==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-OCT-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER BLOOD CLOTTING 02-JUL-12 4FX5 . COMPND 2 MOLECULE: VON WILLEBRAND FACTOR TYPE A; . SOURCE 2 ORGANISM_SCIENTIFIC: CATENULISPORA ACIDIPHILA; . AUTHOR E.V.FILIPPOVA,G.MINASOV,L.SHUVALOVA,O.KIRYUKHINA,R.JEDRZEJCZ . 426 3 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 19411.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 320 75.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 31 7.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 82 19.2 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.5 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 . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 2 0.5 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 . 35 8.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 37 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 119 27.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 0.7 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 1 0 0 0 1 0 2 1 2 1 0 0 1 0 1 0 0 0 0 0 1 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 1 0 1 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 PARALLEL BRIDGES PER LADDER . 1 3 1 1 0 1 3 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 0 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 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 -7 A N 0 0 202 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 29.3 22.9 19.1 30.5 2 -6 A L + 0 0 161 2,-0.0 2,-0.4 0, 0.0 0, 0.0 0.729 360.0 71.3 -82.2 -15.7 26.1 21.2 30.6 3 -5 A Y - 0 0 70 310,-0.0 2,-0.4 313,-0.0 313,-0.1 -0.791 59.7-157.2-111.0 140.3 24.7 24.5 31.6 4 -4 A F - 0 0 152 -2,-0.4 310,-2.4 308,-0.1 2,-0.2 -0.915 12.1-139.5-112.6 143.6 23.3 25.8 34.8 5 -3 A Q - 0 0 75 -2,-0.4 306,-0.1 308,-0.3 310,-0.1 -0.530 11.8-138.4 -89.1 159.4 20.9 28.7 35.4 6 -2 A S 0 0 68 304,-0.4 -1,-0.1 -2,-0.2 305,-0.1 0.536 360.0 360.0 -89.4 -8.7 20.9 31.3 38.1 7 -1 A N 0 0 149 0, 0.0 -2,-0.2 0, 0.0 304,-0.0 -0.426 360.0 360.0-141.7 360.0 17.1 31.2 38.5 8 ! 