==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=1-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 25-JAN-07 2JEY . COMPND 2 MOLECULE: ACETYLCHOLINESTERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR F.EKSTROM,C.ASTOT,Y.P.PANG . 1068 4 6 4 2 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 35709.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 715 66.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 96 9.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 66 6.2 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 0.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 3 0.3 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 . 78 7.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 130 12.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 291 27.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 20 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 7 4 2 3 5 2 1 4 0 2 1 1 4 0 0 0 2 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 6 0 4 2 4 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 PARALLEL BRIDGES PER LADDER . 4 0 0 6 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 ANTIPARALLEL BRIDGES PER LADDER . 0 2 0 0 0 0 0 0 0 1 1 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 E 0 0 144 0, 0.0 2,-0.2 0, 0.0 4,-0.1 0.000 360.0 360.0 360.0 111.4 29.4 13.8 53.2 2 2 A G + 0 0 60 2,-0.2 0, 0.0 0, 0.0 0, 0.0 -0.565 360.0 39.7 133.0 -67.1 27.3 14.5 56.3 3 3 A R S S+ 0 0 239 -2,-0.2 2,-0.0 2,-0.1 0, 0.0 0.671 103.4 82.9 -87.4 -20.8 25.6 17.9 55.6 4 4 A E S S- 0 0 59 1,-0.1 -2,-0.2 2,-0.1 5,-0.1 -0.131 94.3 -64.8 -89.5-179.4 24.8 17.3 51.9 5 5 A D > - 0 0 40 1,-0.2 3,-2.5 3,-0.1 4,-0.2 -0.469 35.6-151.9 -78.9 111.1 22.1 15.5 49.9 6 6 A P G > S+ 0 0 99 0, 0.0 3,-0.8 0, 0.0 -1,-0.2 0.726 92.2 60.7 -53.5 -24.8 22.1 11.7 50.6 7 7 A Q G 3 S+ 0 0 78 1,-0.2 100,-0.3 3,-0.0 -2,-0.1 0.432 98.8 57.1 -85.9 2.5 20.6 11.0 47.2 8 8 A L G < S+ 0 0 16 -3,-2.5 11,-3.4 11,-0.1 2,-0.6 0.296 81.8 93.6-117.3 4.4 23.6 12.5 45.3 9 9 A L E < +A 18 0A 22 -3,-0.8 2,-0.4 -4,-0.2 9,-0.2 -0.915 47.7 162.1-107.5 117.1 26.4 10.5 46.7 10 10 A V E -A 17 0A 7 7,-2.6 7,-3.9 -2,-0.6 2,-0.4 -0.981 29.6-140.0-131.4 143.0 27.4 7.5 44.6 11 11 A R E -A 16 0A 154 -2,-0.4 2,-0.3 5,-0.3 5,-0.3 -0.861 22.3-177.0 -97.4 141.6 30.5 5.4 44.6 12 12 A V E > -A 15 0A 6 3,-4.0 3,-2.9 -2,-0.4 174,-0.1 -0.816 47.6 -87.0-124.0 174.2 31.8 4.2 41.2 13 13 A R T 3 S+ 0 0 155 1,-0.3 3,-0.1 -2,-0.3 169,-0.0 0.847 129.8 50.8 -50.8 -40.2 34.8 1.9 40.4 14 14 A G T 3 S- 0 0 8 1,-0.2 42,-2.7 22,-0.1 2,-0.3 0.555 124.1 -94.8 -72.5 -10.9 37.0 5.0 40.4 15 15 A G E < -A 12 0A 3 -3,-2.9 -3,-4.0 40,-0.2 2,-0.4 -0.937 67.2 -9.1 132.6-155.5 35.8 6.1 43.8 16 16 A Q E -Ab 11 59A 47 42,-0.9 44,-3.9 -2,-0.3 2,-0.4 -0.670 51.5-169.3 -94.4 132.3 33.2 8.4 45.3 17 17 A L E -Ab 10 60A 0 -7,-3.9 -7,-2.6 -2,-0.4 2,-0.6 -0.941 13.0-155.2-121.1 142.7 31.1 11.0 43.3 18 18 A R E -Ab 9 61A 63 42,-2.9 44,-3.1 -2,-0.4 -9,-0.2 -0.967 22.7-171.7-111.9 119.5 28.9 13.8 44.4 19 19 A G - 0 0 3 -11,-3.4 2,-0.4 -2,-0.6 13,-0.2 -0.171 18.6-106.3 -96.7-166.4 26.2 14.7 41.9 20 20 A I E -C 31 0B 52 11,-3.3 11,-1.2 42,-0.4 2,-0.7 -0.981 13.2-129.8-134.5 133.1 23.7 17.4 41.5 21 21 A R E -C 30 0B 129 -2,-0.4 2,-0.4 9,-0.2 9,-0.2 -0.740 36.5-165.4 -75.4 112.8 20.0 17.6 42.0 22 22 A L E -C 29 0B 26 7,-3.5 7,-3.1 -2,-0.7 2,-0.5 -0.883 18.2-122.0-104.2 142.1 18.9 19.3 38.8 23 23 A K E -C 28 0B 131 -2,-0.4 113,-0.1 5,-0.2 3,-0.1 -0.704 30.4-179.6 -74.9 121.1 15.5 20.8 38.2 24 24 A A E > -C 27 0B 0 3,-2.3 3,-3.0 -2,-0.5 430,-0.0 -0.889 44.1-103.8-110.0 155.1 13.6 19.4 35.2 25 25 A P T 3 S+ 0 0 54 0, 0.0 -1,-0.1 0, 0.0 429,-0.1 0.896 124.4 44.3 -34.6 -55.3 10.2 20.7 34.3 26 26 A G T 3 S- 0 0 52 1,-0.2 -3,-0.0 -3,-0.1 111,-0.0 0.432 130.3 -80.0 -79.6 3.5 8.5 17.6 35.8 27 27 A G E < S-C 24 0B 13 -3,-3.0 -3,-2.3 2,-0.0 -1,-0.2 -0.843 74.4 -11.4 126.6-165.2 10.7 17.7 38.9 28 28 A P E -C 23 0B 35 0, 0.0 77,-0.9 0, 0.0 2,-0.3 -0.291 45.1-169.3 -81.4 151.1 14.2 16.8 40.1 29 29 A V E -CD 22 104B 0 -7,-3.1 -7,-3.5 75,-0.2 2,-0.3 -0.982 23.7-123.7-128.4 149.0 16.9 14.7 38.4 30 30 A S E -CD 21 103B 0 73,-2.8 73,-2.1 -2,-0.3 2,-0.4 -0.677 33.2-171.9 -82.3 140.5 20.1 13.3 39.8 31 31 A A E -CD 20 102B 0 -11,-1.2 -11,-3.3 -2,-0.3 2,-0.5 -0.997 19.8-173.9-139.1 135.0 23.0 14.4 37.7 32 32 A F E - D 0 101B 0 69,-2.9 69,-2.3 -2,-0.4 3,-0.4 -0.856 22.8-176.2-129.5 93.5 26.6 13.3 37.8 33 33 A L E + 0 0 6 29,-2.8 31,-0.4 -2,-0.5 67,-0.2 -0.675 56.0 12.7-102.8 150.1 28.5 15.5 35.4 34 34 A G E S+ 0 0 1 -2,-0.3 -1,-0.2 1,-0.2 66,-0.2 