==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER CELL ADHESION 13-DEC-01 1ISN . COMPND 2 MOLECULE: MERLIN; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR T.SHIMIZU,A.SETO,N.MAITA,K.HAMADA,S.TSUKITA,S.TSUKITA, . 323 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 17954.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 222 68.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 5 1.5 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 50 15.5 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 . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 1.5 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 . 21 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 35 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 104 32.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 0.6 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 0 0 0 1 1 1 0 2 0 0 0 1 0 1 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 PARALLEL BRIDGES PER LADDER . 4 1 2 3 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 ANTIPARALLEL BRIDGES PER LADDER . 0 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 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 18 A Q 0 0 153 0, 0.0 2,-0.6 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 140.1 24.8 54.1 47.1 2 19 A P - 0 0 106 0, 0.0 2,-0.3 0, 0.0 0, 0.0 -0.829 360.0-148.2 -92.2 115.0 23.6 53.1 50.6 3 20 A K + 0 0 160 -2,-0.6 19,-1.2 18,-0.0 2,-0.3 -0.635 28.4 159.8 -83.4 141.6 23.2 49.2 51.2 4 21 A T E -A 21 0A 52 -2,-0.3 2,-0.3 17,-0.2 17,-0.2 -0.932 30.2-140.3-155.1 170.3 20.5 48.0 53.6 5 22 A F E -A 20 0A 19 15,-2.1 15,-0.8 -2,-0.3 2,-0.3 -0.803 32.0 -99.3-128.1 172.4 18.3 45.2 54.9 6 23 A T E -A 19 0A 44 -2,-0.3 69,-1.6 13,-0.2 2,-0.3 -0.715 29.7-175.9-105.3 148.5 14.6 45.0 56.0 7 24 A V E -Ab 18 75A 0 11,-2.0 11,-3.0 -2,-0.3 2,-0.5 -0.956 17.6-140.1-134.7 154.3 13.0 44.9 59.5 8 25 A R E -Ab 17 76A 82 67,-3.2 69,-2.2 -2,-0.3 2,-0.6 -0.965 12.9-162.1-116.9 130.9 9.5 44.6 60.9 9 26 A I E -Ab 16 77A 0 7,-2.8 7,-2.4 -2,-0.5 2,-0.5 -0.920 7.9-161.9-118.6 107.3 8.4 46.7 63.8 10 27 A V E -Ab 15 78A 29 67,-2.2 69,-2.9 -2,-0.6 5,-0.2 -0.745 8.7-178.2 -96.1 128.2 5.3 45.5 65.7 11 28 A T - 0 0 8 3,-1.7 69,-0.1 -2,-0.5 89,-0.0 -0.565 49.9 -89.2-109.4 