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 9 2 A S 0 0 71 0, 0.0 2,-0.4 0, 0.0 -4,-0.0 0.000 360.0 360.0 360.0-177.3 13.2 31.8 33.5 10 3 A Q + 0 0 178 218,-0.1 0, 0.0 0, 0.0 0, 0.0 -0.542 360.0 153.5-113.2 68.3 10.9 33.3 30.8 11 4 A Y - 0 0 38 -2,-0.4 218,-0.1 1,-0.1 267,-0.1 -0.615 49.4 -98.6 -90.0 152.2 12.9 33.0 27.6 12 5 A P - 0 0 4 0, 0.0 2,-0.4 0, 0.0 29,-0.2 -0.244 39.8-111.5 -55.4 153.8 11.3 32.8 24.1 13 6 A D E -A 40 0A 111 27,-2.2 27,-2.8 2,-0.0 2,-0.4 -0.817 35.1-147.2 -86.8 135.9 11.0 29.3 22.6 14 7 A F E -A 39 0A 28 303,-0.5 2,-0.5 -2,-0.4 25,-0.2 -0.897 12.1-156.8-111.6 131.3 13.4 28.8 19.7 15 8 A A E -A 38 0A 54 23,-2.7 23,-2.3 -2,-0.4 2,-0.5 -0.917 17.7-162.7 -99.7 131.4 12.9 26.7 16.6 16 9 A F E +A 37 0A 37 -2,-0.5 2,-0.4 21,-0.2 21,-0.2 -0.977 10.6 178.3-123.8 115.6 16.3 25.8 15.1 17 10 A E E -A 36 0A 103 19,-2.6 19,-2.4 -2,-0.5 2,-0.5 -0.956 16.2-152.1-120.3 145.9 16.6 24.6 11.4 18 11 A I E -A 35 0A 49 -2,-0.4 2,-0.5 17,-0.2 17,-0.2 -0.976 8.8-166.6-116.1 132.3 19.7 23.7 9.4 19 12 A N E +A 34 0A 23 15,-2.7 15,-2.6 -2,-0.5 2,-0.3 -0.971 32.5 120.4-121.9 111.4 19.5 24.1 5.7 20 13 A Q - 0 0 24 -2,-0.5 2,-0.7 13,-0.2 13,-0.1 -0.987 62.1-122.3-162.0 157.5 22.4 22.4 3.7 21 14 A N - 0 0 25 11,-0.4 11,-0.3 -2,-0.3 316,-0.1 -0.966 31.6-172.0-100.3 105.6 23.3 19.9 1.1 22 15 A E + 0 0 35 -2,-0.7 303,-2.6 302,-0.1 2,-0.5 0.620 53.4 99.0 -73.2 -16.2 25.6 17.8 3.3 23 16 A F E -e 325 0B 41 309,-0.3 2,-0.3 301,-0.2 303,-0.2 -0.679 53.0-176.9 -84.6 124.0 26.9 15.7 0.3 24 17 A L E -e 326 0B 17 301,-2.5 303,-2.5 -2,-0.5 309,-0.1 -0.877 25.0-114.6-118.6 144.0 30.2 16.8 -1.0 25 18 A A > - 0 0 40 -2,-0.3 3,-1.7 301,-0.2 303,-0.1 -0.320 49.9 -80.7 -71.6 166.1 32.3 15.5 -4.0 26 19 A A T 3 S+ 0 0 53 301,-0.3 302,-0.1 1,-0.3 -1,-0.0 0.710 122.9 33.5 -40.0 -54.9 35.7 13.8 -3.5 27 20 A G T 3 S+ 0 0 63 265,-0.0 -1,-0.3 2,-0.0 299,-0.0 0.661 85.7 133.0 -79.1 -11.6 38.1 16.8 -3.0 28 21 A V < + 0 0 52 -3,-1.7 265,-0.2 1,-0.1 -4,-0.1 -0.091 21.8 165.3 -70.7 129.9 35.7 19.1 -1.2 29 22 A R + 0 0 91 263,-0.1 261,-3.1 260,-0.1 2,-0.5 0.570 53.8 89.6-104.7 -18.5 36.8 21.0 2.0 30 23 A E E - B 0 289A 87 259,-0.2 2,-0.5 257,-0.0 259,-0.2 -0.751 50.2-175.1 -94.0 128.2 34.0 23.7 2.1 31 24 A V E - B 0 288A 0 257,-2.7 257,-2.8 -2,-0.5 2,-0.4 -0.981 6.3-169.5-119.3 123.3 30.8 23.0 4.0 32 25 A H E + B 0 287A 45 -2,-0.5 -11,-0.4 -11,-0.3 2,-0.3 -0.886 10.0 166.8-114.3 141.5 28.0 25.6 3.8 33 26 A A