==== 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 HYDROLASE 14-OCT-05 2BAG . COMPND 2 MOLECULE: ACETYLCHOLINESTERASE; . SOURCE 2 ORGANISM_SCIENTIFIC: TORPEDO CALIFORNICA; . AUTHOR D.LAMBA,C.BARTOLUCCI,M.SIOTTO,M.RACCHI,G.VILLETTI,M.DELCANAL . 532 1 3 3 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20215.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 336 63.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 47 8.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 28 5.3 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 . 3 0.6 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 . 30 5.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 60 11.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 146 27.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 9 1.7 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 1 0 4 2 0 1 3 1 0 1 0 2 0 0 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 1 2 2 1 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 PARALLEL BRIDGES PER LADDER . 1 0 2 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 ANTIPARALLEL BRIDGES PER LADDER . 1 1 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 S > 0 0 115 0, 0.0 3,-2.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 133.3 -12.2 87.9 35.4 2 5 A E T 3 + 0 0 52 1,-0.3 23,-0.1 3,-0.0 12,-0.0 0.746 360.0 51.5 -58.2 -24.8 -8.8 86.9 36.9 3 6 A L T 3 S+ 0 0 38 11,-0.1 11,-3.4 10,-0.1 2,-0.5 0.329 95.6 82.8 -96.4 7.0 -10.6 85.4 39.9 4 7 A L E < +A 13 0A 61 -3,-2.1 2,-0.4 9,-0.2 9,-0.2 -0.943 54.3 174.5-116.1 126.1 -12.9 83.2 37.8 5 8 A V E -A 12 0A 2 7,-2.7 7,-3.1 -2,-0.5 2,-0.7 -0.995 22.6-145.5-133.4 136.2 -11.7 79.9 36.4 6 9 A N E +A 11 0A 99 -2,-0.4 5,-0.2 5,-0.2 2,-0.2 -0.893 26.6 177.5-101.6 117.6 -13.7 77.3 34.5 7 10 A T E > -A 10 0A 7 3,-2.3 3,-1.1 -2,-0.7 173,-0.1 -0.620 46.9 -99.5-111.2 174.6 -12.5 73.8 35.3 8 11 A K T 3 S+ 0 0 122 1,-0.3 3,-0.1 -2,-0.2 172,-0.0 0.580 124.9 51.6 -69.7 -9.4 -13.8 70.4 34.2 9 12 A S T 3 S- 0 0 15 1,-0.5 42,-2.9 41,-0.1 -1,-0.3 0.539 127.1 -77.8-102.9 -9.2 -15.7 70.2 37.4 10 13 A G E < -A 7 0A 12 -3,-1.1 -3,-2.3 40,-0.2 -1,-0.5 -0.796 64.9 -43.5 137.2-179.6 -17.4 73.6 37.1 11 14 A K E -Ab 6 54A 93 42,-1.0 44,-2.9 40,-0.3 2,-0.4 -0.547 49.3-161.2 -83.1 147.5 -16.6 77.3 37.5 12 15 A V E -Ab 5 55A 0 -7,-3.1 -7,-2.7 42,-0.2 2,-0.5 -0.981 7.5-151.7-131.2 143.2 -14.7 78.5 40.5 13 16 A M E -Ab 4 56A 77 42,-3.0 44,-2.6 -2,-0.4 -9,-0.2 -0.948 17.2-170.8-117.0 117.3 -14.4 82.0 42.0 14 17 A G - 0 0 6 -11,-3.4 2,-0.3 -2,-0.5 13,-0.2 0.036 15.9-122.5 -88.3-161.0 -11.3 83.0 43.9 15 18 A T E -C 26 0B 41 11,-1.8 11,-2.2 42,-0.2 2,-0.4 -0.984 19.9-116.1-145.4 145.8 -10.4 86.0 46.0 16 19 A R E -C 25 0B 114 -2,-0.3 9,-0.2 9,-0.2 7,-0.0 -0.723 35.4-168.1 -85.2 132.6 -7.6 88.5 45.7 17 20 A V E -C 24 0B 25 7,-3.0 7,-2.1 -2,-0.4 2,-0.1 -0.969 18.7-123.2-125.9 141.3 -5.2 88.4 48.7 18 21 A P E +C 23 0B 77 0, 0.0 2,-0.3 0, 0.0 5,-0.3 -0.507 30.9 175.8 -79.4 152.2 -2.5 90.8 49.7 19 22 A V E > -C 22 0B 2 3,-1.9 3,-1.3 -2,-0.1 -2,-0.0 -0.893 65.4 -19.9-159.2 125.0 1.1 89.5 50.1 20 23 A L T 3 S- 0 0 46 -2,-0.3 3,-0.1 1,-0.3 430,-0.0 0.872 128.7 -49.1 36.0 54.3 4.3 91.4 50.8 21 24 A S T 3 S+ 0 0 129 1,-0.2 -1,-0.3 0, 0.0 2,-0.2 0.794 131.0 72.8 57.4 36.4 2.6 94.6 49.7 22 25 A S E < S-C 19 0B 39 -3,-1.3 -3,-1.9 -5,-0.0 2,-0.3 -0.706 74.9-116.8-149.2-161.1 1.3 93.2 46.4 23 26 A H E +C 18 0B 78 -5,-0.3 77,-0.4 -2,-0.2 2,-0.3 -0.997 22.8 174.6-152.9 154.8 -1.5 90.7 45.5 24 27 A I E -C 17 0B 1 -7,-2.1 -7,-3.0 -2,-0.3 2,-0.3 -0.880 37.1 -95.5-146.7 174.5 -2.2 87.3 44.0 25 28 A S E -CD 16 98B 0 73,-2.6 73,-2.5 -2,-0.3 2,-0.4 -0.705 30.2-163.9 -98.2 151.5 -5.3 85.2 43.6 26 29 A A E -CD 15 97B 0 -11,-2.2 -11,-1.8 -2,-0.3 2,-0.7 -0.997 9.6-167.4-136.7 129.6 -6.3 82.4 45.9 27 30 A F E - D 0 96B 1 69,-3.3 69,-2.8 -2,-0.4 2,-0.3 -0.940 23.9-175.2-116.4 104.3 -8.8 79.7 45.2 28 31 A L E + 0 0 16 29,-2.3 31,-0.5 -2,-0.7 67,-0.2 -0.799 52.6 15.1-108.0 145.4 -9.6 78.1 48.5 29 32 A G E + 0 0 6 -2,-0.3 -1,-0.2 65,-0.2 66,-0.2 0.871 68.8 171.6 68.9 40.0 -11.7 75.1 49.4 30 33 A I E - D 0 94B 0 64,-2.7 64,-2.2 -3,-0.3 2,-0.2 -0.713 30.8-129.7 -82.6 125.3 -12.1 73.6 46.0 31 34 A P E + D 0 93B 1 0, 0.0 62,-0.2 0, 0.0 3,-0.1 -0.556 32.8 169.8 -76.2 135.6 -13.7 70.1 46.3 32 35 A F + 0 0 2 60,-1.5 16,-0.9 -2,-0.2 2,-0.3 0.379 65.2 34.4-123.3 -0.7 -11.9 67.3 44.5 33 36 A A B S-M 47 0C 3 59,-0.8 -1,-0.2 14,-0.3 59,-0.1 -0.985 89.5 -94.5-148.9 156.5 -13.9 64.3 45.9 34 37 A E - 0 0 39 12,-2.9 12,-0.4 -2,-0.3 14,-0.1 -0.439 63.9 -86.3 -66.3 145.4 -17.4 63.5 47.0 35 38 A P - 0 0 25 0, 0.0 2,-2.5 0, 0.0 55,-0.2 -0.383 37.6-133.8 -56.6 121.7 -17.6 64.0 50.8 36 39 A P + 0 0 3 0, 0.0 6,-0.2 0, 0.0 2,-0.2 -0.226 59.7 135.0 -75.3 56.0 -16.4 60.7 52.3 37 40 A V > - 0 0 56 -2,-2.5 3,-1.9 3,-0.1 2,-0.1 -0.573 51.0 -4.4-107.3 165.7 -19.3 60.6 54.8 38 41 A G G > S+ 0 