175.3 3.3 47.7 68.0 12 29 A M S S+ 0 0 67 67,-0.2 3,-0.1 -2,-0.2 -2,-0.0 0.452 127.2 11.2 -66.1 2.8 0.2 46.8 70.1 13 30 A D S S+ 0 0 105 1,-0.1 -1,-0.2 0, 0.0 2,-0.2 0.409 125.2 52.2-151.8 -17.3 -2.0 47.8 67.0 14 31 A A - 0 0 41 2,-0.0 -3,-1.7 -5,-0.0 2,-0.3 -0.594 52.8-154.5-122.4 177.4 0.4 48.2 64.0 15 32 A E E -A 10 0A 112 -5,-0.2 2,-0.3 -2,-0.2 -5,-0.2 -0.856 17.7-171.9-156.7 116.4 3.2 46.5 62.1 16 33 A M E -A 9 0A 34 -7,-2.4 -7,-2.8 -2,-0.3 2,-0.4 -0.788 14.5-149.8-113.2 156.7 5.8 48.3 60.1 17 34 A E E -A 8 0A 101 -2,-0.3 2,-0.3 -9,-0.3 -9,-0.3 -0.947 25.2-177.9-121.0 142.4 8.5 47.2 57.7 18 35 A F E -A 7 0A 34 -11,-3.0 -11,-2.0 -2,-0.4 2,-0.6 -0.876 33.5-123.0-137.6 171.6 11.6 49.3 57.5 19 36 A N E -A 6 0A 95 -2,-0.3 2,-0.5 -13,-0.2 -13,-0.2 -0.799 33.8-175.9-120.4 81.1 14.9 49.6 55.7 20 37 A C E -A 5 0A 0 -15,-0.8 -15,-2.1 -2,-0.6 -2,-0.0 -0.700 27.3-118.1 -81.3 123.3 17.5 49.6 58.4 21 38 A E E > -A 4 0A 72 -2,-0.5 3,-1.3 -17,-0.2 -17,-0.2 -0.195 20.3-115.1 -59.5 154.7 21.0 50.1 57.2 22 39 A M T 3 S+ 0 0 73 -19,-1.2 43,-0.4 1,-0.3 -18,-0.1 0.956 114.6 36.5 -51.2 -61.9 23.6 47.3 57.6 23 40 A K T 3 S+ 0 0 67 41,-0.1 -1,-0.3 40,-0.1 2,-0.2 0.095 91.0 131.7 -80.9 14.6 25.9 49.3 60.0 24 41 A W < - 0 0 54 -3,-1.3 40,-2.0 1,-0.1 41,-0.4 -0.497 48.7-132.9 -76.6 146.5 23.0 51.0 61.8 25 42 A K B > -E 63 0B 105 38,-0.3 4,-2.2 -2,-0.2 38,-0.2 -0.433 24.7-102.7 -95.5 168.1 22.9 51.2 65.5 26 43 A G H > S+ 0 0 0 36,-1.9 4,-2.8 33,-0.6 34,-0.3 0.907 122.3 47.9 -52.7 -45.8 20.1 50.5 68.0 27 44 A K H > S+ 0 0 106 33,-0.6 4,-2.9 1,-0.2 5,-0.3 0.919 107.7 54.4 -62.8 -48.0 19.6 54.2 68.6 28 45 A D H > S+ 0 0 68 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.894 115.4 40.2 -53.0 -46.7 19.5 55.0 64.8 29 46 A L H X S+ 0 0 0 -4,-2.2 4,-2.3 2,-0.2 3,-0.3 0.980 113.5 52.7 -65.5 -59.5 16.8 52.4 64.3 30 47 A F H X S+ 0 0 11 -4,-2.8 4,-2.3 1,-0.3 3,-0.2 0.904 110.6 48.1 -41.3 -57.6 14.8 53.2 67.4 31 48 A D H X S+ 0 0 62 -4,-2.9 4,-2.8 1,-0.2 -1,-0.3 0.873 107.1 55.5 -55.4 -41.9 14.6 56.9 66.5 32 49 A L H X S+ 0 0 27 -4,-1.5 4,-2.2 -3,-0.3 -1,-0.2 0.933 112.0 45.1 -56.4 -45.1 13.5 56.1 63.0 33 50 A V H X S+ 0 0 0 -4,-2.3 4,-0.6 -3,-0.2 -2,-0.2 0.835 111.8 51.0 -66.9 -36.8 10.7 54.1 64.5 34 51 A C H X>S+ 0 0 5 -4,-2.3 5,-1.6 -5,-0.2 4,-1.0 0.883 110.7 50.1 -70.0 -37.3 9.8 56.9 67.1 35 52 A R H ><5S+ 0 0 166 -4,-2.8 3,-1.5 1,-0.2 -2,-0.2 0.973 108.1 49.1 -66.1 -55.4 9.7 59.5 64.4 36 53 A T H 3<5S+ 0 0 79 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.696 113.2 51.5 -60.9 -14.9 7.4 57.7 62.0 37 54 A L H 3<5S- 0 0 45 -4,-0.6 -1,-0.3 -5,-0.2 -2,-0.2 0.700 105.5-129.8 -92.7 -20.0 5.2 57.1 65.0 38 55 A G T <<5 + 0 0 44 -3,-1.5 2,-0.4 -4,-1.0 -3,-0.2 0.573 61.8 140.3 81.0 9.9 5.1 60.7 66.0 39 56 A L < + 0 0 6 -5,-1.6 -1,-0.3 -6,-0.2 -2,-0.2 -0.709 22.0 165.6 -88.6 128.3 6.1 59.6 69.5 40 57 A R + 0 0 94 -2,-0.4 2,-1.3 -3,-0.1 3,-0.3 0.493 60.3 83.8-120.9 -7.8 8.6 61.8 71.4 41 58 A E > + 0 0 2 1,-0.2 3,-1.1 -7,-0.1 4,-0.2 -0.371 58.5 153.5 -88.9 53.9 8.3 60.5 75.0 42 59 A T G > + 0 0 41 -2,-1.3 3,-2.2 1,-0.3 -1,-0.2 0.783 43.2 84.2 -56.1 -35.7 10.7 57.9 73.8 43 60 A W G 3 S+ 0 0 89 -3,-0.3 -1,-0.3 1,-0.3 246,-0.1 0.486 85.4 59.0 -51.5 -8.0 12.2 57.1 77.2 44 61 A F G < S+ 0 0 3 -3,-1.1 39,-3.0 38,-0.1 38,-2.9 0.710 104.2 51.4 -94.1 -23.9 9.4 54.7 78.1 45 62 A F E < +C 81 0A 11 -3,-2.2 2,-0.3 36,-0.3 36,-0.2 -0.341 49.9 168.9-106.7-173.7 9.9 52.3 75.2 46 63 A G E -C 80 0A 3 34,-1.3 34,-2.2 -2,-0.1 2,-0.4 -0.892 39.7 -93.8 176.7 165.1 12.5 50.2 73.5 47 64 A L E -C 79 0A 0 -2,-0.3 11,-2.7 11,-0.2 2,-0.5 -0.831 37.5-162.8-101.2 139.7 12.5 47.5 70.8 48 65 A Q E +CD 78 57A 34 30,-2.7 30,-1.8 -2,-0.4 9,-0.2 -0.946 15.5 176.6-134.1 126.0 12.5 43.8 71.8 49 66 A Y E - D 0 56A 9 7,-0.6 7,-0.8 -2,-0.5 2,-0.3 -0.175 22.3-140.8 -95.8-163.0 13.3 40.6 70.0 50 67 A T E - D 0 55A 75 5,-0.2 5,-0.2 26,-0.2 20,-0.1 -0.841 17.9-164.0-169.2 124.3 13.2 37.3 71.7 51 68 A I - 0 0 81 3,-0.9 4,-0.1 -2,-0.3 -1,-0.1 0.975 59.3 -96.3 -72.7 -57.6 15.4 34.1 71.5 52 69 A K S S+ 0 0 169 2,-0.4 3,-0.1 0, 0.0 -1,-0.0 -0.064 108.2 34.3 165.6 -37.9 13.0 31.7 73.2 53 70 A D S S+ 0 0 130 1,-0.4 2,-0.3 0, 0.0 0, 0.0 0.730 119.7 24.7 -99.8 -94.4 14.3 31.7 76.8 54 71 A T S S- 0 0 29 -4,-0.1 -3,-0.9 1,-0.0 -2,-0.4 -0.571 81.2-141.0 -75.8 133.4 15.7 35.0 78.1 55 72 A V E -D 50 0A 55 -2,-0.3 2,-0.3 -5,-0.2 -5,-0.2 -0.620 17.8-145.7 -92.9 160.8 14.2 37.9 76.2 56 73 A A E -D 49 0A 3 -7,-0.8 -7,-0.6 -2,-0.2 2,-0.4 -0.892 13.2-140.3-135.8 162.0 16.1 41.0 75.1 57 74 A W E -D 48 0A 23 -2,-0.3 