E - B 0 286A 0 253,-2.1 253,-3.0 -2,-0.4 2,-0.5 -0.984 26.4-143.5-148.7 149.2 24.8 25.8 5.8 34 27 A V E -AB 19 285A 0 -15,-2.6 -15,-2.7 -2,-0.3 2,-0.5 -0.959 17.4-155.8-111.1 127.0 22.1 28.2 6.6 35 28 A V E -AB 18 284A 0 249,-2.6 249,-2.4 -2,-0.5 2,-0.5 -0.901 3.5-157.8-103.5 124.6 20.7 28.2 10.1 36 29 A T E -AB 17 283A 1 -19,-2.4 -19,-2.6 -2,-0.5 2,-0.5 -0.943 8.5-171.1-105.7 127.3 17.1 29.5 10.6 37 30 A L E -AB 16 282A 0 245,-3.0 245,-2.4 -2,-0.5 2,-0.5 -0.978 4.7-179.7-120.9 121.3 16.3 30.7 14.1 38 31 A T E -AB 15 281A 46 -23,-2.3 -23,-2.7 -2,-0.5 2,-0.5 -0.983 9.1-161.1-127.1 119.4 12.7 31.6 15.0 39 32 A A E -AB 14 280A 3 241,-3.2 241,-0.9 -2,-0.5 2,-0.3 -0.855 8.2-172.3-102.3 133.1 11.8 32.8 18.5 40 33 A T E A 13 0A 72 -27,-2.8 -27,-2.2 -2,-0.5 239,-0.0 -0.899 360.0 360.0-118.5 153.0 8.2 32.7 19.8 41 34 A A 0 0 94 -2,-0.3 -1,-0.1 -29,-0.2 238,-0.0 0.973 360.0 360.0 -59.5 360.0 6.7 34.0 23.0 42 ! 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 43 52 A S 0 0 130 0, 0.0 2,-0.2 0, 0.0 103,-0.1 0.000 360.0 360.0 360.0 -58.8 13.8 40.9 32.2 44 53 A E - 0 0 76 101,-0.2 103,-3.0 38,-0.0 2,-0.4 -0.617 360.0-140.6 -81.4 145.6 14.1 44.7 32.7 45 54 A N E -j 147 0C 17 -2,-0.2 38,-2.5 101,-0.2 2,-0.4 -0.861 13.0-169.2-105.8 144.8 14.5 47.0 29.7 46 55 A V E -jk 148 83C 0 101,-2.7 103,-2.3 -2,-0.4 2,-0.5 -0.984 7.3-172.7-130.3 120.9 16.8 50.1 29.5 47 56 A E E -jk 149 84C 0 36,-2.1 38,-1.9 -2,-0.4 2,-0.5 -0.968 4.6-168.4-118.3 121.7 16.4 52.3 26.5 48 57 A V E -jk 150 85C 0 101,-2.2 103,-2.2 -2,-0.5 2,-0.6 -0.955 7.1-157.9-111.6 123.4 18.8 55.2 25.9 49 58 A I E -jk 151 86C 0 36,-2.8 38,-2.9 -2,-0.5 2,-0.6 -0.896 6.3-163.2-104.8 119.3 17.8 57.7 23.2 50 59 A I E -jk 152 87C 0 101,-3.6 103,-2.2 -2,-0.6 2,-0.5 -0.912 7.0-169.7-110.7 114.3 20.7 59.7 21.8 51 60 A I E -jk 153 88C 0 36,-2.9 38,-3.0 -2,-0.6 2,-0.3 -0.924 23.0-128.4-113.4 121.1 19.8 62.8 19.9 52 61 A D E + k 0 89C 0 101,-1.7 38,-0.2 -2,-0.5 75,-0.1 -0.467 28.4 174.6 -57.6 119.1 22.2 64.9 17.8 53 62 A C + 0 0 2 36,-3.2 71,-3.0 -2,-0.3 -1,-0.1 -0.027 27.9 141.2-119.3 28.8 21.8 68.5 19.0 54 63 A S > - 0 0 2 69,-0.3 3,-1.9 35,-0.2 72,-0.2 -0.182 68.8 -98.0 -69.3 164.0 24.6 69.9 16.9 55 64 A G G > S+ 0 0 25 70,-2.5 3,-1.5 1,-0.3 68,-0.1 0.813 118.7 62.5 -55.4 -35.1 24.3 73.3 15.2 56 65 A S G > S+ 0 0 50 69,-0.4 3,-2.1 1,-0.3 -1,-0.3 0.654 80.1 84.4 -70.1 -12.3 23.2 71.9 11.9 57 66 A X G < S+ 0 0 0 -3,-1.9 7,-1.6 1,-0.3 -1,-0.3 0.662 86.0 57.3 -65.0 -13.5 20.0 70.4 13.4 58 67 A D G X S+ 0 0 62 -3,-1.5 3,-0.6 -4,-0.2 -1,-0.3 0.338 82.0 102.6 -92.9 7.2 18.4 73.9 13.0 59 68 A Y T < S+ 0 0 178 -3,-2.1 -1,-0.2 1,-0.7 2,-0.1 -0.771 103.6 11.7-134.3 87.9 19.0 73.9 9.2 60 69 A P T > S- 0 0 80 0, 0.0 3,-2.2 0, 0.0 -1,-0.7 0.523 92.5-144.8 -81.2 157.4 16.3 73.2 8.4 61 70 A R T <> S+ 0 0 184 -3,-0.6 4,-2.1 1,-0.3 5,-0.2 0.667 91.6 78.9 -61.3 -21.3 14.5 73.7 11.7 62 71 A T H 3> S+ 0 0 77 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.753 86.4 61.5 -57.6 -25.4 12.2 70.8 10.8 63 72 A K H <> S+ 0 0 14 -3,-2.2 4,-2.5 -6,-0.2 -1,-0.2 0.970 107.2 40.0 -66.8 -54.2 15.1 68.4 11.8 64 73 A X H > S+ 0 0 3 -7,-1.6 4,-2.0 -4,-0.5 -2,-0.2 0.893 116.5 52.0 -62.3 -39.1 15.3 69.5 15.4 65 74 A X H X S+ 0 0 117 -4,-2.1 4,-2.5 1,-0.2 -1,-0.2 0.920 111.6 46.2 -64.8 -42.7 11.5 69.8 15.7 66 75 A A H X S+ 0 0 4 -4,-2.2 4,-3.4 2,-0.2 5,-0.3 0.889 108.7 55.4 -64.3 -42.9 11.1 66.2 14.4 67 76 A A H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.912 112.0 44.5 -56.4 -42.4 13.8 64.9 16.7 68 77 A K H X S+ 0 0 36 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.952 115.1 46.9 -66.4 -47.0 11.8 66.4 19.6 69 78 A E H X S+ 0 0 100 -4,-2.5 4,-1.9 1,-0.2 -2,-0.2 0.929 115.1 46.9 -58.9 -48.2 8.5 65.1 18.4 70 79 A A H X S+ 0 0 0 -4,-3.4 4,-2.7 2,-0.2 -1,-0.2 0.900 109.7 52.4 -66.3 -40.5 10.0 61.6 17.7 71 80 A T H X S+ 0 0 0 -4,-2.3 4,-2.5 -5,-0.3 -1,-0.2 0.895 108.3 51.8 -63.5 -38.5 11.7 61.4 21.1 72 81 A K H X S+ 0 0 77 -4,-2.2 4,-2.1 2,-0.2 -1,-0.2 0.885 108.8 50.4 -64.0 -39.6 8.5 62.2 22.8 73 82 A V H X S+ 0 0 23 -4,-1.9 4,-1.4 2,-0.2 -2,-0.2 0.921 110.0 50.8 -62.2 -44.1 6.7 59.4 20.9 74 83 A A H >X S+ 0 0 0 -4,-2.7 4,-1.0 1,-0.2 3,-0.7 0.946 108.7 51.2 -59.4 -45.8 9.5 57.0 21.9 75 84 A I H >< S+ 0 0 0 -4,-2.5 3,-0.7 1,-0.3 -1,-0.2 0.915 111.2 48.4 -59.1 -40.0 9.0 58.1 25.6 76 85 A D H 3< S+ 0 0 82 -4,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.730 108.1 56.0 -71.8 -22.8 5.3 57.4 25.3 77 86 A T H << S+ 0 0 31 -4,-1.4 -1,-0.2 -3,-0.7 -2,-0.2 0.593 81.6 110.4 -86.6 -12.6 6.0 54.0 23.6 