==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER GENE REGULATION/ANTITUMOR PROTEIN/DNA 27-AUG-02 1MJE . COMPND 2 MOLECULE: 5'-D(P*TP*TP*TP*TP*TP*T)-3'; . SOURCE 2 SYNTHETIC: YES; . AUTHOR H.YANG,P.D.JEFFREY,J.MILLER,E.KINNUCAN,Y.SUN,N.H.THOMA, . 642 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33428.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 405 63.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 20 3.1 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 95 14.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 3 0.5 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 . 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 . 66 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 71 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 122 19.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 10 1.6 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 1 1 0 2 0 2 0 1 0 0 0 2 1 1 0 0 0 1 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 1 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 . 5 0 7 4 1 2 0 0 0 1 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 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 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 B P 0 0 142 0, 0.0 208,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-179.6 26.1 170.8 45.7 2 8 B V - 0 0 44 1,-0.1 5,-0.0 92,-0.1 92,-0.0 -0.113 360.0-128.1 -40.9 114.3 27.3 167.6 47.4 3 9 B D - 0 0 71 1,-0.1 -1,-0.1 2,-0.0 85,-0.0 -0.212 13.3-154.1 -61.2 163.3 24.8 164.8 46.8 4 10 B L S S+ 0 0 34 2,-0.1 -1,-0.1 3,-0.0 -2,-0.1 0.030 82.4 44.5-130.8 26.5 23.6 163.0 50.0 5 11 B G S S+ 0 0 4 76,-0.0 77,-0.2 73,-0.0 4,-0.1 0.437 108.0 50.9-144.0 -13.5 22.6 159.6 48.8 6 12 B L S S+ 0 0 16 2,-0.1 83,-1.5 75,-0.1 2,-0.2 0.440 86.0 109.5-100.7 -12.8 25.4 158.5 46.5 7 13 B L E S-a 89 0A 4 81,-0.2 2,-1.1 1,-0.1 83,-0.2 -0.497 82.1-120.1 -62.8 130.0 27.8 159.5 49.3 8 14 B E E -a 90 0A 50 81,-4.2 83,-0.6 -2,-0.2 -1,-0.1 -0.693 28.2-136.0 -82.5 102.1 29.2 156.2 50.7 9 15 B E > - 0 0 12 -2,-1.1 2,-2.9 1,-0.2 3,-0.9 -0.232 21.8-111.7 -53.8 143.9 28.0 156.3 54.3 10 16 B D T 3 S+ 0 0 1 1,-0.2 329,-0.8 328,-0.1 -1,-0.2 -0.396 114.3 36.3 -74.7 60.8 30.8 155.2 56.7 11 17 B D T 3 S+ 0 0 8 -2,-2.9 2,-0.6 1,-0.3 -1,-0.2 0.270 71.7 117.8 177.2 -23.8 28.8 152.1 57.3 12 18 B E < - 0 0 30 -3,-0.9 -1,-0.3 328,-0.0 2,-0.2 -0.576 55.4-162.3 -66.3 116.6 27.0 150.9 54.3 13 19 B F - 0 0 31 -2,-0.6 2,-0.3 223,-0.1 327,-0.1 -0.556 16.5-120.0-101.3 166.3 28.7 147.5 54.0 14 20 B E - 0 0 115 -2,-0.2 4,-0.0 1,-0.1 5,-0.0 -0.813 