0 45 1,-0.3 3,-1.8 -2,-0.2 0, 0.0 -0.370 134.2 4.5 61.6-126.7 -21.9 58.1 56.0 39 42 A N G 3 S+ 0 0 120 1,-0.3 -1,-0.3 -2,-0.1 -2,-0.0 0.541 127.6 67.4 -68.5 -7.8 -21.6 54.7 54.2 40 43 A M G X + 0 0 44 -3,-1.9 3,-2.1 -5,-0.1 -1,-0.3 0.549 69.8 121.2 -89.3 -7.4 -18.6 56.1 52.4 41 44 A R T < S+ 0 0 11 -3,-1.8 3,-0.1 1,-0.3 -4,-0.1 -0.360 85.1 10.9 -60.0 130.3 -16.4 56.3 55.6 42 45 A F T 3 S+ 0 0 2 108,-0.6 121,-0.5 1,-0.3 -1,-0.3 0.254 107.8 122.8 83.3 -9.6 -13.2 54.1 55.2 43 46 A R S < S- 0 0 102 -3,-2.1 -1,-0.3 118,-0.2 117,-0.1 -0.428 75.8 -92.7 -84.2 156.2 -14.1 53.8 51.6 44 47 A R - 0 0 86 115,-0.4 -1,-0.1 -2,-0.1 121,-0.1 -0.323 56.6 -99.8 -58.8 147.6 -12.0 54.8 48.6 45 48 A P - 0 0 23 0, 0.0 -1,-0.1 0, 0.0 -12,-0.0 -0.338 30.9-137.4 -72.7 158.5 -12.8 58.4 47.6 46 49 A E - 0 0 93 -12,-0.4 -12,-2.9 -3,-0.1 3,-0.1 -0.899 28.7 -98.0-115.1 145.7 -15.1 59.2 44.7 47 50 A P B -M 33 0C 82 0, 0.0 2,-0.3 0, 0.0 -14,-0.3 -0.286 48.8 -97.3 -57.7 140.8 -14.5 61.9 42.1 48 51 A K - 0 0 41 -16,-0.9 3,-0.1 -15,-0.1 -14,-0.0 -0.480 37.6-120.5 -66.8 121.7 -16.4 65.1 42.8 49 52 A K - 0 0 104 -2,-0.3 -1,-0.1 1,-0.1 -16,-0.1 -0.421 40.1-102.3 -60.0 128.9 -19.6 65.2 40.8 50 53 A P - 0 0 95 0, 0.0 2,-0.3 0, 0.0 -40,-0.2 -0.140 39.3-141.6 -53.1 152.8 -19.4 68.3 38.6 51 54 A W - 0 0 36 -42,-2.9 -40,-0.3 2,-0.1 2,-0.2 -0.898 2.8-134.0-122.4 149.9 -21.4 71.4 39.8 52 55 A S S S+ 0 0 120 -2,-0.3 2,-0.1 -42,-0.1 -43,-0.0 -0.590 73.2 26.8 -92.4 161.0 -23.4 74.0 37.9 53 56 A G S S- 0 0 48 -2,-0.2 -42,-1.0 2,-0.1 2,-0.5 -0.303 105.8 -46.4 83.0-171.7 -23.0 77.6 38.9 54 57 A V E -b 11 0A 79 -44,-0.1 2,-0.5 -2,-0.1 -42,-0.2 -0.897 48.0-136.5-108.2 122.4 -19.9 79.2 40.5 55 58 A W E -b 12 0A 67 -44,-2.9 -42,-3.0 -2,-0.5 2,-0.8 -0.633 20.9-129.2 -78.0 123.8 -18.1 77.6 43.4 56 59 A N E +b 13 0A 109 -2,-0.5 3,-0.3 -44,-0.2 -42,-0.1 -0.645 34.3 171.0 -75.9 109.5 -17.2 80.1 46.0 57 60 A A + 0 0 0 -44,-2.6 -29,-2.3 -2,-0.8 -42,-0.2 -0.399 42.0 107.6-115.7 53.6 -13.5 79.5 46.7 58 61 A S S S+ 0 0 38 -31,-0.2 2,-0.3 -44,-0.2 -1,-0.2 0.589 73.0 48.4-106.5 -11.8 -12.8 82.5 48.8 59 62 A T S S- 0 0 91 -31,-0.5 -1,-0.1 -3,-0.3 -44,-0.0 -0.936 88.6 -92.6-132.4 154.5 -12.4 80.8 52.2 60 63 A Y - 0 0 38 -2,-0.3 3,-0.1 1,-0.1 -2,-0.1 -0.245 41.7-123.4 -61.4 143.8 -10.6 77.8 53.7 61 64 A P - 0 0 14 0, 0.0 -1,-0.1 0, 0.0 30,-0.1 -0.177 37.7 -79.2 -78.6 177.7 -12.4 74.5 53.8 62 65 A N - 0 0 56 28,-0.3 2,-0.3 23,-0.1 25,-0.2 -0.238 