78 87 A L S << S- 0 0 6 -4,-1.0 2,-0.2 -3,-0.7 3,-0.1 -0.351 78.8-108.5 -58.3 141.8 8.2 52.8 26.5 79 88 A T > - 0 0 72 1,-0.1 3,-2.7 4,-0.1 27,-0.3 -0.494 43.4 -93.1 -64.2 137.4 6.6 50.0 28.6 80 89 A D T 3 S+ 0 0 128 1,-0.3 27,-0.2 -2,-0.2 -1,-0.1 -0.340 117.1 24.4 -49.0 129.8 5.4 51.1 32.0 81 90 A G T 3 S+ 0 0 21 25,-2.6 -1,-0.3 1,-0.3 26,-0.1 0.155 88.4 134.3 94.0 -17.7 8.4 50.3 34.3 82 91 A A < - 0 0 3 -3,-2.7 24,-2.0 23,-0.2 -1,-0.3 -0.369 54.9-126.2 -64.7 137.9 11.1 50.4 31.6 83 92 A F E +kL 46 105C 38 -38,-2.5 -36,-2.1 22,-0.2 2,-0.3 -0.617 39.6 167.3 -80.4 149.3 14.2 52.4 32.6 84 93 A F E -kL 47 104C 1 20,-0.9 20,-0.6 -2,-0.2 2,-0.3 -0.993 21.6-169.7-159.4 158.5 15.3 55.1 30.1 85 94 A A E -k 48 0C 1 -38,-1.9 -36,-2.8 -2,-0.3 2,-0.4 -0.986 15.5-141.2-149.4 157.8 17.4 58.1 29.5 86 95 A V E -kM 49 97C 0 11,-2.8 10,-2.4 -2,-0.3 11,-1.3 -0.993 17.0-165.2-120.3 130.6 17.8 60.9 26.9 87 96 A V E -kM 50 95C 0 -38,-2.9 -36,-2.9 -2,-0.4 2,-0.7 -0.958 11.4-147.0-118.6 127.2 21.3 62.0 25.8 88 97 A A E -kM 51 94C 3 6,-2.8 6,-1.9 -2,-0.4 2,-0.5 -0.867 21.0-152.4 -93.4 117.6 21.9 65.3 23.9 89 98 A G E +kM 52 93C 0 -38,-3.0 -36,-3.2 -2,-0.7 -35,-0.2 -0.807 36.8 128.4-100.6 129.7 24.9 64.8 21.6 90 99 A T S S- 0 0 32 2,-2.9 38,-2.2 -2,-0.5 42,-0.2 -0.291 89.9 -46.0-137.2-138.8 27.2 67.6 20.5 91 100 A E S S+ 0 0 91 36,-0.3 2,-0.2 -2,-0.1 36,-0.1 0.688 139.8 29.9 -69.5 -17.3 31.0 67.6 20.7 92 101 A G S S- 0 0 24 34,-0.2 -2,-2.9 39,-0.1 2,-0.4 -0.450 89.1-116.5-118.3-166.0 30.1 66.4 24.2 93 102 A A E -M 89 0C 28 -4,-0.2 2,-0.4 -2,-0.2 -4,-0.2 -0.989 24.3-174.3-139.3 130.1 27.3 64.3 25.7 94 103 A R E -M 88 0C 137 -6,-1.9 -6,-2.8 -2,-0.4 2,-0.7 -0.988 23.5-133.5-125.0 134.0 24.9 65.6 28.3 95 104 A V E +M 87 0C 46 -2,-0.4 -8,-0.2 -8,-0.2 6,-0.1 -0.777 25.2 177.5 -83.1 118.1 22.2 63.5 30.0 96 105 A V E + 0 0 11 -10,-2.4 -9,-0.2 -2,-0.7 -1,-0.2 0.707 57.8 57.0 -99.5 -19.1 19.1 65.6 29.9 97 106 A Y E S+M 86 0C 22 -11,-1.3 -11,-2.8 1,-0.2 -1,-0.4 -0.914 99.4 28.1-155.7 137.4 16.8 63.1 31.5 98 107 A P S S- 0 0 8 0, 0.0 -1,-0.2 0, 0.0 3,-0.2 0.696 72.8-163.9 -73.1 175.9 16.9 61.7 34.2 99 108 A T S S+ 0 0 125 -2,-0.2 -4,-0.1 1,-0.1 -2,-0.0 0.466 71.3 66.7-111.4 -5.0 18.8 64.4 36.1 100 109 A G S S- 0 0 69 2,-0.3 -1,-0.1 0, 0.0 