 0 0 0 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.945 112.0 49.5 -55.2 -47.4 21.0 30.0 20.9 342 342 A R H X S+ 0 0 78 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.908 112.6 46.3 -59.8 -44.3 20.3 30.5 17.2 343 343 A Q H X S+ 0 0 71 -4,-2.4 4,-2.4 2,-0.2 -1,-0.2 0.901 110.6 52.5 -69.3 -38.1 23.6 29.0 16.2 344 344 A A H X S+ 0 0 0 -4,-2.8 4,-2.4 1,-0.2 5,-0.2 0.916 105.9 56.7 -63.9 -40.4 23.3 26.0 18.5 345 345 A A H X>S+ 0 0 7 -4,-2.5 5,-1.8 1,-0.2 4,-1.2 0.927 111.3 40.5 -59.3 -46.0 19.9 25.4 17.0 346 346 A T H <5S+ 0 0 108 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.869 114.8 55.6 -73.9 -27.0 21.4 25.1 13.4 347 347 A E H <5S+ 0 0 93 -4,-2.4 -2,-0.2 1,-0.2 -1,-0.2 0.840 122.5 23.1 -68.2 -38.0 24.3 23.1 14.9 348 348 A F H <5S- 0 0 54 -4,-2.4 -1,-0.2 -3,-0.2 -2,-0.2 0.356 107.6-112.1-113.0 4.2 22.3 20.4 16.6 349 349 A G T <5 + 0 0 54 -4,-1.2 2,-0.4 -5,-0.2 -3,-0.2 0.908 61.1 153.6 68.8 43.6 19.0 20.6 14.5 350 350 A W < - 0 0 9 -5,-1.8 2,-0.9 -6,-0.2 -1,-0.2 -0.831 41.2-143.5 -99.5 144.1 16.8 21.9 17.3 351 351 A T - 0 0 134 -2,-0.4 2,-0.3 2,-0.0 -5,-0.0 -0.901 29.7-171.3-106.9 100.8 13.7 24.0 16.4 352 352 A L - 0 0 16 -2,-0.9 2,-0.7 -10,-0.1 3,-0.1 -0.687 23.1-142.0 -91.7 147.8 13.8 26.5 19.2 353 353 A N > - 0 0 105 -2,-0.3 4,-2.1 -180,-0.3 5,-0.1 -0.922 15.5-169.3-108.9 102.3 11.0 28.9 19.9 354 354 A Y H > S+ 0 0 23 -2,-0.7 4,-2.4 29,-0.2 5,-0.2 0.880 85.8 52.6 -64.1 -39.6 12.9 32.0 20.9 355 355 A G H > S+ 0 0 1 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.880 109.7 52.7 -62.9 -35.5 9.8 33.9 22.1 356 356 A G H > S+ 0 0 13 2,-0.2 4,-2.3 1,-0.2 -2,-0.2 0.897 107.3 49.6 -63.1 -44.3 9.1 30.8 24.2 357 357 A I H X S+ 0 0 1 -4,-2.1 4,-1.4 2,-0.2 -2,-0.2 0.934 109.5 51.8 -63.5 -45.9 12.5 30.8 25.8 358 358 A A H < S+ 0 0 0 -4,-2.4 4,-0.4 1,-0.2 3,-0.2 0.879 109.0 51.2 -58.0 -40.8 12.2 34.5 26.6 359 359 A L H >X S+ 0 0 20 -4,-2.0 3,-1.6 1,-0.2 4,-0.6 0.930 105.8 54.5 -61.7 -46.5 8.9 33.8 28.3 360 360 A M H 3< S+ 0 0 4 -4,-2.3 5,-0.3 1,-0.3 -1,-0.2 0.774 113.3 44.0 -60.9 -24.5 10.6 30.9 30.4 361 361 A W T 3< S+ 0 0 0 -4,-1.4 -1,-0.3 -3,-0.2 -2,-0.2 0.439 93.5 82.9 -95.9 -2.4 13.1 33.6 