46.7-117.9 -68.4 165.7 -13.0 72.4 56.9 63 66 A N B -n 87 0D 4 23,-2.2 25,-2.3 1,-0.1 27,-0.1 -0.801 35.4 -97.2-104.0 151.7 -10.1 70.3 58.3 64 67 A a - 0 0 3 56,-0.3 25,-0.2 -2,-0.3 2,-0.2 -0.270 50.5 -85.9 -66.1 156.1 -10.5 66.5 58.4 65 68 A Q + 0 0 31 23,-0.4 82,-0.4 22,-0.1 2,-0.3 -0.440 68.2 152.3 -63.7 132.1 -11.5 64.9 61.7 66 69 A Q - 0 0 3 -2,-0.2 53,-0.2 -3,-0.1 206,-0.0 -0.996 51.1 -83.7-161.7 156.6 -8.4 64.4 63.9 67 70 A Y - 0 0 85 51,-0.9 2,-0.5 -2,-0.3 206,-0.0 -0.282 47.9-140.3 -55.8 148.2 -6.9 64.1 67.4 68 71 A V - 0 0 42 14,-0.1 2,-0.3 51,-0.1 -1,-0.1 -0.980 9.5-123.1-124.7 125.2 -6.2 67.6 68.7 69 72 A D + 0 0 28 -2,-0.5 13,-0.1 9,-0.2 12,-0.0 -0.479 37.7 161.4 -67.0 123.0 -3.1 68.4 70.7 70 73 A E + 0 0 143 -2,-0.3 -1,-0.1 3,-0.1 9,-0.0 0.120 39.3 112.1-128.2 16.2 -4.0 69.9 74.1 71 74 A Q S S+ 0 0 106 1,-0.3 -1,-0.1 7,-0.0 -2,-0.0 0.870 91.1 23.9 -58.7 -39.2 -0.7 69.3 75.9 72 75 A F S > S- 0 0 38 3,-0.1 3,-2.6 -3,-0.0 -1,-0.3 -0.593 84.9-153.0-131.9 73.1 0.0 73.1 76.1 73 76 A P T 3 S+ 0 0 102 0, 0.0 3,-0.1 0, 0.0 -3,-0.1 -0.146 82.6 7.0 -47.5 126.2 -3.3 75.1 75.9 74 77 A G T 3 S+ 0 0 63 1,-0.3 2,-0.5 2,-0.1 3,-0.0 0.255 95.2 129.6 83.0 -14.3 -2.7 78.5 74.5 75 78 A F X> - 0 0 42 -3,-2.6 4,-2.2 1,-0.2 3,-0.6 -0.623 49.8-153.9 -77.2 123.4 0.9 77.7 73.6 76 79 A S H 3> S+ 0 0 65 -2,-0.5 4,-2.1 1,-0.2 5,-0.2 0.830 86.3 72.3 -67.6 -30.7 1.5 78.7 70.0 77 80 A G H 34 S+ 0 0 0 1,-0.2 -1,-0.2 2,-0.2 352,-0.1 0.861 114.8 22.5 -52.5 -39.1 4.3 76.2 69.6 78 81 A S H X4 S+ 0 0 1 -3,-0.6 3,-1.2 -6,-0.3 4,-0.4 0.787 119.6 58.1 -99.1 -34.6 1.8 73.3 69.6 79 82 A E H >< S+ 0 0 79 -4,-2.2 3,-0.7 -7,-0.3 -3,-0.2 0.730 89.6 72.2 -72.5 -18.9 -1.4 75.0 68.6 80 83 A M T 3< S+ 0 0 51 -4,-2.1 46,-0.3 1,-0.2 45,-0.3 0.714 100.2 50.2 -65.7 -16.9 -0.0 76.3 65.3 81 84 A W T < S+ 0 0 53 -3,-1.2 -1,-0.2 -5,-0.2 -2,-0.2 0.656 94.1 93.2 -92.7 -19.5 -0.2 72.6 64.2 82 85 A N S < S- 0 0 22 -3,-0.7 -14,-0.1 -4,-0.4 2,-0.1 -0.236 94.7 -80.0 -73.2 161.6 -3.8 72.0 65.3 83 86 A P - 0 0 25 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 -0.412 37.1-168.7 -60.2 132.8 -6.8 72.4 63.0 84 87 A N + 0 0 66 2,-0.1 2,-0.3 -3,-0.1 -2,-0.0 0.127 69.8 61.5-109.9 16.9 -7.7 76.1 62.7 85 88 A R S S- 0 0 108 1,-0.0 -23,-0.1 0, 0.0 -22,-0.0 -0.892 103.8 -80.3-133.9 164.6 -11.0 75.3 61.0 86 89 A E - 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0 0 34 -3,-0.9 9,-0.1 1,-0.1 -3,-0.0 -0.354 61.2-140.4 -59.4 139.4 -0.8 50.5 