35.0-105.1-104.1 146.3 29.1 144.9 51.3 15 21 B E S S+ 0 0 64 -2,-0.3 -1,-0.1 1,-0.2 4,-0.0 0.859 103.8 0.6 -31.5 -76.5 27.8 141.3 51.7 16 22 B F S S- 0 0 126 -3,-0.1 -1,-0.2 2,-0.0 2,-0.0 -0.995 87.6-105.7-125.0 126.2 31.2 139.7 52.3 17 23 B P S S+ 0 0 69 0, 0.0 2,-0.7 0, 0.0 -2,-0.1 0.502 111.6 65.6 -17.8 -27.4 34.5 141.8 52.3 18 24 B A 0 0 76 1,-0.1 -2,-0.0 -4,-0.0 -3,-0.0 -0.712 360.0 360.0-109.8 79.6 35.4 140.4 48.8 19 25 B E 0 0 101 -2,-0.7 -1,-0.1 -4,-0.0 -4,-0.1 -0.000 360.0 360.0-137.6 360.0 32.7 141.7 46.4 20 ! 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 21 37 B H 0 0 85 0, 0.0 4,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -88.5 48.1 152.6 57.7 22 38 B V + 0 0 21 311,-0.1 312,-1.5 2,-0.1 2,-0.4 0.496 360.0 53.3 -27.7 -29.7 44.4 152.3 58.8 23 39 B W B S-B 333 0B 40 310,-0.2 2,-0.4 275,-0.0 310,-0.2 -0.924 92.6-110.4-118.4 141.4 45.3 151.9 62.4 24 40 B E - 0 0 48 308,-2.6 -2,-0.1 -2,-0.4 0, 0.0 -0.578 27.6-140.0 -74.4 127.9 47.4 154.1 64.5 25 41 B D S S+ 0 0 74 -2,-0.4 2,-0.2 -4,-0.1 -1,-0.1 0.948 82.8 35.0 -46.0 -94.2 50.7 152.3 65.4 26 42 B N S S- 0 0 63 1,-0.1 3,-0.0 328,-0.1 327,-0.0 -0.461 80.5-138.5 -66.1 133.4 51.5 153.2 69.1 27 43 B W S S+ 0 0 12 -2,-0.2 -1,-0.1 1,-0.1 304,-0.0 0.539 82.9 27.1 -62.0-129.8 48.3 153.5 71.2 28 44 B D 0 0 108 1,-0.1 -1,-0.1 0, 0.0 258,-0.0 0.125 360.0 360.0 -33.9 134.4 48.8 156.5 73.5 29 45 B D 0 0 141 -3,-0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.917 360.0 360.0 174.9 360.0 51.2 159.2 72.0 30 ! 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 31 50 B D > 0 0 83 0, 0.0 4,-1.2 0, 0.0 304,-0.0 0.000 360.0 360.0 360.0 -71.1 45.2 164.1 62.4 32 51 B D T 4 + 0 0 31 1,-0.2 303,-3.7 2,-0.2 304,-0.1 0.580 360.0 48.6 -71.1 -10.6 42.7 161.6 60.9 33 52 B F T 4 S+ 0 0 26 301,-0.2 264,-0.2 302,-0.1 -1,-0.2 0.894 104.9 54.0 -93.9 -50.3 42.9 159.7 64.1 34 53 B S T 4 S+ 0 0 87 1,-0.2 2,-0.8 298,-0.1 -2,-0.2 0.768 103.3 58.5 -55.2 -34.1 42.4 162.5 66.6 35 54 B N < - 0 0 34 -4,-1.2 2,-0.4 68,-0.0 -1,-0.2 -0.774 63.9-178.2-107.5 91.0 39.1 163.9 65.2 36 55 B Q > - 0 0 5 -2,-0.8 4,-1.7 1,-0.2 3,-0.3 -0.716 21.0-144.0 -85.9 134.3 36.3 161.3 65.1 37 56 B L H >> S+ 0 0 5 -2,-0.4 3,-2.2 298,-0.3 4,-1.1 0.991 96.7 48.4 -57.7 -73.4 33.2 162.7 63.5 38 57 B R H 34 S+ 0 0 9 1,-0.3 4,-0.4 257,-0.2 84,-0.3 0.664 116.9 46.6 -40.1 -25.5 30.6 161.0 65.6 39 58 B A H 3> S+ 0 0 12 256,-0.5 4,-1.1 -3,-0.3 -1,-0.3 0.712 91.6 73.2 -94.7 -26.1 32.5 162.0 68.7 40 59 B E H << S+ 0 0 18 -3,-2.2 3,-0.4 -4,-1.7 64,-0.3 0.845 93.6 65.4 -55.7 -26.9 33.1 165.7 67.8 41 60 B L