2,-0.3 -9,-0.2 -9,-0.2 -0.905 37.5-107.0-114.9 137.7 16.1 44.7 74.5 58 75 A L - 0 0 6 -11,-2.7 2,-0.4 -2,-0.4 -11,-0.2 -0.508 35.9-132.8 -66.9 122.9 17.9 46.4 71.6 59 76 A K - 0 0 42 -2,-0.3 -33,-0.6 4,-0.1 -32,-0.2 -0.678 1.4-141.0 -81.7 129.6 20.9 48.2 73.0 60 77 A M S S+ 0 0 53 -2,-0.4 -33,-0.6 -34,-0.3 -32,-0.2 0.472 100.1 47.8 -67.9 -4.2 21.4 51.8 71.8 61 78 A D S S+ 0 0 116 -35,-0.1 -1,-0.2 -36,-0.1 3,-0.1 0.838 97.5 71.6-101.3 -51.6 25.1 51.2 71.5 62 79 A K S S- 0 0 82 1,-0.1 -36,-1.9 -37,-0.1 2,-0.2 -0.166 91.3 -97.4 -66.0 157.6 25.5 47.9 69.7 63 80 A K B > -E 25 0B 94 -38,-0.2 4,-1.4 1,-0.1 3,-0.4 -0.522 31.7-121.7 -72.9 144.5 24.8 47.4 66.0 64 81 A V T 4 S+ 0 0 3 -40,-2.0 5,-0.3 1,-0.2 -1,-0.1 0.779 114.1 49.3 -59.6 -26.2 21.3 46.0 65.4 65 82 A L T 4 S+ 0 0 38 -41,-0.4 4,-0.3 -43,-0.4 -1,-0.2 0.826 102.4 60.6 -81.8 -32.3 22.9 43.1 63.6 66 83 A D T 4 S+ 0 0 101 -3,-0.4 -2,-0.2 2,-0.1 -1,-0.2 0.821 82.0 93.9 -65.1 -33.3 25.5 42.3 66.3 67 84 A H S < S- 0 0 0 -4,-1.4 2,-3.2 1,-0.2 -9,-0.0 -0.356 98.0-108.9 -58.3 140.0 22.7 41.7 68.9 68 85 A D + 0 0 75 2,-0.0 2,-0.3 3,-0.0 -1,-0.2 -0.193 69.9 148.2 -70.0 52.6 22.1 37.9 68.8 69 86 A V - 0 0 7 -2,-3.2 2,-0.3 -4,-0.3 -18,-0.1 -0.645 62.6 -90.9 -91.2 144.9 18.8 38.5 67.1 70 87 A S - 0 0 91 -2,-0.3 6,-0.4 1,-0.2 -1,-0.1 -0.390 38.1-152.8 -56.1 114.2 17.3 36.0 64.6 71 88 A K + 0 0 113 -2,-0.3 2,-0.4 4,-0.1 4,-0.2 0.378 50.8 123.0 -74.8 2.8 18.7 37.3 61.3 72 89 A E S S- 0 0 158 2,-0.1 4,-0.1 1,-0.1 -2,-0.0 -0.526 72.9 -82.4 -71.1 123.6 15.9 36.0 59.0 73 90 A E S S+ 0 0 108 -2,-0.4 -66,-0.1 1,-0.2 -1,-0.1 -0.408 118.8 44.5 -67.8 136.3 14.5 38.9 57.0 74 91 A P S S- 0 0 34 0, 0.0 -67,-0.3 0, 0.0 -1,-0.2 0.408 89.0-147.2 -86.7 129.9 12.4 40.7 58.0 75 92 A V E -b 7 0A 5 -69,-1.6 -67,-3.2 -4,-0.2 2,-0.5 -0.335 22.3-135.4 -56.3 132.4 14.3 41.0 61.4 76 93 A T E +b 8 0A 46 -6,-0.4 2,-0.4 -69,-0.2 -26,-0.2 -0.826 29.6 170.8-107.4 133.8 11.6 41.4 64.0 77 94 A F E -b 9 0A 1 -69,-2.2 -67,-2.2 -2,-0.5 2,-0.6 -0.996 23.9-141.0-134.1 137.5 11.4 43.8 66.9 78 95 A H E -bC 10 48A 68 -30,-1.8 -30,-2.7 -2,-0.4 2,-0.7 -0.891 15.4-139.8-101.6 122.5 8.5 44.5 69.1 79 96 A F E + C 0 47A 5 -69,-2.9 2,-0.3 -2,-0.6 -67,-0.2 -0.760 42.3 151.7 -83.8 113.4 8.0 48.1 70.1 80 97 A L E - C 0 46A 