69.4 280 283 A P S S+ 0 0 54 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.808 78.4 37.4 -74.4 -28.1 0.9 47.2 70.1 281 284 A F S S- 0 0 106 74,-0.0 2,-0.9 3,-0.0 78,-0.1 -0.821 87.1-104.8-124.5 164.3 3.7 48.6 72.2 282 285 A D S S+ 0 0 133 -2,-0.3 2,-0.3 76,-0.1 0, 0.0 -0.771 73.7 151.0 -80.0 110.3 4.4 51.3 74.7 283 286 A S - 0 0 19 -2,-0.9 2,-0.4 3,-0.1 3,-0.2 -0.906 50.4-135.7-147.3 173.5 6.1 53.5 72.2 284 287 A I S S+ 0 0 18 71,-1.6 3,-0.1 -2,-0.3 45,-0.1 -0.950 88.8 20.6-130.4 144.6 7.1 56.9 70.9 285 288 A F S S+ 0 0 6 -2,-0.4 2,-0.4 1,-0.2 -1,-0.2 0.882 93.2 118.4 63.8 38.7 6.9 57.9 67.2 286 289 A R - 0 0 32 -3,-0.2 2,-0.4 -5,-0.1 -1,-0.2 -0.998 45.6-161.5-135.5 135.8 4.3 55.2 66.4 287 290 A F - 0 0 12 -2,-0.4 3,-0.2 -57,-0.4 -11,-0.0 -0.919 18.7-130.3-123.4 146.5 0.9 56.0 65.1 288 291 A S S S+ 0 0 1 -2,-0.4 2,-0.7 1,-0.2 -1,-0.1 0.929 90.1 35.0 -62.3 -55.8 -2.3 53.9 65.0 289 292 A F S S+ 0 0 5 -136,-0.1 -141,-0.4 -48,-0.0 -1,-0.2 -0.879 74.5 140.4-114.1 107.2 -3.6 54.1 61.5 290 293 A V - 0 0 3 -2,-0.7 -126,-0.2 -138,-0.3 -58,-0.1 -0.772 57.7 -57.1-132.8 174.3 -1.1 54.4 58.7 291 294 A P - 0 0 0 0, 0.0 -58,-1.8 0, 0.0 2,-0.4 -0.177 51.5-142.3 -54.1 147.9 -0.6 53.0 55.2 292 295 A V E -o 233 0E 2 -60,-0.2 2,-1.4 -3,-0.1 6,-0.2 -0.939 18.5-119.6-117.7 141.1 -0.6 49.2 54.8 293 296 A I E +o 234 0E 41 -60,-1.9 -58,-0.5 -2,-0.4 8,-0.1 -0.676 50.2 162.9 -77.8 95.8 1.6 47.2 52.5 294 297 A D - 0 0 13 -2,-1.4 -1,-0.2 -60,-0.1 7,-0.1 0.533 52.9-114.5 -99.5 -10.6 -1.5 45.8 50.7 295 298 A G S S+ 0 0 46 3,-1.3 -2,-0.1 5,-0.2 6,-0.0 0.440 104.7 62.9 87.8 -3.5 -0.2 44.3 47.4 296 299 A E S S+ 0 0 94 2,-0.2 -85,-0.2 4,-0.0 -1,-0.1 0.691 108.7 25.7-115.3 -73.8 -2.2 47.0 45.5 297 300 A F S S+ 0 0 8 1,-0.3 -86,-0.3 -5,-0.2 -85,-0.2 0.934 140.5 33.5 -58.6 -43.3 -1.2 50.6 46.2 298 301 A F S S- 0 0 0 -6,-0.2 -3,-1.3 1,-0.1 -1,-0.3 -0.960 80.9-158.4-112.3 111.1 2.2 49.0 47.0 299 302 A P S S- 0 0 46 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 0.900 72.5 -8.2 -57.5 -44.5 2.7 45.9 44.8 300 303 A T S S- 0 0 64 1,-0.2 -5,-0.2 -4,-0.1 -6,-0.1 -0.737 105.2 -45.7-138.5-173.7 5.3 44.3 47.1 301 304 A S > - 0 0 59 -2,-0.2 4,-1.8 1,-0.1 -1,-0.2 -0.224 54.9-119.4 -55.8 151.1 7.2 45.2 50.2 302 305 A L H > S+ 0 0 12 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.910 111.0 56.1 -62.3 -41.5 8.8 48.6 50.1 303 306 A E H > S+ 0 0 74 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.889 107.6 