T < S+ 0 0 1 -4,-1.1 -1,-0.2 1,-0.2 -2,-0.2 0.957 94.4 50.7 -59.9 -56.0 29.5 165.8 68.7 42 61 B E T 4 S+ 0 0 58 -4,-0.4 2,-1.3 -3,-0.3 -1,-0.2 0.728 99.5 73.1 -58.5 -18.7 29.8 164.9 72.4 43 62 B K < 0 0 39 -4,-1.1 61,-0.8 -3,-0.4 -1,-0.2 -0.602 360.0 360.0 -95.4 73.9 32.4 167.7 72.5 44 63 B H 0 0 69 -2,-1.3 -2,-0.2 60,-0.2 -1,-0.1 -0.124 360.0 360.0 155.6 360.0 29.9 170.6 72.3 45 !* 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 46 2399 A K 0 0 139 0, 0.0 2,-0.2 0, 0.0 115,-0.1 0.000 360.0 360.0 360.0 -95.9 0.1 172.3 65.7 47 2400 A D - 0 0 51 114,-0.0 2,-0.4 95,-0.0 95,-0.1 -0.549 360.0 -67.0 95.0-160.4 -3.5 171.4 64.4 48 2401 A L - 0 0 106 -2,-0.2 3,-0.3 1,-0.1 111,-0.0 -0.996 27.4-124.7-134.7 140.0 -6.3 169.8 66.4 49 2402 A M S >> S+ 0 0 119 -2,-0.4 3,-0.9 1,-0.2 4,-0.8 0.603 102.2 77.8 -53.4 -13.9 -6.7 166.4 67.9 50 2403 A S G >4 S+ 0 0 85 1,-0.3 2,-2.0 2,-0.2 3,-0.6 0.996 95.9 37.5 -58.6 -77.3 -10.0 166.2 65.9 51 2404 A S G 34 S+ 0 0 39 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 -0.139 104.7 80.8 -72.4 43.0 -8.6 165.4 62.5 52 2405 A L G <> S+ 0 0 22 -2,-2.0 4,-1.0 -3,-0.9 -1,-0.2 0.757 87.2 43.9-113.0 -56.9 -5.8 163.1 64.0 53 2406 A Q H S+ 0 0 19 -2,-0.8 4,-0.9 -3,-0.1 -1,-0.2 0.021 122.8 68.2 167.6 -20.4 -5.7 158.8 59.7 56 2409 A R H X S+ 0 0 65 -4,-1.0 4,-1.5 2,-0.2 -3,-0.2 0.880 112.3 32.2 -81.0 -45.2 -4.4 157.1 62.9 57 2410 A D H < S+ 0 0 99 -4,-1.8 -1,-0.2 2,-0.2 -3,-0.1 0.385 123.1 51.9 -89.8 -1.2 -7.5 154.8 63.1 58 2411 A L H > S+ 0 0 76 2,-0.1 4,-0.9 -5,-0.1 -2,-0.2 0.649 104.4 56.7-101.6 -28.0 -7.4 155.0 59.3 59 2412 A Q H >X S+ 0 0 4 -4,-0.9 4,-1.4 1,-0.2 3,-0.8 0.967 98.5 57.8 -66.8 -54.1 -3.8 154.0 59.2 60 2413 A D H 3X S+ 0 0 54 -4,-1.5 4,-2.4 1,-0.3 -1,-0.2 0.739 95.7 70.4 -48.1 -27.4 -4.3 150.7 61.2 61 2414 A M H 3> S+ 0 0 87 1,-0.2 4,-1.4 2,-0.2 5,-0.4 0.979 99.5 42.8 -55.7 -60.9 -6.7 149.8 58.4 62 2415 A R H X S+ 0 0 128 -4,-2.4 3,-3.4 1,-0.2 4,-1.0 0.972 121.1 48.0 -52.1 -84.4 -4.6 144.9 58.8 65 2418 A N H 3< S+ 0 0 93 -4,-1.4 -1,-0.2 1,-0.3 -3,-0.2 0.672 119.0 42.5 -31.2 -34.8 -6.1 144.8 55.3 66 2419 A K H >< S+ 0 0 95 -4,-1.9 3,-0.7 -5,-0.4 -1,-0.3 0.707 108.6 57.2 -90.9 -20.7 -2.6 144.6 53.8 67 2420 A E H << S+ 0 0 91 -3,-3.4 -2,-0.2 -4,-1.6 -1,-0.2 0.495 89.7 77.9 -84.3 -2.5 -1.4 142.1 56.4 68 2421 A R T 3< S+ 0 0 186 -4,-1.0 -1,-0.2 -5,-0.1 2,-0.2 0.165 104.8 26.8 -89.0 16.9 -4.2 139.8 55.2 69 2422 A R S < S- 0 0 131 -3,-0.7 2,-0.5 0, 0.0 -3,-0.0 -0.810 97.5 -77.1-154.2-168.2 -2.1 139.0 52.2 70 2423 A H - 0 0 162 -2,-0.2 -2,-0.1 1,-0.0 -3,-0.1 -0.924 54.7-132.6-105.3 