0.914 71.9 171.7 54.9 47.6 32.1 15.3 34.4 35 35 A I E - D 0 99B 0 64,-3.6 64,-2.8 -3,-0.4 -1,-0.2 -0.798 35.6-121.9 -80.3 124.2 32.8 11.9 35.9 36 36 A P E + D 0 98B 2 0, 0.0 62,-0.2 0, 0.0 -22,-0.1 -0.450 38.0 168.9 -65.7 137.8 36.3 11.0 34.8 37 37 A F + 0 0 4 60,-1.9 16,-1.1 1,-0.3 2,-0.3 0.372 64.4 32.8-127.0 -3.2 36.4 7.7 32.9 38 38 A A B S-M 52 0C 1 59,-1.1 -1,-0.3 14,-0.3 15,-0.2 -0.988 89.2 -94.8-147.6 154.3 39.9 7.8 31.6 39 39 A E - 0 0 19 12,-2.4 12,-0.4 -2,-0.3 14,-0.1 -0.514 68.9 -86.1 -59.9 134.4 43.3 9.1 32.6 40 40 A P - 0 0 28 0, 0.0 2,-2.8 0, 0.0 55,-0.2 -0.268 37.6-131.4 -45.7 122.8 43.4 12.5 30.9 41 41 A P + 0 0 3 0, 0.0 6,-0.2 0, 0.0 2,-0.1 -0.268 64.7 132.2 -76.0 58.0 44.7 11.6 27.4 42 42 A V > - 0 0 62 -2,-2.8 3,-3.2 4,-0.1 4,-0.2 -0.416 52.7 -2.3-103.8 176.9 47.2 14.4 27.8 43 43 A G G > S+ 0 0 46 1,-0.3 3,-1.4 2,-0.2 0, 0.0 -0.155 136.9 4.4 51.4-118.8 50.9 14.9 27.2 44 44 A S G 3 S+ 0 0 82 1,-0.3 -1,-0.3 3,-0.1 224,-0.1 0.640 128.0 66.8 -70.9 -14.3 52.5 11.6 26.1 45 45 A R G X + 0 0 60 -3,-3.2 3,-1.6 -5,-0.1 -1,-0.3 0.409 69.9 123.2 -92.9 2.9 49.0 10.1 26.0 46 46 A R T < S+ 0 0 12 -3,-1.4 -4,-0.1 1,-0.3 222,-0.1 -0.384 84.4 9.6 -59.1 139.6 47.8 12.2 23.1 47 47 A F T 3 S+ 0 0 0 109,-0.7 122,-0.5 1,-0.2 -1,-0.3 0.312 107.3 120.8 70.7 -10.5 46.6 10.0 20.2 48 48 A M S < S- 0 0 34 -3,-1.6 -1,-0.2 119,-0.1 3,-0.1 -0.518 76.4 -93.1 -87.0 151.6 46.9 7.0 22.6 49 49 A P - 0 0 45 0, 0.0 -1,-0.1 0, 0.0 122,-0.1 -0.256 55.7 -96.3 -52.0 151.0 44.0 4.7 23.5 50 50 A P - 0 0 18 0, 0.0 -12,-0.0 0, 0.0 3,-0.0 -0.430 33.9-141.1 -69.4 148.9 42.4 5.9 26.7 51 51 A E - 0 0 76 -12,-0.4 -12,-2.4 -3,-0.1 3,-0.1 -0.906 34.6 -91.6-103.7 141.9 43.5 4.3 29.9 52 52 A P B -M 38 0C 89 0, 0.0 -14,-0.3 0, 0.0 2,-0.1 -0.201 53.4 -95.6 -47.2 138.5 40.9 3.5 32.5 53 53 A K - 0 0 55 -16,-1.1 3,-0.1 -15,-0.2 -14,-0.1 -0.439 39.9-121.1 -61.2 127.4 40.6 6.4 35.0 54 54 A R - 0 0 137 -2,-0.1 -1,-0.1 1,-0.1 -40,-0.1 -0.542 39.8 -95.1 -67.7 132.9 42.8 5.7 38.0 55 55 A P - 0 0 82 0, 0.0 2,-0.2 0, 0.0 -40,-0.2 -0.179 43.3-146.1 -50.2 142.6 40.7 5.7 41.2 56 56 A W - 0 0 46 -42,-2.7 2,-0.3 2,-0.1 -40,-0.2 -0.615 10.8-114.5-108.1 171.2 40.7 9.0 43.0 57 57 A S S S+ 0 0 115 -2,-0.2 -43,-0.0 -42,-0.1 -42,-0.0 -0.725 72.1 2.1-107.7 158.1 40.5 9.7 46.7 58 58 A G S S- 