46.4 -60.0 -42.5 12.3 47.2 50.4 304 307 A S H > S+ 0 0 45 2,-0.2 4,-2.4 1,-0.2 6,-0.3 0.868 111.6 52.7 -71.1 -31.1 12.0 44.9 47.4 305 308 A M H X>S+ 0 0 0 -4,-1.8 5,-2.0 1,-0.2 4,-0.9 0.936 111.7 46.6 -65.2 -42.6 10.5 47.7 45.4 306 309 A L H <5S+ 0 0 1 -4,-2.7 3,-0.3 1,-0.2 -2,-0.2 0.876 113.4 49.0 -66.5 -36.6 13.5 49.9 46.3 307 310 A N H <5S+ 0 0 74 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.871 114.4 43.2 -71.2 -38.0 16.0 47.1 45.5 308 311 A S H <5S- 0 0 78 -4,-2.4 -1,-0.2 -5,-0.1 -2,-0.2 0.491 110.7-113.8 -88.1 -2.8 14.5 46.3 42.1 309 312 A G T <5 + 0 0 8 -4,-0.9 2,-2.2 -3,-0.3 -3,-0.2 0.730 59.4 157.8 78.2 19.6 14.1 49.9 41.0 310 313 A N < + 0 0 53 -5,-2.0 2,-0.3 -6,-0.3 -1,-0.2 -0.507 42.5 78.4 -81.5 78.7 10.3 49.4 41.0 311 314 A F S S- 0 0 2 -2,-2.2 -103,-0.2 -3,-0.1 2,-0.2 -0.975 92.5 -63.5-170.1 165.8 9.5 53.1 41.3 312 315 A K - 0 0 39 -105,-3.1 2,-0.7 -2,-0.3 -2,-0.0 -0.422 46.6-141.6 -63.2 129.7 9.2 56.4 39.3 313 316 A K + 0 0 104 -2,-0.2 2,-0.2 99,-0.1 99,-0.1 -0.856 52.7 106.2 -96.5 112.9 12.6 57.5 38.0 314 317 A T S S- 0 0 9 -2,-0.7 99,-2.3 100,-0.1 100,-0.6 -0.814 71.6 -61.0-160.5-163.2 13.0 61.2 38.2 315 318 A Q E - j 0 414B 25 -98,-0.3 -96,-1.4 -2,-0.2 2,-0.3 -0.715 46.9-172.6 -97.0 150.0 14.8 63.9 40.2 316 319 A I E -ij 219 415B 0 98,-2.7 100,-1.9 -2,-0.3 2,-0.4 -0.986 14.5-163.0-141.1 151.1 14.2 64.3 43.9 317 320 A L E +ij 220 416B 0 -98,-1.6 -96,-2.0 -2,-0.3 2,-0.3 -0.999 29.9 148.4-133.0 127.2 15.3 66.8 46.5 318 321 A L E +ij 221 417B 0 98,-2.7 100,-2.0 -2,-0.4 2,-0.3 -0.970 9.8 149.7-155.8 168.0 15.1 65.8 50.2 319 322 A G E -ij 222 418B 0 -98,-1.6 -96,-3.1 -2,-0.3 -95,-0.3 -0.989 26.6-113.9 180.0-174.9 16.6 66.2 53.6 320 323 A V E - j 0 419B 0 98,-1.4 100,-3.0 -2,-0.3 2,-0.3 -0.863 22.6-111.4-138.7 169.7 16.3 66.3 57.3 321 324 A N E > - j 0 420B 0 -2,-0.3 3,-0.8 98,-0.2 100,-0.2 -0.705 32.0-115.3-100.5 158.5 16.5 68.6 60.3 322 325 A K T 3 S+ 0 0 94 98,-1.8 2,-0.2 -2,-0.3 3,-0.2 0.858 107.9 32.4 -61.4 -40.8 19.2 68.3 63.0 323 326 A D B > +p 436 0F 14 112,-1.9 114,-0.7 1,-0.2 3,-0.7 -0.466 66.1 154.0-121.0 61.9 17.0 67.4 65.9 324 327 A E T < S+ 0 0 1 -3,-0.8 3,-0.3 -2,-0.2 4,-0.3 0.804 70.6 53.2 -56.5 -33.7 14.1 65.4 64.5 325 328 A G T >> S+ 0 0 0 64,-0.5 4,-1.5 1,-0.2 3,-0.8 0.750 78.8 86.3 -81.8 -21.2 13.5 63.5 67.7 326 329 A S H <> S+ 0 0 0 -3,-0.7 4,-2.5 107,-0.3 3,-0.2 0.827 85.2 58.6 -50.2 -39.8 13.0 66.1 70.4 327 330 A F H 3> S+ 0 0 27 -4,-0.4 