==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=12-OCT-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/DNA 15-JUN-12 4FLZ . COMPND 2 MOLECULE: DNA POLYMERASE 1; . SOURCE 2 ORGANISM_SCIENTIFIC: PYROCOCCUS ABYSSI; . AUTHOR J.GOUGE,M.DELARUE . 754 2 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 34575.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 521 69.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 15 2.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 117 15.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 8 1.1 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 . 47 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 75 9.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 245 32.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 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 1 2 1 1 2 2 2 2 1 0 0 3 1 0 2 0 0 1 0 1 0 0 0 0 0 0 1 RESIDUES PER ALPHA HELIX . 1 0 2 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 0 0 PARALLEL BRIDGES PER LADDER . 2 0 2 6 3 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 ANTIPARALLEL BRIDGES PER LADDER . 2 3 0 1 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 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 0 122 0, 0.0 2,-0.1 0, 0.0 21,-0.0 0.000 360.0 360.0 360.0 -31.8 33.3 -53.8 31.1 2 0 A G - 0 0 31 22,-0.1 2,-0.5 131,-0.0 22,-0.2 -0.046 360.0 -64.0-113.3-144.7 33.7 -49.9 31.4 3 1 A M E -A 23 0A 7 20,-2.5 20,-2.1 -2,-0.1 2,-0.3 -0.970 40.6-135.8-118.2 122.0 31.6 -46.9 30.4 4 2 A I E +A 22 0A 11 125,-0.5 127,-2.9 -2,-0.5 18,-0.2 -0.614 26.4 172.0 -76.9 129.2 30.8 -46.2 26.7 5 3 A I E - 0 0 1 16,-2.8 338,-0.4 1,-0.4 339,-0.4 0.662 63.6 -17.3-110.1 -24.5 31.3 -42.4 25.9 6 4 A D E -A 21 0A 4 15,-1.1 15,-2.2 336,-0.1 -1,-0.4 -0.960 53.0-149.4-168.9 170.0 30.9 -42.5 22.1 7 5 A A E +A 20 0A 8 -2,-0.3 2,-0.3 13,-0.2 13,-0.2 -0.980 22.4 152.4-149.9 142.9 30.9 -44.8 19.0 8 6 A D E -A 19 0A 22 11,-2.1 11,-3.5 -2,-0.3 2,-0.3 -0.869 32.2-113.6-152.5-175.3 31.9 -44.3 15.3 9 7 A Y E -A 18 0A 65 9,-0.3 2,-0.3 -2,-0.3 9,-0.2 -0.982 15.7-165.6-135.9 150.2 33.2 -46.2 12.3 10 8 A I E -A 17 0A 50 7,-2.4 7,-2.9 -2,-0.3 2,-0.4 -0.812 21.5-126.5-120.7 155.7 36.4 -46.2 10.3 11 9 A T E +A 16 0A 71 -2,-0.3 2,-0.4 5,-0.2 80,-0.0 -0.931 25.5 179.0-112.6 137.5 37.0 -47.8 6.8 12 10 A E E > S-A 15 0A 99 3,-2.6 3,-2.3 -2,-0.4 -2,-0.0 -0.977 74.4 -10.7-141.8 120.7 39.9 -50.2 6.3 13 11 A D T 3 S- 0 0 176 -2,-0.4 -1,-0.0 1,-0.3 -2,-0.0 0.799 130.5 -56.9 56.1 33.8 40.6 -52.0 3.0 14 12 A G T 3 S+ 0 0 39 1,-0.2 -1,-0.3 76,-0.0 -3,-0.0 0.324 118.5 112.0 82.3 -4.0 37.1 -50.7 1.9 15 13 A K E < -A 12 0A 39 -3,-2.3 -3,-2.6 76,-0.1 -1,-0.2 -0.776 69.1-113.5-106.0 142.3 35.4 -52.4 4.8 16 14 A P E -A 11 0A 9 0, 0.0 2,-0.4 0, 0.0 -5,-0.2 -0.467 24.9-169.6 -78.1 143.1 33.7 -50.7 7.9 17 15 A I E -A 10 0A 8 -7,-2.9 -7,-2.4 -2,-0.2 2,-0.3 -0.987 17.6-137.2-131.0 118.7 35.2 -51.1 11.5 18 16 A I E -AB 9 33A 2 15,-3.2 15,-2.1 -2,-0.4 2,-0.5 -0.575 14.6-155.1 -77.8 134.7 33.1 -49.9 14.4 19 17 A R E -AB 8 32A 15 -11,-3.5 -11,-2.1 -2,-0.3 2,-0.6 -0.968 4.9-165.2-111.7 125.5 35.1 -48.0 17.1 20 18 A I E -AB 7 31A 4 11,-2.7 11,-2.5 -2,-0.5 2,-0.5 -0.961 10.6-150.2-112.8 115.3 33.7 -48.0 20.7 21 19 A F E -AB 6 30A 6 -15,-2.2 -16,-2.8 -2,-0.6 -15,-1.1 -0.767 24.5-179.3 -89.1 121.8 35.3 -45.3 22.9 22 20 A K E -AB 4 29A 17 7,-3.1 7,-2.5 -2,-0.5 2,-0.5 -0.882 31.8-147.3-126.4 155.6 35.4 -46.4 26.6 23 21 A K E -AB 3 28A 12 -20,-2.1 -20,-2.5 -2,-0.3 2,-0.5 -0.993 25.8-179.5-120.3 114.1 36.5 -45.1 30.0 24 22 A E E > - B 0 27A 76 3,-3.0 3,-1.8 -2,-0.5 -22,-0.1 -0.947 67.0 -31.5-127.3 106.4 37.6 -48.1 32.1 25 23 A K T 3 S- 0 0 87 -2,-0.5 -1,-0.1 1,-0.3 3,-0.1 0.933 128.4 -42.4 46.8 56.2 38.8 -47.5 35.7 26 24 A G T 3 S+ 0 0 48 1,-0.2 2,-0.4 110,-0.1 -1,-0.3 0.324 119.1 111.6 78.1 -3.1 40.2 -44.1 34.8 27 25 A E E < -B 24 0A 142 -3,-1.8 -3,-3.0 2,-0.0 2,-0.3 -0.860 67.5-123.8-112.7 142.4 41.7 -45.2 31.5 28 26 A F E +B 23 0A 64 -2,-0.4 2,-0.3 -5,-0.2 -5,-0.2 -0.590 34.9 178.7 -76.0 126.2 40.8 -44.5 27.8 29 27 A K E -B 22 0A 28 -7,-2.5 -7,-3.1 -2,-0.3 2,-0.5 -0.992 16.9-157.3-132.5 137.7 40.2 -47.7 25.9 30 