0 0 50 -2,-0.3 -42,-0.9 2,-0.1 2,-0.6 -0.151 110.4 -31.4 65.3-162.0 37.7 11.5 48.5 59 59 A V E -b 16 0A 45 -44,-0.1 2,-0.4 -42,-0.1 -42,-0.2 -0.807 57.1-141.0 -99.8 125.9 34.6 12.6 46.8 60 60 A L E -b 17 0A 33 -44,-3.9 -42,-2.9 -2,-0.6 2,-0.8 -0.675 21.3-122.7 -79.4 133.5 34.8 13.7 43.2 61 61 A D E +b 18 0A 76 -2,-0.4 3,-0.3 -44,-0.2 -42,-0.1 -0.715 36.5 169.9 -80.8 112.5 32.7 16.7 42.5 62 62 A A + 0 0 0 -44,-3.1 -29,-2.8 -2,-0.8 -42,-0.4 -0.344 44.8 105.6-113.1 46.5 30.4 15.6 39.6 63 63 A T S S+ 0 0 30 -31,-0.2 2,-0.3 -44,-0.2 -1,-0.1 0.653 75.5 41.8-105.9 -18.2 28.1 18.7 39.8 64 64 A T S S- 0 0 73 -31,-0.4 2,-0.1 -3,-0.3 -1,-0.0 -0.869 91.4 -94.1-127.1 161.2 29.3 20.5 36.7 65 65 A F - 0 0 27 -2,-0.3 3,-0.1 -32,-0.1 -32,-0.1 -0.436 43.0-128.0 -70.8 148.6 30.2 19.4 33.1 66 66 A Q - 0 0 60 1,-0.2 -32,-0.1 -2,-0.1 63,-0.1 -0.240 41.8 -56.1 -89.0-177.9 33.8 18.8 32.5 67 67 A N - 0 0 25 28,-0.3 2,-0.4 23,-0.1 31,-0.2 -0.158 51.7-121.5 -57.5 147.4 36.1 20.1 29.8 68 68 A V B -n 92 0D 0 23,-2.7 25,-3.1 -3,-0.1 3,-0.1 -0.771 38.3 -96.4 -88.4 140.9 35.2 19.6 26.2 69 69 A a - 0 0 1 -2,-0.4 25,-0.2 57,-0.3 57,-0.1 -0.235 54.7 -83.4 -61.6 144.9 37.7 17.7 24.1 70 70 A Y S S+ 0 0 46 23,-0.3 2,-0.3 22,-0.1 83,-0.3 -0.257 72.8 151.2 -60.5 130.1 40.1 20.0 22.2 71 71 A Q - 0 0 1 -3,-0.1 2,-0.3 83,-0.1 54,-0.1 -0.995 51.8 -86.4-158.4 156.5 38.3 21.0 19.0 72 72 A Y - 0 0 59 52,-0.8 2,-0.6 -2,-0.3 52,-0.0 -0.530 40.1-143.0 -61.3 127.4 37.8 23.4 16.2 73 73 A V - 0 0 54 -2,-0.3 2,-0.1 14,-0.1 14,-0.1 -0.895 20.7-122.1 -94.0 118.6 35.1 26.0 17.3 74 74 A D + 0 0 14 -2,-0.6 13,-0.1 9,-0.2 12,-0.1 -0.390 37.6 168.6 -64.3 132.1 32.9 26.9 14.3 75 75 A T + 0 0 85 -2,-0.1 -1,-0.1 3,-0.1 9,-0.0 0.136 40.7 108.9-133.2 21.1 33.1 30.6 13.6 76 76 A L S S+ 0 0 91 1,-0.3 -1,-0.1 7,-0.0 -2,-0.0 0.915 96.8 23.6 -66.8 -44.0 31.4 31.0 10.3 77 77 A Y S > S- 0 0 26 3,-0.1 3,-1.0 265,-0.0 -1,-0.3 -0.729 87.8-162.2-120.2 82.0 28.3 32.7 11.8 78 78 A P T 3 S+ 0 0 96 0, 0.0 3,-0.1 0, 0.0 -3,-0.1 -0.429 76.5 16.3 -66.2 133.5 29.6 34.1 15.2 79 79 A G T 3 S+ 0 0 64 1,-0.3 2,-0.2 -2,-0.1 -4,-0.0 -0.062 93.1 131.1 95.2 -29.2 26.8 34.9 17.6 80 80 A F X> - 0 0 27 -3,-1.0 4,-3.0 1,-0.2 3,-1.3 -0.395 54.3-147.7 -66.6 123.9 24.4 32.8 15.7 81 81 A E H 3> S+ 0 0 122 1,-0.3 4,-1.9 2,-0.2 -1,-0.2 0.724 94.0 66.3 -63.1 -24.1 22.4 30.4 17.9 82 82 A G H 34 S+ 0 0 0 1,-0.2 -1,-0.3 2,-0.2 -2,-0.1 0.721 117.2 24.3 -76.7 -22.1 22.3 27.9 15.1 83 83 A T H X> S+ 0 0 1 -3,-1.3 3,-1.5 -6,-0.3 4,-0.9 0.683 116.9 64.2-104.4 -30.8 26.0 27.4 15.2 84 84 A E H >< S+ 0 0 71 -4,-3.0 3,-1.7 1,-0.3 -3,-0.2 0.922 92.0 64.2 -58.5 -44.3 26.5 28.5 18.8 85 85 A M T 3< S+ 0 0 30 -4,-1.9 47,-0.4 1,-0.3 -1,-0.3 0.648 105.7 45.1 -58.2 -16.5 24.5 25.6 20.2 86 86 A W T <4 S+ 0 0 36 -3,-1.5 -1,-0.3 -5,-0.1 40,-0.3 0.640 92.4 101.6-100.3 -19.1 27.0 23.1 18.8 87 87 A N S << S- 0 0 14 -3,-1.7 -14,-0.1 -4,-0.9 40,-0.1 -0.293 91.1 -81.9 -68.9 149.6 30.1 25.0 20.0 88 88 A P - 0 0 25 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 -0.246 37.3-167.8 -55.0 135.1 31.9 23.9 23.1 89 89 A N + 0 0 46 -3,-0.1 2,-0.3 2,-0.1 -2,-0.1 0.147 69.5 47.4-112.3 12.3 30.2 25.2 26.2 90 90 A R S S- 0 0 112 1,-0.0 -23,-0.1 3,-0.0 -24,-0.1 -0.883 107.0 -60.6-139.0 173.3 33.0 24.3 28.5 91 91 A E - 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0 0 0 93,-0.3 93,-0.2 -3,-0.2 -1,-0.1 -0.972 48.8-177.4-164.4 153.8 24.7 9.0 10.9 231 231 A T - 0 0 0 -2,-0.3 -24,-0.3 2,-0.2 6,-0.2 -0.982 34.8-126.7-152.6 152.0 26.0 5.6 9.9 232 232 A P S S+ 0 0 0 0, 0.0 75,-0.2 0, 0.0 2,-0.1 0.872 99.7 62.2 -73.7 -31.0 29.4 3.9 10.1 233 233 A N S S+ 0 0 5 73,-0.2 -2,-0.2 171,-0.1 4,-0.2 -0.374 75.3 80.7 -80.0 171.2 29.2 3.2 6.4 234 234 A G S > S- 0 0 31 1,-0.1 4,-0.5 -2,-0.1 166,-0.1 -0.456 93.0 -71.5 107.7 169.1 29.1 6.1 3.9 235 235 A P T 4 S+ 0 0 36 0, 0.0 -1,-0.1 0, 0.0 165,-0.1 0.608 121.8 39.2 -80.0 -10.8 31.7 8.4 2.5 236 236 A W T 4 S+ 0 0 3 164,-0.2 55,-0.3 -3,-0.2 -2,-0.1 0.761 93.5 72.2-111.3 -28.2 32.5 10.4 5.6 237 237 A A T 4 S+ 0 0 0 -6,-0.2 2,-0.3 -4,-0.2 -4,-0.1 0.780 104.0 20.7 -71.9 -28.1 32.4 8.3 8.7 238 238 A T < - 0 0 24 -4,-0.5 2,-0.3 56,-0.1 58,-0.2 -0.819 60.3-151.5-128.5 174.4 35.7 6.4 8.0 239 239 A V B -p 296 0F 16 56,-1.6 58,-3.0 -2,-0.3 -3,-0.0 -0.957 29.9-103.6-135.0 159.5 38.9 6.7 6.1 240 240 A S > - 0 0 65 -2,-0.3 4,-2.6 56,-0.2 5,-0.1 -0.218 36.1-111.5 -64.0 168.4 41.3 4.0 4.8 241 241 A A H > S+ 0 0 35 56,-0.3 4,-3.7 2,-0.2 5,-0.2 0.890 120.7 54.1 -69.4 -39.8 44.4 3.5 6.7 242 242 A G H > S+ 0 0 49 2,-0.2 4,-3.2 1,-0.2 -1,-0.2 0.916 111.4 43.8 -62.1 -43.0 46.3 5.0 