4,-1.9 -3,-0.3 -1,-0.2 0.919 108.5 44.3 -54.6 -48.7 9.3 66.6 69.7 328 331 A F H <> S+ 0 0 33 -3,-0.8 4,-1.5 -4,-0.3 -1,-0.2 0.748 112.2 50.9 -72.1 -27.0 8.4 63.0 70.4 329 332 A L H X S+ 0 0 1 -4,-1.5 4,-2.8 -3,-0.2 7,-0.3 0.910 108.0 54.1 -76.0 -41.7 10.6 62.7 73.5 330 333 A L H < S+ 0 0 14 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.1 0.924 115.1 40.2 -54.0 -48.2 9.0 65.9 75.0 331 334 A Y H < S+ 0 0 76 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.782 134.4 11.6 -76.4 -26.4 5.5 64.4 74.5 332 335 A G H < S+ 0 0 32 -4,-1.5 -3,-0.2 -5,-0.1 -2,-0.2 0.554 97.0 88.1-135.4 0.6 6.2 60.8 75.6 333 336 A A S >< S- 0 0 7 -4,-2.8 3,-1.4 -5,-0.2 19,-0.1 -0.850 74.1-112.8-105.5 136.1 9.5 60.1 77.3 334 337 A P T 3 S+ 0 0 54 0, 0.0 18,-0.1 0, 0.0 3,-0.1 -0.358 98.3 32.2 -63.9 140.4 9.9 60.4 81.1 335 338 A G T 3 S+ 0 0 34 1,-0.3 2,-0.4 -5,-0.1 -5,-0.1 0.229 91.5 106.2 101.3 -13.6 12.2 63.1 82.2 336 339 A F < + 0 0 15 -3,-1.4 2,-0.3 -7,-0.3 -1,-0.3 -0.848 40.2 168.0-102.5 135.1 11.5 65.6 79.4 337 340 A S > - 0 0 58 -2,-0.4 3,-0.6 3,-0.3 -6,-0.1 -0.963 41.4-123.6-141.6 157.7 9.5 68.7 80.0 338 341 A K T 3 S+ 0 0 35 -2,-0.3 -1,-0.1 1,-0.2 -8,-0.0 0.860 108.3 44.1 -71.1 -34.9 8.8 71.9 78.1 339 342 A D T 3 S+ 0 0 140 91,-0.1 2,-0.3 -3,-0.1 -1,-0.2 0.290 105.6 63.2 -97.6 9.1 10.0 74.2 80.8 340 343 A S S < S- 0 0 53 -3,-0.6 -3,-0.3 1,-0.0 92,-0.2 -0.836 88.1-110.0-125.1 168.6 13.2 72.6 82.0 341 344 A E - 0 0 113 -2,-0.3 -3,-0.0 -5,-0.1 -1,-0.0 0.606 48.6-137.3 -69.3 -14.2 16.5 71.7 80.3 342 345 A S - 0 0 3 1,-0.2 2,-0.2 43,-0.0 -1,-0.0 0.906 26.3-172.9 56.6 49.9 15.4 68.1 80.5 343 346 A K - 0 0 127 42,-0.1 2,-0.5 41,-0.1 39,-0.2 -0.556 17.7-138.5 -70.6 135.9 18.7 66.6 81.7 344 347 A I - 0 0 2 37,-2.4 40,-0.3 -2,-0.2 41,-0.2 -0.861 7.7-145.9-110.2 129.3 18.2 62.8 81.6 345 348 A S > - 0 0 60 -2,-0.5 4,-2.2 1,-0.1 5,-0.1 -0.312 36.0-102.0 -78.0 168.6 19.4 60.3 84.2 346 349 A R H > S+ 0 0 32 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.884 122.8 56.2 -58.6 -40.0 20.6 56.8 83.2 347 350 A E H > S+ 0 0 107 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.937 110.9 41.3 -59.1 -49.0 17.2 55.4 84.3 348 351 A D H > S+ 0 0 34 2,-0.2 4,-2.6 1,-0.2 -1,-0.2 0.827 112.4 56.4 -70.4 -28.8 15.2 57.7 82.1 349 352 A F H X S+ 0 0 1 -4,-2.2 4,-2.5 2,-0.2 5,-0.2 0.966 108.8 46.3 -63.9 -49.8 17.7 57.1 79.3 350 353 A M H X S+ 0 0 112 -4,-2.9 4,-1.6 1,-0.2 -2,-0.2 0.878 113.2 48.9 -59.6 -40.2 17.1 