28 A V E -B 21 0A 47 -2,-0.3 2,-0.3 -9,-0.2 -9,-0.2 -0.973 10.2-163.8-119.0 115.5 39.2 -48.1 22.2 31 29 A E E -B 20 0A 76 -11,-2.5 -11,-2.7 -2,-0.5 2,-0.4 -0.780 7.4-149.7 -96.9 142.4 37.4 -51.4 21.2 32 30 A Y E -B 19 0A 132 -2,-0.3 2,-0.4 -13,-0.2 -13,-0.2 -0.928 11.8-172.9-115.3 140.4 37.1 -52.5 17.5 33 31 A D E +B 18 0A 26 -15,-2.1 -15,-3.2 -2,-0.4 3,-0.1 -0.975 13.5 167.0-133.7 118.9 34.4 -54.5 15.8 34 32 A R + 0 0 151 -2,-0.4 -1,-0.1 -17,-0.2 -2,-0.0 0.501 68.8 71.6-101.4 -12.4 34.8 -55.6 12.2 35 33 A T + 0 0 97 -17,-0.1 2,-0.4 2,-0.1 -1,-0.1 0.532 66.1 103.3 -88.7 -14.3 31.9 -58.2 12.1 36 34 A F - 0 0 28 -20,-0.1 86,-0.1 -3,-0.1 -18,-0.1 -0.612 57.1-156.4 -79.1 128.0 28.8 -55.9 12.2 37 35 A R - 0 0 94 -2,-0.4 53,-0.1 54,-0.1 54,-0.1 -0.874 13.0-122.1-106.4 137.9 27.1 -55.7 8.8 38 36 A P + 0 0 5 0, 0.0 51,-2.5 0, 0.0 2,-0.3 -0.302 41.0 164.3 -69.2 155.8 24.9 -52.8 7.5 39 37 A Y E -C 88 0B 7 49,-0.3 2,-0.3 74,-0.2 49,-0.2 -0.984 26.6-160.9-163.7 167.9 21.3 -53.8 6.3 40 38 A I E -C 87 0B 1 47,-1.5 47,-3.1 -2,-0.3 2,-0.4 -0.835 26.1-117.7-142.5 171.0 17.8 -52.7 5.4 41 39 A Y E -CD 86 112B 4 71,-2.1 71,-2.3 -2,-0.3 2,-0.4 -0.934 19.0-163.3-115.9 147.4 14.5 -54.6 5.2 42 40 A A E -CD 85 111B 0 43,-2.3 43,-2.4 -2,-0.4 2,-0.6 -0.997 10.2-150.0-131.9 127.0 12.3 -55.1 2.1 43 41 A L E - D 0 110B 36 67,-3.1 66,-3.0 -2,-0.4 67,-1.1 -0.875 24.4-159.1 -93.0 118.1 8.6 -56.2 2.1 44 42 A L E - D 0 108B 18 -2,-0.6 64,-0.2 39,-0.3 3,-0.1 -0.673 26.9-131.1-102.2 155.4 8.0 -58.2 -1.0 45 43 A K S S+ 0 0 80 62,-2.4 2,-0.3 1,-0.3 -1,-0.1 0.853 96.6 3.9 -68.7 -33.0 4.7 -58.9 -2.8 46 44 A D S > S- 0 0 99 61,-0.3 3,-1.5 1,-0.1 4,-0.3 -0.986 70.8-119.4-151.8 146.7 5.7 -62.6 -3.0 47 45 A D G > S+ 0 0 75 -2,-0.3 3,-1.7 1,-0.3 4,-0.3 0.820 110.1 68.4 -55.7 -35.5 8.7 -64.8 -1.7 48 46 A S G > S+ 0 0 78 1,-0.3 3,-1.2 2,-0.1 4,-0.3 0.775 86.3 69.8 -52.8 -34.7 9.5 -65.7 -5.3 49 47 A A G X> S+ 0 0 14 -3,-1.5 4,-2.5 1,-0.2 3,-1.1 0.688 76.7 80.3 -58.6 -26.8 10.6 -62.0 -5.9 50 48 A I H <> S+ 0 0 9 -3,-1.7 4,-3.1 -4,-0.3 -1,-0.2 0.821 84.6 61.4 -54.8 -33.3 13.7 -62.4 -3.7 51 49 A D H <4 S+ 0 0 111 -3,-1.2 4,-0.3 -4,-0.3 -1,-0.3 0.847 113.3 35.2 -62.5 -37.7 15.6 -64.1 -6.6 52 50 A E H X4 S+ 0 0 134 -3,-1.1 3,-0.6 -4,-0.3 -2,-0.2 0.877 119.1 51.2 -78.5 -45.7 15.2 -60.8 -8.8 53 51 A V H >< S+ 0 0 0 -4,-2.5 3,-2.0 1,-0.2 -2,-0.2 0.878 103.1 56.8 -63.7 -43.5 15.5 -58.4 -5.8 54 52 A K T 3< S+ 0 0 86 -4,-3.1 13,-0.5 1,-0.3 -1,-0.2 0.723 101.4 60.9 -64.5 -19.9 18.9 -60.0 -4.4 55 53 A K T < S+ 0 0 70 -3,-0.6 -1,-0.3 -4,-0.3 -2,-0.2 0.351 76.0 124.7 -88.5 3.3 20.4 -59.3 -7.9 56 54 A I < - 0 0 25 -3,-2.0 11,-0.7 1,-0.0 2,-0.3 -0.388 43.0-165.6 -69.0 140.2 19.8 -55.4 -7.6 57 55 A T E -G 66 0C 63 9,-0.1 2,-0.2 -2,-0.1 9,-0.2 -0.883 13.7-179.7-129.5 156.6 23.1 -53.4 -8.1 58 56 A A E -G 65 0C 16 7,-1.9 7,-2.8 -2,-0.3 2,-0.4 -0.797 23.4-118.3-142.1 180.0 24.3 -49.8 -7.5 59 57 A E E +G 64 0C 73 5,-0.3 2,-0.3 -2,-0.2 5,-0.2 -0.996 31.8 160.2-132.2 136.0 27.5 -47.7 -8.0 60 58 A R E > +G 63 0C 66 3,-3.0 3,-1.1 -2,-0.4 -2,-0.1 -0.927 69.0 3.4-153.7 134.1 29.6 -46.0 -5.3 61 59 A H T 3 S- 0 0 179 -2,-0.3 2,-0.5 1,-0.3 3,-0.1 0.887 128.1 -61.4 58.9 40.7 33.2 -44.7 -5.3 62 60 A G T 3 S+ 0 0 87 1,-0.2 -1,-0.3 -3,-0.0 2,-0.2 -0.047 122.4 96.4 77.8 -30.9 33.5 -45.8 -9.1 63 61 A K E < S-G 60 0C 60 -3,-1.1 -3,-3.0 -2,-0.5 -1,-0.2 -0.494 80.0-104.7 -92.4 154.0 32.9 -49.5 -8.1 64 62 A I E -G 59 0C 92 -5,-0.2 2,-0.4 -2,-0.2 -5,-0.3 -0.460 28.2-141.2 -81.5 150.1 29.5 -51.4 -8.1 65 63 A V E -G 58 0C 7 -7,-2.8 -7,-1.9 -2,-0.1 2,-0.3 -0.919 19.2-171.3-113.4 137.7 27.6 -52.2 -4.9 66 64 A R E -G 57 0C 155 -2,-0.4 2,-0.5 -9,-0.2 24,-0.5 -0.884 35.2-103.0-125.5 160.9 25.8 -55.5 -4.2 67 65 A I - 0 0 17 -11,-0.7 22,-0.2 -13,-0.5 3,-0.1 -0.734 36.1-159.2 -78.2 118.6 23.4 -57.1 -1.7 68 66 A T - 0 0 86 20,-2.7 2,-0.3 -2,-0.5 -1,-0.2 0.920 64.4 -11.7 -71.6 -48.7 25.8 -59.2 0.3 69 67 A E E -E 88 0B 95 19,-0.5 19,-2.9 2,-0.0 2,-0.3 -0.961 61.2-142.7-151.4 154.1 23.3 -61.7 1.8 70 68 A V E -E 87 0B 32 -2,-0.3 2,-0.4 17,-0.2 17,-0.2 -0.960 15.0-174.0-124.5 142.6 19.5 -62.0 2.1 71 69 A E E -E 86 0B 77 15,-1.9 15,-3.4 -2,-0.3 2,-0.4 -0.980 21.5-135.7-141.2 123.7 17.6 -63.3 5.2 72 70 A K E -E 85 0B 73 -2,-0.4 2,-0.3 13,-0.2 13,-0.2 -0.683 34.1-177.3 -78.5 127.9 13.8 -63.9 5.6 73 71 A V E -E 84 0B 26 11,-3.0 11,-2.3 -2,-0.4 2,-0.5 -0.960 25.1-136.7-131.1 149.3 12.7 -62.6 9.0 74 72 A Q E +E 83 0B 81 -2,-0.3 2,-0.2 9,-0.2 9,-0.2 -0.912 38.4 153.2-105.6 123.6 9.5 -62.6 11.0 75 73 A K E -E 82 0B 13 7,-3.2 7,-2.9 -2,-0.5 2,-0.4 -0.739 42.9 -98.6-136.5-176.2 8.7 -59.3 12.8 76 74 A K E +Ef 81 368B 79 291,-1.6 293,-3.2 5,-0.2 2,-0.3 -0.940 35.6 173.4-112.2 132.2 5.8 -57.1 14.1 77 75 A F E > S-E 80 0B 39 3,-3.0 3,-0.8 -2,-0.4 293,-0.1 -0.971 71.5 -6.8-142.8 125.3 4.4 -54.2 12.1 78 76 A L T 3 S- 0 0 110 -2,-0.3 -1,-0.1 291,-0.3 290,-0.0 0.925 130.8 -56.7 58.7 40.4 1.4 -52.1 13.0 79 77 A G T 3 S+ 0 0 25 1,-0.2 -1,-0.3 -3,-0.0 -3,-0.0 0.765 121.3 104.3 59.3 31.6 0.7 -54.6 15.8 80 78 A R E < S- E 0 77B 39 -3,-0.8 -3,-3.0 0, 0.0 -1,-0.2 -0.996 79.2-100.4-141.6 143.8 0.6 -57.5 13.2 81 79 A P E - E 0 76B 107 0, 0.0 2,-0.3 0, 0.0 -5,-0.2 -0.312 44.9-174.8 -62.8 142.4 3.1 -60.3 12.3 82 80 A I E - E 0 75B 26 -7,-2.9 -7,-3.2 2,-0.0 2,-0.6 -0.997 23.1-143.3-142.9 142.5 5.0 -59.5 9.1 83 81 A E E + E 0 74B 99 -2,-0.3 -39,-0.3 -9,-0.2 2,-0.3 -0.941 33.3 161.3-107.6 119.8 7.5 -61.3 6.9 84 82 A V E - E 0 73B 0 -11,-2.3 -11,-3.0 -2,-0.6 2,-0.5 -0.862 36.5-115.4-130.6 166.3 10.3 -59.1 5.5 85 83 A W E -CE 42 72B 31 -43,-2.4 -43,-2.3 -2,-0.3 2,-0.6 -0.938 17.2-141.5-110.6 125.5 13.7 -59.7 4.0 86 84 A K E -CE 41 71B 28 -15,-3.4 -15,-1.9 -2,-0.5 2,-0.6 -0.790 18.4-158.0 -82.5 117.6 16.9 -58.4 5.7 87 85 A L E -CE 40 70B 0 -47,-3.1 -47,-1.5 -2,-0.6 2,-0.2 -0.928 7.2-151.6-104.0 110.8 19.2 -57.2 2.9 88 86 A Y E -CE 39 69B 14 -19,-2.9 -20,-2.7 -2,-0.6 -19,-0.5 -0.598 10.9-166.5 -85.1 143.0 22.8 -57.1 4.0 89 87 A L - 0 0 0 -51,-2.5 -22,-0.1 -22,-0.2 -24,-0.0 -0.827 25.8-128.9-125.7 162.1 25.4 -54.7 2.5 90 88 A E S S+ 0 0 110 -24,-0.5 -1,-0.1 -2,-0.3 -23,-0.1 0.933 91.4 18.7 -74.5 -48.7 29.2 -54.5 2.6 91 89 A H S >> S- 0 0 7 -76,-0.1 3,-2.1 -54,-0.1 4,-0.5 -0.942 71.7-125.4-125.7 144.2 29.6 -50.8 3.7 92 90 A P T >4 S+ 0 0 16 0, 0.0 3,-1.2 0, 0.0 -1,-0.1 0.852 112.0 62.5 -59.7 -30.2 27.1 -48.3 5.3 93 91 A Q T 3> S+ 0 0 103 1,-0.3 4,-0.6 2,-0.2 -3,-0.0 0.659 91.8 68.3 -68.9 -11.8 27.7 -45.8 2.5 94 92 A D H <> S+ 0 0 4 -3,-2.1 4,-2.5 1,-0.2 3,-0.3 0.825 86.3 70.1 -69.9 -35.1 26.2 -48.6 0.2 95 93 A V H S+ 0 0 101 -4,-0.3 4,-2.6 2,-0.2 -1,-0.2 0.830 109.2 56.1 -72.2 -28.9 16.1 -46.3 -4.0 101 99 A K H > S+ 0 0 39 -3,-0.4 4,-0.8 -4,-0.2 -2,-0.2 0.939 112.7 42.9 -65.6 -40.8 17.1 -49.0 -6.5 102 100 A I H >< S+ 0 0 0 -4,-2.2 3,-1.1 1,-0.2 -2,-0.2 0.959 114.4 49.3 -69.3 -47.3 15.4 -51.6 -4.1 103 101 A R H 3< S+ 0 0 76 -4,-2.9 -2,-0.2 1,-0.2 -1,-0.2 0.870 106.5 57.6 -57.8 -40.9 12.4 -49.3 -3.4 104 102 A E H 3< S+ 0 0 82 -4,-2.6 -1,-0.2 -5,-0.1 -2,-0.2 0.709 81.6 112.5 -59.4 -31.2 11.9 -48.7 -7.3 105 103 A H S X< S- 0 0 43 -3,-1.1 3,-1.7 -4,-0.8 -52,-0.0 -0.208 72.3-131.8 -53.6 133.0 11.5 -52.5 -7.9 106 104 A P T 3 S+ 0 0 127 0, 0.0 -1,-0.1 0, 0.0 -3,-0.0 0.697 105.6 49.8 -59.0 -23.2 8.0 -53.6 -9.0 107 105 A A T 3 S+ 0 0 20 -58,-0.1 -62,-2.4 -63,-0.1 2,-0.6 0.431 89.0 94.0 -96.2 -2.9 8.0 -56.5 -6.5 108 106 A V E < -D 44 0B 14 -3,-1.7 -64,-0.2 -64,-0.2 3,-0.1 -0.840 49.9-173.7 -96.8 119.5 9.0 -54.4 -3.5 109 107 A V E - 0 0 93 -66,-3.0 2,-0.3 -2,-0.6 -1,-0.2 0.915 69.6 -29.8 -76.2 -46.0 6.0 -53.1 -1.5 110 108 A D E -D 43 0B 56 -67,-1.1 -67,-3.1 2,-0.0 -1,-0.4 -0.962 54.1-129.9-166.7 159.4 8.2 -51.0 0.8 111 109 A I E -D 42 0B 0 -2,-0.3 2,-0.3 -69,-0.2 -69,-0.2 -0.811 25.8-162.2-113.0 155.0 11.7 -50.7 2.4 112 110 A F E +D 41 0B 3 -71,-2.3 -71,-2.1 -2,-0.3 260,-0.1 -0.968 56.7 16.6-139.6 158.4 12.4 -50.1 6.1 113 111 A E S S+ 0 0 10 257,-0.4 3,-0.2 -2,-0.3 -74,-0.2 0.903 74.3 135.0 49.0 53.8 15.2 -49.0 8.5 114 112 A Y + 0 0 24 1,-0.1 -15,-0.1 -3,-0.1 -1,-0.1 0.313 61.0 52.1-111.4 0.7 17.3 -47.5 5.7 115 113 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23.1 -65.3 -32.3 15.2 -13.4 25.8 274 272 A T - 0 0 44 2,-0.1 2,-0.3 -3,-0.1 336,-0.1 -0.996 66.6-148.6-132.7 141.0 19.0 -13.6 25.1 275 273 A Y + 0 0 37 -2,-0.3 2,-0.2 -3,-0.1 -8,-0.1 -0.379 41.7 150.3-105.5 52.1 21.4 -16.4 25.6 276 274 A T > - 0 0 61 -2,-0.3 4,-2.5 1,-0.1 3,-0.3 -0.589 58.9-118.8 -75.5 146.7 24.5 -14.3 26.4 277 275 A L H > S+ 0 0 13 1,-0.2 4,-3.1 -2,-0.2 5,-0.2 0.903 116.4 54.4 -53.1 -41.0 26.9 -16.2 28.7 278 276 A E H > S+ 0 0 22 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.864 110.0 44.7 -58.0 -46.8 26.4 -13.3 31.3 279 277 A A H > S+ 0 0 31 -3,-0.3 4,-2.0 2,-0.2 -1,-0.2 0.907 116.0 47.5 -67.2 -41.7 22.5 -13.7 31.2 280 278 A V H X S+ 0 0 0 -4,-2.5 4,-2.2 2,-0.2 -2,-0.2 0.931 111.7 48.7 -65.4 -50.1 22.8 -17.5 31.5 281 279 A Y H X S+ 0 0 39 -4,-3.1 4,-2.9 1,-0.2 6,-0.5 0.929 113.6 47.6 -57.9 -46.6 25.4 -17.4 34.4 282 280 A E H X S+ 0 0 104 -4,-2.1 4,-1.5 1,-0.2 -1,-0.2 0.876 110.9 52.0 -63.0 -38.7 23.2 -14.9 36.3 283 281 A A H < S+ 0 0 54 -4,-2.0 -1,-0.2 2,-0.2 -2,-0.2 0.894 119.4 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156.1 32.2 -5.8 24.0 294 292 A A H 3> S+ 0 0 45 1,-0.2 4,-2.4 2,-0.2 -146,-0.3 0.844 118.0 54.1 -51.7 -42.6 34.2 -6.6 20.7 295 293 A H H 3> S+ 0 0 136 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.823 109.0 48.9 -63.7 -34.5 34.9 -2.9 20.0 296 294 A E H <> S+ 0 0 49 -3,-0.8 4,-2.3 2,-0.2 -1,-0.2 0.832 111.1 50.5 -70.7 -38.5 36.4 -2.4 23.6 297 295 A I H X S+ 0 0 9 -4,-1.7 4,-2.5 2,-0.2 -2,-0.2 0.914 111.4 48.2 -65.7 -44.5 38.6 -5.6 23.0 298 296 A A H X S+ 0 0 6 -4,-2.4 4,-2.7 2,-0.2 5,-0.2 0.935 112.7 48.3 -61.4 -47.8 39.8 -4.2 19.6 299 297 A E H X S+ 0 0 46 -4,-2.1 4,-2.5 1,-0.2 6,-0.3 0.919 113.5 46.6 -60.1 -47.5 40.6 -0.8 21.2 300 298 A A H X S+ 0 0 8 -4,-2.3 4,-2.1 1,-0.2 5,-0.2 0.891 115.5 45.9 -63.0 -43.5 42.5 -2.4 24.1 301 299 A W H < S+ 0 0 8 -4,-2.5 -2,-0.2 2,-0.2 -1,-0.2 0.917 117.6 42.3 -64.8 -46.9 44.5 -4.8 21.8 302 300 A E H < S+ 0 0 112 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.850 123.3 37.4 -70.4 -39.0 45.4 -2.1 19.3 303 301 A T H < S- 0 0 108 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.756 96.3-137.4 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38.3 -72.7 -51.1 26.1 -39.5 46.6 474 476 A E H > S+ 