3,-0.1 0.227 105.9-105.2-105.2 15.0 20.0 62.7 39.2 101 110 A G S S+ 0 0 78 -3,-0.2 2,-0.3 1,-0.2 -2,-0.1 0.639 91.1 95.0 75.9 17.0 22.5 60.2 37.9 102 111 A Q S S- 0 0 145 0, 0.0 -2,-0.3 0, 0.0 -1,-0.2 -0.999 78.7-109.3-141.4 135.8 20.2 57.2 38.4 103 112 A L - 0 0 19 -2,-0.3 2,-0.3 36,-0.2 -18,-0.1 -0.345 33.3-158.3 -62.0 137.2 17.8 55.5 36.0 104 113 A L E -L 84 0C 71 -20,-0.6 -20,-0.9 -2,-0.1 2,-0.1 -0.921 18.7-109.7-118.6 148.4 14.1 56.0 36.7 105 114 A R E -L 83 0C 107 -2,-0.3 2,-0.4 -22,-0.2 5,-0.2 -0.401 37.0-102.3 -75.0 147.8 11.2 53.8 35.6 106 115 A A + 0 0 2 -24,-2.0 -25,-2.6 -27,-0.3 2,-0.3 -0.552 62.1 135.5 -74.4 120.7 8.7 55.1 33.0 107 116 A D S > S- 0 0 77 -2,-0.4 4,-2.5 -27,-0.2 5,-0.3 -0.892 71.5 -76.7-150.8-179.9 5.5 56.2 34.6 108 117 A Y H > S+ 0 0 213 -2,-0.3 4,-1.9 1,-0.2 5,-0.1 0.901 128.9 43.0 -52.1 -42.3 3.2 59.2 34.2 109 118 A Q H > S+ 0 0 161 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.917 115.0 45.0 -72.3 -50.1 5.5 61.5 36.1 110 119 A S H > S+ 0 0 5 -5,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.872 113.3 52.2 -64.4 -38.3 8.9 60.5 34.6 111 120 A R H X S+ 0 0 27 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.950 111.5 46.0 -63.7 -48.8 7.4 60.5 31.1 112 121 A A H X S+ 0 0 43 -4,-1.9 4,-1.8 -5,-0.3 -2,-0.2 0.895 113.8 48.5 -61.9 -40.3 6.1 64.1 31.5 113 122 A A H X S+ 0 0 35 -4,-2.3 4,-2.0 2,-0.2 -1,-0.2 0.903 111.2 50.9 -67.3 -39.8 9.3 65.3 33.0 114 123 A A H X S+ 0 0 0 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.914 108.5 51.5 -62.4 -45.0 11.4 63.7 30.2 115 124 A K H X S+ 0 0 59 -4,-2.5 4,-2.1 1,-0.2 -1,-0.2 0.881 107.9 52.3 -61.7 -39.0 9.2 65.3 27.6 116 125 A E H X S+ 0 0 134 -4,-1.8 4,-0.8 2,-0.2 -1,-0.2 0.926 110.1 48.1 -62.4 -44.6 9.7 68.7 29.2 117 126 A A H >< S+ 0 0 7 -4,-2.0 3,-0.9 1,-0.2 4,-0.2 0.899 110.4 52.2 -60.8 -41.0 13.5 68.3 29.1 118 127 A V H >< S+ 0 0 0 -4,-2.3 3,-1.7 1,-0.3 -1,-0.2 0.886 102.7 60.4 -62.4 -38.5 13.3 67.2 25.4 119 128 A G H 3< S+ 0 0 33 -4,-2.1 -1,-0.3 1,-0.3 -2,-0.2 0.757 100.6 55.0 -59.7 -27.0 11.3 70.3 24.7 120 129 A R T << S+ 0 0 174 -3,-0.9 -1,-0.3 -4,-0.8 -2,-0.2 0.433 78.7 120.2 -90.3 0.3 14.3 72.4 25.9 121 130 A L < - 0 0 4 -3,-1.7 2,-0.3 -4,-0.2 -53,-0.1 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