53.4 79.5 351 354 A S H X S+ 0 0 35 -4,-2.0 4,-2.1 -5,-0.2 -1,-0.2 0.894 110.8 54.0 -65.8 -39.3 13.3 54.0 79.6 352 355 A G H X S+ 0 0 0 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.915 106.4 47.4 -63.2 -45.0 13.7 56.3 76.6 353 356 A V H X S+ 0 0 2 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.893 110.1 54.5 -68.3 -31.9 15.5 53.8 74.4 354 357 A K H < S+ 0 0 93 -4,-1.6 -1,-0.2 -5,-0.2 6,-0.2 0.937 112.0 44.4 -61.4 -45.4 12.9 51.1 75.3 355 358 A L H < S+ 0 0 16 -4,-2.1 -71,-1.6 1,-0.2 -2,-0.2 0.862 113.7 52.6 -65.4 -36.4 10.2 53.6 74.2 356 359 A S H < S+ 0 0 0 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.745 117.5 32.9 -75.2 -28.0 12.2 54.5 71.0 357 360 A V S >< S+ 0 0 0 -4,-1.9 3,-2.0 -3,-0.2 -1,-0.3 -0.571 71.8 166.3-128.9 66.0 12.8 51.0 69.7 358 361 A P T 3 S+ 0 0 10 0, 0.0 -76,-0.1 0, 0.0 -1,-0.1 0.763 72.5 56.8 -51.2 -34.7 9.6 49.3 70.8 359 362 A H T 3 S+ 0 0 87 -3,-0.1 2,-0.3 -78,-0.1 -5,-0.1 0.366 86.8 108.0 -83.3 4.3 10.2 46.3 68.5 360 363 A A < - 0 0 7 -3,-2.0 -3,-0.1 -6,-0.2 2,-0.1 -0.633 60.3-138.3 -92.8 140.5 13.6 45.4 70.0 361 364 A N > - 0 0 49 -2,-0.3 4,-2.6 1,-0.1 5,-0.2 -0.292 44.0 -88.6 -79.4 174.9 14.6 42.5 72.2 362 365 A D H > S+ 0 0 118 1,-0.2 4,-2.4 2,-0.2 5,-0.1 0.865 128.7 53.0 -54.6 -39.8 17.0 43.1 75.2 363 366 A L H > S+ 0 0 86 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.934 110.4 48.4 -62.6 -43.4 20.1 42.5 73.1 364 367 A G H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.932 109.3 52.1 -61.2 -45.4 18.9 45.1 70.6 365 368 A L H X S+ 0 0 20 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.898 110.4 50.0 -59.0 -38.3 18.2 47.5 73.4 366 369 A D H X S+ 0 0 103 -4,-2.4 4,-2.9 -5,-0.2 5,-0.3 0.909 107.3 52.4 -65.9 -43.3 21.7 46.9 74.6 367 370 A A H X S+ 0 0 18 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.904 112.1 46.7 -60.4 -41.0 23.3 47.5 71.1 368 371 A V H X S+ 0 0 0 -4,-2.3 4,-1.6 2,-0.2 -2,-0.2 0.966 112.3 49.7 -63.2 -52.5 21.4 50.8 70.8 369 372 A T H X S+ 0 0 20 -4,-2.4 4,-0.8 1,-0.2 3,-0.4 0.899 112.9 46.2 -53.5 -46.3 22.4 51.9 74.3 370 373 A L H >< S+ 0 0 112 -4,-2.9 3,-0.6 1,-0.2 -1,-0.2 0.895 109.4 56.0 -64.1 -40.5 26.1 51.1 73.7 371 374 A Q H 3< S+ 0 0 68 -4,-2.1 -1,-0.2 -5,-0.3 -2,-0.2 0.770 118.0 32.3 -64.3 -27.5 26.0 52.8 70.4 372 375 A Y H 3< S+ 0 0 31 -4,-1.6 2,-0.5 -3,-0.4 -1,-0.2 0.320 97.5 96.1-114.4 7.4 24.8 56.1 71.9 373 376 A T << - 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