0 0 81 1,-0.2 4,-3.5 2,-0.2 5,-0.2 0.857 111.7 60.3 -69.9 -32.2 23.6 -42.1 45.1 475 477 A K H X S+ 0 0 27 -4,-1.9 4,-1.7 1,-0.2 -1,-0.2 0.871 106.4 47.9 -58.5 -40.0 20.6 -39.9 46.1 476 478 A K H X S+ 0 0 51 -4,-1.2 4,-1.5 2,-0.2 -1,-0.2 0.912 114.7 44.7 -65.3 -47.5 22.1 -37.2 43.8 477 479 A L H X S+ 0 0 58 -4,-1.6 4,-1.3 1,-0.2 3,-0.2 0.924 114.1 48.7 -66.0 -46.7 22.6 -39.6 40.9 478 480 A L H X S+ 0 0 11 -4,-3.5 4,-2.3 1,-0.2 5,-0.2 0.815 105.7 59.3 -63.3 -32.4 19.2 -41.2 41.4 479 481 A D H X S+ 0 0 59 -4,-1.7 4,-1.7 -5,-0.2 -1,-0.2 0.912 106.5 46.8 -63.5 -41.8 17.6 -37.7 41.5 480 482 A Y H X S+ 0 0 67 -4,-1.5 4,-2.0 -3,-0.2 -1,-0.2 0.784 111.9 53.5 -65.3 -33.0 19.0 -37.0 37.9 481 483 A R H X S+ 0 0 50 -4,-1.3 4,-1.7 2,-0.2 -2,-0.2 0.899 109.3 43.6 -72.0 -45.5 17.7 -40.4 36.8 482 484 A Q H X S+ 0 0 16 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.837 114.9 52.1 -70.3 -31.7 14.1 -39.9 37.9 483 485 A R H X S+ 0 0 101 -4,-1.7 4,-2.4 -5,-0.2 -2,-0.2 0.912 106.9 52.5 -67.4 -43.3 14.2 -36.4 36.4 484 486 A A H X S+ 0 0 2 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.877 109.7 49.3 -60.5 -39.3 15.5 -37.8 33.0 485 487 A I H X S+ 0 0 6 -4,-1.7 4,-3.4 2,-0.2 5,-0.3 0.933 109.4 51.9 -64.9 -45.8 12.6 -40.3 33.0 486 488 A K H X S+ 0 0 46 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.898 110.3 49.1 -57.3 -43.2 10.1 -37.4 33.7 487 489 A I H < S+ 0 0 57 -4,-2.4 4,-0.4 2,-0.2 -1,-0.2 0.940 116.2 41.7 -63.3 -47.7 11.6 -35.4 30.8 488 490 A L H >< S+ 0 0 2 -4,-2.2 3,-1.3 2,-0.2 4,-0.3 0.923 115.6 48.8 -66.7 -47.7 11.3 -38.3 28.4 489 491 A A H >< S+ 0 0 1 -4,-3.4 3,-1.3 1,-0.3 4,-0.4 0.892 109.7 52.0 -60.8 -40.4 7.8 -39.5 29.6 490 492 A N T 3< S+ 0 0 45 -4,-2.3 4,-0.4 -5,-0.3 -1,-0.3 0.543 102.2 62.9 -76.2 -3.3 6.4 -35.9 29.3 491 493 A S T <> S+ 0 0 16 -3,-1.3 4,-1.7 -4,-0.4 -1,-0.2 0.508 83.4 78.0 -93.8 -12.3 7.7 -35.7 25.7 492 494 A Y H <> S+ 0 0 2 -3,-1.3 4,-2.0 -4,-0.3 -1,-0.1 0.857 87.8 54.8 -66.6 -42.1 5.5 -38.5 24.3 493 495 A Y H > S+ 0 0 29 -4,-0.4 4,-0.6 1,-0.2 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