3.7 243 243 A E H > S+ 0 0 38 2,-0.2 4,-3.6 1,-0.2 5,-0.3 0.969 113.7 49.6 -69.7 -51.8 44.1 8.1 3.8 244 244 A A H X S+ 0 0 3 -4,-2.6 4,-3.0 2,-0.2 -84,-0.3 0.933 114.0 48.4 -46.0 -49.2 44.4 8.4 7.6 245 245 A R H X S+ 0 0 76 -4,-3.7 4,-3.9 1,-0.2 5,-0.2 0.959 112.0 47.2 -58.4 -52.3 48.1 8.0 7.2 246 246 A R H X S+ 0 0 85 -4,-3.2 4,-2.9 1,-0.2 -1,-0.2 0.903 115.9 45.7 -56.9 -43.0 48.3 10.6 4.5 247 247 A R H X S+ 0 0 13 -4,-3.6 4,-2.8 2,-0.2 -1,-0.2 0.872 114.1 47.7 -71.2 -37.0 46.2 13.0 6.5 248 248 A A H X S+ 0 0 0 -4,-3.0 4,-2.9 -88,-0.4 -2,-0.2 0.928 114.7 46.3 -69.7 -43.3 48.1 12.4 9.7 249 249 A T H X S+ 0 0 49 -4,-3.9 4,-3.1 -5,-0.3 -2,-0.2 0.938 114.4 46.4 -67.7 -40.3 51.3 12.8 7.9 250 250 A L H X S+ 0 0 47 -4,-2.9 4,-3.1 2,-0.2 -2,-0.2 0.938 111.5 51.3 -64.9 -43.5 50.2 16.0 6.1 251 251 A L H X S+ 0 0 0 -4,-2.8 4,-1.0 1,-0.2 -1,-0.2 0.956 111.4 50.0 -57.5 -47.5 48.8 17.4 9.3 252 252 A A H >X S+ 0 0 0 -4,-2.9 3,-1.6 1,-0.2 4,-0.5 0.951 109.9 49.4 -45.6 -57.9 52.2 16.6 10.8 253 253 A R H >< S+ 0 0 191 -4,-3.1 3,-2.7 1,-0.3 -2,-0.2 0.933 106.6 57.3 -47.4 -50.4 53.9 18.3 7.9 254 254 A L H 3< S+ 0 0 65 -4,-3.1 -1,-0.3 1,-0.3 -2,-0.2 0.625 114.0 36.9 -65.0 -21.1 51.6 21.3 8.4 255 255 A V H << S- 0 0 18 -3,-1.6 -1,-0.3 -4,-1.0 -2,-0.2 0.188 128.6 -95.7-108.7 7.7 52.8 21.7 12.0 256 256 A G << 0 0 44 -3,-2.7 -3,-0.2 -4,-0.5 -2,-0.1 0.993 360.0 360.0 79.2 74.8 56.4 20.7 11.2 257 257 A b 0 0 59 -8,-0.2 -4,-0.2 -5,-0.2 -5,-0.1 0.341 360.0 360.0-150.6 360.0 57.0 17.0 11.8 258 ! 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 0.0 259 265 A N > 0 0 144 0, 0.0 4,-1.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 119.1 59.3 6.5 11.2 260 266 A D H > + 0 0 40 2,-0.2 4,-3.0 1,-0.1 5,-0.3 0.852 360.0 60.9 -79.3 -37.9 56.0 7.0 13.0 261 267 A T H > S+ 0 0 62 1,-0.2 4,-4.1 2,-0.2 5,-0.3 0.961 105.6 46.4 -53.1 -59.6 57.3 7.4 16.6 262 268 A E H > S+ 0 0 151 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.878 115.5 48.0 -47.0 -47.1 59.3 10.6 15.7 263 269 A L H X S+ 0 0 25 -4,-1.0 4,-2.7 2,-0.2 3,-0.3 0.964 116.8 39.6 -62.9 -57.2 56.4 12.0 13.9 264 270 A I H X S+ 0 0 0 -4,-3.0 4,-2.9 1,-0.2 5,-0.2 0.916 112.5 57.6 -58.9 -44.3 53.8 11.3 16.6 265 271 A A H < S+ 0 0 30 -4,-4.1 4,-0.3 -5,-0.3 -1,-0.2 0.865 109.6 45.9 -55.8 -34.3 56.3 12.3 19.2 