31.5 362 362 A R T <4 S+ 0 0 71 -3,-1.6 2,-0.3 -4,-0.4 7,-0.2 0.770 103.9 11.8 -74.1 -25.7 10.4 36.3 32.2 363 363 A G S < S+ 0 0 12 -4,-0.6 2,-1.6 -3,-0.2 -202,-0.1 -0.927 117.4 29.8-144.4 165.1 9.6 34.9 35.7 364 364 A G S S+ 0 0 10 -2,-0.3 -225,-0.2 1,-0.1 -3,-0.1 -0.317 97.0 91.0 83.4 -52.0 11.0 32.4 38.2 365 365 A C S > S- 0 0 0 -2,-1.6 3,-1.8 -5,-0.3 -135,-0.2 -0.300 85.7-112.7 -82.6 161.7 14.6 32.9 37.1 366 366 A I T 3 S+ 0 0 39 1,-0.3 -135,-0.5 -136,-0.1 -136,-0.1 0.799 114.4 55.8 -63.3 -27.8 17.3 35.3 38.4 367 367 A I T 3 S+ 0 0 3 -137,-0.1 -1,-0.3 -4,-0.1 5,-0.2 0.461 78.7 141.6 -87.1 7.0 17.4 37.3 35.1 368 368 A R < + 0 0 76 -3,-1.8 -138,-2.6 -139,-0.1 -137,-0.4 -0.131 19.0 137.9 -57.9 137.1 13.6 38.1 35.2 369 369 A S B > -J 229 0D 5 -140,-0.2 3,-1.0 -7,-0.2 4,-0.5 -0.946 68.5-101.2-166.5 164.6 12.6 41.5 34.1 370 370 A V T >> S+ 0 0 63 -142,-1.4 3,-1.5 -2,-0.3 4,-1.0 0.819 114.7 73.5 -60.6 -33.3 10.1 43.4 32.1 371 371 A F H 3> S+ 0 0 4 -143,-0.6 4,-1.9 -145,-0.3 3,-0.4 0.842 86.1 60.1 -54.5 -39.4 12.8 43.5 29.4 372 372 A L H <> S+ 0 0 0 -3,-1.0 4,-2.4 1,-0.2 -1,-0.3 0.812 98.9 60.0 -62.1 -27.2 12.3 39.8 28.6 373 373 A G H <> S+ 0 0 20 -3,-1.5 4,-2.2 -4,-0.5 -1,-0.2 0.911 103.5 48.9 -65.4 -40.5 8.7 40.8 27.7 374 374 A K H X S+ 0 0 69 -4,-1.0 4,-1.6 -3,-0.4 -2,-0.2 0.928 110.4 51.0 -67.6 -40.9 9.9 43.1 25.0 375 375 A I H X S+ 0 0 0 -4,-1.9 4,-2.0 1,-0.2 3,-0.4 0.944 107.3 55.9 -60.1 -45.4 12.2 40.4 23.6 376 376 A K H X S+ 0 0 46 -4,-2.4 4,-2.0 1,-0.3 -2,-0.2 0.926 109.4 43.1 -57.9 -47.8 9.3 38.0 23.5 377 377 A D H X S+ 0 0 55 -4,-2.2 4,-2.5 2,-0.2 -1,-0.3 0.743 105.3 63.9 -78.9 -11.0 7.1 40.2 21.4 378 378 A A H X S+ 0 0 0 -4,-1.6 4,-1.2 -3,-0.4 -1,-0.2 0.958 112.0 37.8 -62.9 -46.4 10.2 41.0 19.1 379 379 A F H < S+ 0 0 8 -4,-2.0 -2,-0.2 2,-0.2 -1,-0.2 0.750 113.0 56.8 -78.5 -24.9 10.1 37.3 18.3 380 380 A D H < S+ 0 0 90 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.963 108.6 47.1 -65.5 -49.6 6.2 37.2 18.3 381 381 A R H < S+ 0 0 132 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.792 139.0 5.7 -56.1 -34.4 6.2 40.0 15.6 382 382 A N >< - 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