32 -34,-2.2 -34,-1.3 -2,-0.7 2,-0.4 -0.971 52.5 -94.1-145.6 159.9 7.0 48.1 73.7 81 98 A A E + C 0 45A 5 -2,-0.3 -36,-0.3 -36,-0.2 3,-0.1 -0.591 32.1 177.8 -73.3 122.5 7.0 50.1 76.9 82 99 A K + 0 0 35 -38,-2.9 2,-0.3 -2,-0.4 -37,-0.2 0.756 70.0 44.5 -93.1 -33.3 10.1 49.0 78.9 83 100 A F - 0 0 21 -39,-3.0 -1,-0.1 -3,-0.1 118,-0.1 -0.808 69.5-151.3-117.5 153.2 9.3 51.6 81.6 84 101 A Y - 0 0 19 -2,-0.3 2,-0.1 117,-0.2 -39,-0.0 -0.944 17.8-123.2-124.4 139.7 6.2 52.6 83.4 85 102 A P - 0 0 1 0, 0.0 3,-0.4 0, 0.0 136,-0.1 -0.444 13.3-132.4 -79.1 152.4 5.2 56.0 85.0 86 103 A E S S+ 0 0 61 1,-0.3 2,-0.1 -2,-0.1 136,-0.0 0.671 103.6 19.2 -75.4 -17.2 4.3 56.4 88.6 87 104 A N >> - 0 0 60 1,-0.1 3,-2.1 108,-0.0 4,-2.0 -0.591 65.7-171.1-157.7 90.2 1.3 58.5 87.4 88 105 A A H 3> S+ 0 0 0 -3,-0.4 4,-2.7 1,-0.3 -1,-0.1 0.836 86.3 60.0 -47.3 -48.2 0.1 58.1 83.8 89 106 A E H 34 S+ 0 0 107 1,-0.2 -1,-0.3 2,-0.2 99,-0.0 0.647 118.2 32.6 -60.9 -14.6 -2.3 61.0 84.0 90 107 A E H <4 S+ 0 0 105 -3,-2.1 -2,-0.2 0, 0.0 -1,-0.2 0.608 125.4 39.4-115.6 -21.0 0.6 63.3 84.8 91 108 A E H < S+ 0 0 40 -4,-2.0 2,-0.7 1,-0.1 -3,-0.2 0.604 98.9 72.0-109.0 -13.9 3.5 61.7 83.0 92 109 A L < + 0 0 5 -4,-2.7 -1,-0.1 -5,-0.3 6,-0.0 -0.905 50.3 161.0-105.0 108.3 2.0 60.6 79.6 93 110 A V + 0 0 30 -2,-0.7 -1,-0.2 -3,-0.1 -2,-0.0 0.924 50.0 73.6 -91.9 -53.9 1.3 63.7 77.6 94 111 A Q S > S- 0 0 26 1,-0.1 4,-2.5 2,-0.0 5,-0.2 -0.322 72.3-139.8 -64.4 138.1 1.0 62.5 74.0 95 112 A E H > S+ 0 0 87 1,-0.2 4,-3.4 2,-0.2 5,-0.2 0.919 107.2 58.3 -62.9 -37.5 -2.2 60.7 73.2 96 113 A I H > S+ 0 0 58 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.864 106.7 45.3 -54.8 -47.6 0.0 58.4 71.1 97 114 A T H > S+ 0 0 0 2,-0.2 4,-1.2 1,-0.2 -1,-0.2 0.937 114.2 49.3 -61.5 -50.1 2.0 57.6 74.2 98 115 A Q H X S+ 0 0 19 -4,-2.5 4,-3.0 1,-0.2 3,-0.3 0.887 110.4 51.4 -56.4 -44.1 -1.1 57.1 76.2 99 116 A H H X S+ 0 0 27 -4,-3.4 4,-2.6 1,-0.2 5,-0.3 0.954 106.8 51.6 -59.9 -52.8 -2.6 54.9 73.5 100 117 A L H X S+ 0 0 9 -4,-2.2 4,-0.8 1,-0.2 -1,-0.2 0.720 113.9 45.7 -59.5 -23.5 0.4 52.6 73.3 101 118 A F H X S+ 0 0 0 -4,-1.2 4,-2.7 -3,-0.3 5,-0.4 0.909 109.3 55.1 -83.4 -48.2 0.3 52.2 77.1 102 119 A F H X S+ 0 0 10 -4,-3.0 4,-2.4 1,-0.2 -2,-0.2 0.924 113.0 40.8 -47.9 -57.2 -3.5 51.6 77.1 103 