266 272 A b H >X S+ 0 0 24 -4,-1.6 3,-2.7 -3,-0.3 4,-1.2 0.964 109.1 53.6 -74.7 -49.4 56.5 15.6 17.4 267 273 A L H >< S+ 0 0 0 -4,-2.7 3,-0.6 1,-0.3 -2,-0.2 0.842 105.0 57.2 -49.0 -38.2 52.8 15.9 17.1 268 274 A R T 3< S+ 0 0 61 -4,-2.9 -1,-0.3 1,-0.3 -2,-0.2 0.626 103.3 52.8 -74.3 -11.6 52.6 15.3 20.9 269 275 A T T <4 S+ 0 0 93 -3,-2.7 -1,-0.3 -4,-0.3 -2,-0.2 0.686 90.8 96.1 -93.4 -18.1 54.8 18.3 21.4 270 276 A R S << S- 0 0 62 -4,-1.2 2,-0.1 -3,-0.6 5,-0.0 -0.434 86.6-106.2 -70.5 142.9 52.6 20.5 19.4 271 277 A P >> - 0 0 69 0, 0.0 4,-1.4 0, 0.0 3,-0.8 -0.436 27.4-117.5 -66.5 141.9 50.0 22.6 21.2 272 278 A A H >> S+ 0 0 14 1,-0.3 4,-2.3 2,-0.2 3,-0.6 0.882 114.2 54.5 -41.3 -50.3 46.4 21.3 20.9 273 279 A Q H 3> S+ 0 0 67 1,-0.3 4,-3.9 2,-0.2 -1,-0.3 0.855 102.1 57.2 -58.0 -41.5 45.3 24.5 19.2 274 280 A D H <> S+ 0 0 63 -3,-0.8 4,-0.8 1,-0.2 -1,-0.3 0.874 107.9 46.6 -58.4 -40.4 47.9 24.1 16.6 275 281 A L H XX S+ 0 0 0 -4,-1.4 4,-1.3 -3,-0.6 3,-0.9 0.928 113.9 47.8 -70.4 -43.4 46.7 20.8 15.6 276 282 A V H >X S+ 0 0 2 -4,-2.3 3,-1.7 1,-0.3 4,-0.7 0.977 104.9 59.6 -59.5 -55.8 43.2 22.0 15.5 277 283 A D H 3< S+ 0 0 86 -4,-3.9 -1,-0.3 1,-0.3 -2,-0.2 0.704 119.2 30.6 -42.8 -27.2 44.2 25.0 13.5 278 284 A H H < S+ 0 0 105 -4,-0.7 3,-1.3 1,-0.2 -1,-0.3 0.815 95.8 70.3 -77.6 -30.1 41.0 20.9 8.4 281 287 A H G 34 S+ 0 0 140 -3,-0.3 -1,-0.2 1,-0.2 -2,-0.2 0.811 87.7 70.9 -54.6 -19.1 43.8 21.8 5.9 282 288 A V G << + 0 0 0 -3,-1.0 -1,-0.2 -4,-0.8 -2,-0.1 0.399 65.2 118.6 -84.6 11.4 44.4 18.0 5.4 283 289 A L < - 0 0 19 -3,-1.3 9,-0.1 1,-0.1 4,-0.0 -0.640 64.5-134.8 -83.4 133.9 41.3 17.2 3.4 284 290 A P S S+ 0 0 48 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.688 81.7 14.8 -57.8 -28.7 42.0 15.9 -0.1 285 291 A Q S S- 0 0 73 74,-0.1 2,-0.6 0, 0.0 78,-0.1 -0.889 94.9 -81.1-137.6 169.0 39.3 18.0 -1.8 286 292 A E S S+ 0 0 133 -2,-0.3 2,-0.3 76,-0.1 50,-0.1 -0.682 71.9 170.9 -65.0 117.7 37.1 21.0 -1.2 287 293 A S - 0 0 13 -2,-0.6 2,-0.3 3,-0.1 73,-0.2 -0.952 38.5-158.0-133.3 151.9 34.5 19.1 0.7 288 294 A I S S+ 0 0 8 71,-1.2 3,-0.1 -2,-0.3 45,-0.1 -0.885 89.4 20.6-112.2 159.2 31.4 19.5 2.8 289 295 A F S S+ 0 0 5 -2,-0.3 2,-0.4 1,-0.2 -1,-0.1 0.844 98.8 114.0 53.6 32.3 30.4 16.7 5.1 290 296 A R - 0 0 10 -3,-0.2 2,-0.4 -53,-0.0 -1,-0.2 -0.994 