120 A L H X S+ 0 0 26 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.850 114.9 51.5 -62.6 -39.6 -3.3 48.7 74.6 104 121 A Q H X S+ 0 0 12 -4,-0.8 4,-1.6 -5,-0.3 -1,-0.2 0.932 114.5 41.2 -63.8 -50.9 -0.2 47.1 76.1 105 122 A V H X S+ 0 0 1 -4,-2.7 4,-2.5 2,-0.2 5,-0.2 0.895 109.0 60.5 -63.8 -44.1 -1.5 47.0 79.6 106 123 A K H X S+ 0 0 53 -4,-2.4 4,-3.1 -5,-0.4 3,-0.3 0.941 107.3 46.6 -49.6 -48.3 -5.0 45.9 78.4 107 124 A K H X S+ 0 0 18 -4,-1.9 4,-2.9 1,-0.3 -1,-0.3 0.876 109.4 54.1 -62.9 -38.6 -3.2 42.9 76.9 108 125 A Q H <>S+ 0 0 28 -4,-1.6 5,-2.9 2,-0.2 6,-1.9 0.831 113.4 43.1 -64.8 -32.8 -1.4 42.4 80.2 109 126 A I H ><5S+ 0 0 4 -4,-2.5 3,-2.0 -3,-0.3 -2,-0.2 0.970 115.4 47.6 -75.0 -54.9 -4.7 42.4 82.0 110 127 A L H 3<5S+ 0 0 17 -4,-3.1 44,-0.7 1,-0.3 -2,-0.2 0.875 112.3 47.5 -52.3 -49.1 -6.5 40.2 79.5 111 128 A D T 3<5S- 0 0 90 -4,-2.9 -1,-0.3 -5,-0.2 -2,-0.1 0.216 116.1-117.9 -80.4 16.4 -3.8 37.5 79.3 112 129 A E T < 5S+ 0 0 89 -3,-2.0 -3,-0.2 2,-0.2 3,-0.2 0.824 75.7 131.9 50.6 40.4 -3.7 37.6 83.1 113 130 A K S - 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0 0 76 -2,-0.4 3,-1.7 -5,-0.1 4,-1.6 -0.532 27.8 -99.7 -92.2 152.6 -23.1 33.7 83.3 164 181 A P H >> S+ 0 0 104 0, 0.0 4,-0.7 0, 0.0 3,-0.6 0.811 119.5 30.1 -28.9 -74.7 -21.5 34.9 79.9 165 182 A E H 3> S+ 0 0 93 1,-0.2 4,-0.6 2,-0.2 -21,-0.1 0.495 108.2 73.3 -75.1 -1.0 -23.8 37.6 78.7 166 183 A M H X> S+ 0 0 18 -3,-1.7 4,-1.6 2,-0.2 3,-1.2 0.888 95.0 53.3 -74.1 -38.5 -24.7 38.5 82.3 167 184 A W H X S+ 0 0 81 -4,-0.9 3,-1.5 -3,-0.4 4,-1.1 0.949 111.4 59.4 -73.8 -55.9 -21.0 51.3 83.5 175 192 A Y H >< S+ 0 0 0 -4,-2.7 3,-0.7 1,-0.3 -39,-0.4 0.824 99.3 60.2 -43.6 -37.0 -20.5 52.0 79.8 176 193 A A H >< S+ 0 0 41 -4,-1.6 3,-1.3 1,-0.3 -1,-0.3 0.945 103.9 49.2 -60.3 -42.1 -23.9 53.7 79.9 177 194 A E H << S+ 0 0 143 -3,-1.5 -1,-0.3 -4,-0.7 -2,-0.2 0.678 95.5 73.8 -71.7 -17.2 -22.5 56.2 82.5 178 195 A H T X< + 0 0 10 -4,-1.1 3,-1.7 -3,-0.7 -1,-0.3 0.351 66.3 141.3 -79.3 8.0 -19.4 56.8 80.3 179 196 A R T < + 0 0 68 -3,-1.3 -3,-0.0 1,-0.2 -49,-0.0 -0.235 64.9 26.4 -55.4 131.9 -21.5 58.9 77.9 180 197 A G T 3 S+ 0 0 63 1,-0.3 2,-0.4 0, 0.0 -1,-0.2 0.399 87.1 136.2 96.2 -1.1 -19.5 62.0 76.6 181 198 A R < - 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