48.9-165.0-124.8 137.1 34.0 15.5 5.0 291 297 A F - 0 0 17 -2,-0.4 3,-0.2 -55,-0.3 -169,-0.1 -0.971 19.8-132.6-129.3 145.8 36.0 15.6 8.1 292 298 A S S S+ 0 0 4 -2,-0.4 2,-0.6 1,-0.2 -1,-0.1 0.860 91.4 33.0 -68.1 -47.5 39.7 15.3 8.5 293 299 A F S S+ 0 0 4 -171,-0.1 -139,-0.4 -134,-0.1 -1,-0.2 -0.925 75.5 141.4-122.5 104.8 40.1 12.8 11.2 294 300 A V - 0 0 1 -2,-0.6 -124,-0.2 -136,-0.3 -55,-0.1 -0.758 61.7 -49.3-130.8 169.7 37.5 10.3 11.5 295 301 A P - 0 0 0 0, 0.0 -56,-1.6 0, 0.0 2,-0.4 -0.158 58.5-140.9 -40.3 133.9 37.5 6.6 12.4 296 302 A V B -p 239 0F 0 -58,-0.2 2,-1.4 -128,-0.1 6,-0.4 -0.862 16.8-120.2-100.2 137.2 40.1 4.7 10.4 297 303 A V + 0 0 23 -58,-3.0 -56,-0.3 -2,-0.4 8,-0.1 -0.703 48.1 164.9 -67.5 95.1 39.5 1.3 9.0 298 304 A D - 0 0 39 -2,-1.4 -1,-0.2 6,-0.1 5,-0.1 0.448 51.9-119.2 -95.7 -8.9 42.4 -0.0 11.0 299 305 A G S S+ 0 0 50 3,-1.8 4,-0.3 5,-0.1 -2,-0.1 0.879 104.6 64.4 60.3 35.3 41.6 -3.7 10.7 300 306 A D S S+ 0 0 122 2,-0.7 3,-0.2 4,-0.1 -1,-0.1 0.154 110.2 20.6-143.3 -83.6 41.4 -3.7 14.5 301 307 A F S S+ 0 0 5 1,-0.3 2,-0.8 -132,-0.1 -85,-0.2 0.975 142.2 34.0 -55.5 -52.9 38.6 -1.5 15.8 302 308 A L S S- 0 0 0 -6,-0.4 -3,-1.8 1,-0.2 -2,-0.7 -0.914 80.2-162.0-104.9 108.5 37.0 -1.8 12.4 303 309 A S S S- 0 0 81 -2,-0.8 2,-0.2 -89,-0.4 -1,-0.2 0.857 75.7 -14.0 -58.9 -35.2 38.0 -5.3 11.2 304 310 A D S S- 0 0 80 -3,-0.1 -6,-0.1 -4,-0.1 -5,-0.1 -0.784 105.4 -48.5-149.3-176.0 37.2 -4.2 7.7 305 311 A T > - 0 0 55 -2,-0.2 4,-2.7 1,-0.1 3,-0.4 -0.453 52.0-120.5 -61.8 139.9 35.4 -1.3 6.0 306 312 A P H > S+ 0 0 3 0, 0.0 4,-2.5 0, 0.0 5,-0.3 0.817 115.8 62.6 -47.1 -36.1 32.0 -0.6 7.6 307 313 A E H > S+ 0 0 95 2,-0.2 4,-2.6 1,-0.2 5,-0.1 0.961 109.3 38.9 -53.2 -53.8 30.6 -1.3 4.1 308 314 A A H > S+ 0 0 20 -3,-0.4 4,-2.2 1,-0.2 5,-0.4 0.952 113.1 55.5 -62.5 -52.4 32.0 -4.9 4.3 309 315 A L H X S+ 0 0 19 -4,-2.7 4,-1.6 1,-0.2 -1,-0.2 0.817 113.7 40.1 -55.8 -36.3 31.1 -5.3 7.9 310 316 A I H < S+ 0 0 0 -4,-2.5 -1,-0.2 -5,-0.2 -2,-0.2 0.924 113.5 54.9 -77.9 -41.2 27.4 -4.5 7.3 311 317 A N H < S+ 0 0 42 -4,-2.6 -2,-0.2 -5,-0.3 -1,-0.2 0.815 127.6 16.4 -55.5 -32.9 27.3 -6.4 4.0 312 318 A T H < S+ 0 0 109 -4,-2.2 -3,-0.2 -5,-0.1 -2,-0.2 0.776 99.2 90.9-119.0 -41.5 28.6 -9.6 5.7 313 319 A G < - 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