129.4 1.4 138.6 50.8 71 2424 A L - 0 0 26 -2,-0.5 2,-0.7 106,-0.1 108,-0.1 -0.167 8.8-114.4 -82.5 176.1 2.9 142.1 50.0 72 2425 A R - 0 0 165 106,-0.1 2,-0.7 2,-0.0 105,-0.2 -0.869 29.6-142.7-113.1 94.1 4.7 143.6 47.0 73 2426 A L - 0 0 69 -2,-0.7 104,-0.1 103,-0.1 105,-0.1 -0.418 21.1-171.9 -61.5 102.7 8.3 144.4 48.2 74 2427 A Q - 0 0 108 -2,-0.7 155,-0.1 1,-0.0 -1,-0.1 -0.889 26.3-117.8-104.3 117.9 9.1 147.6 46.4 75 2428 A P - 0 0 64 0, 0.0 151,-0.1 0, 0.0 102,-0.0 -0.234 35.1-126.5 -51.1 134.5 12.8 148.9 46.7 76 2429 A G > - 0 0 3 150,-0.1 4,-1.1 149,-0.1 5,-0.2 0.112 28.3 -87.7 -72.3-169.4 12.9 152.2 48.5 77 2430 A S H >> S+ 0 0 47 2,-0.2 4,-2.0 3,-0.1 3,-1.2 0.991 120.3 40.2 -62.2 -77.8 14.5 155.5 47.3 78 2431 A L H >> S+ 0 0 5 1,-0.3 4,-1.4 2,-0.2 3,-0.6 0.876 108.7 57.8 -34.9 -76.1 18.0 155.0 48.7 79 2432 A Y H 3> S+ 0 0 47 1,-0.3 4,-1.8 2,-0.2 -1,-0.3 0.752 112.6 42.9 -29.0 -47.4 18.5 151.4 47.9 80 2433 A L H -a 8 0A 39 -2,-0.3 4,-4.6 -83,-0.2 5,-0.4 -0.852 22.2-132.7-100.3 128.8 33.8 159.1 49.7 91 2444 A L T 4 S+ 0 0 12 -83,-0.6 7,-0.3 -2,-0.5 4,-0.2 0.876 113.5 61.1 -43.9 -37.5 33.4 161.1 52.9 92 2445 A Q T >4>S+ 0 0 46 1,-0.2 5,-1.1 2,-0.2 3,-1.0 0.980 117.0 24.4 -51.1 -66.5 37.0 161.5 52.4 93 2446 A A G >45S+ 0 0 62 1,-0.3 3,-2.6 3,-0.2 -2,-0.2 0.920 113.2 69.0 -67.0 -45.7 36.6 163.2 49.1 94 2447 A A G 3<5S+ 0 0 12 -4,-4.6 -1,-0.3 1,-0.3 -2,-0.2 0.451 112.6 33.9 -55.1 3.9 33.1 164.5 49.9 95 2448 A V G < 5S- 0 0 10 -3,-1.0 -1,-0.3 -5,-0.4 -2,-0.2 0.365 121.6-104.5-137.6 -3.3 34.9 166.7 52.3 96 2449 A G T < 5S- 0 0 53 -3,-2.6 -3,-0.2 -4,-0.3 -2,-0.1 0.988 70.7 -58.6 73.7 65.9 38.0 167.3 50.4 97 2450 A D S > + 0 0 126 1,-0.2 4,-2.7 2,-0.1 3,-1.7 0.634 55.5 99.5 -73.0 -14.8 26.6 178.6 64.2 110 2463 A I T 34 + 0 0 145 1,-0.3 3,-0.2 2,-0.2 -1,-0.2 0.866 59.7 71.6 -29.7 -81.6 25.6 180.5 61.2 111 2464 A Y T 34 S- 0 0 133 -3,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.518 132.6 -51.8 -14.4 -38.9 25.6 177.7 58.6 112 2465 A G T <4 - 0 0 19 -3,-1.7 -1,-0.2 99,-0.1 -2,-0.2 0.473 64.2-173.2 159.2 27.1 22.5 176.1 60.1 113 2466 A V < - 0 0 53 -4,-2.7 5,-0.2 -3,-0.2 -3,-0.1 0.511 3.3-174.1 1.4-109.9 22.7 175.5 63.9 114 2467 A S >> - 0 0 26 3,-0.1 3,-2.3 2,-0.1 4,-1.1 0.894 13.5-163.4 93.6 67.9 19.6 173.6 65.0 115 2468 A K T 34 S+ 0 0 72 1,-0.3 4,-0.4 2,-0.2 -2,-0.1 0.454 83.8 79.3 -58.5 4.0 19.8 173.4 68.7 116 2469 A E T 34 S+ 0 0 43 2,-0.1 -1,-0.3 15,-0.0 -2,-0.1 0.385 107.4 22.8 -92.2 0.9 17.2 170.6 68.2 117 2470 A C T <4 S+ 0 0 5 -3,-2.3 3,-0.3 3,-0.1 -2,-0.2 0.556 106.4 71.8-124.9 -65.9 20.0 168.1 67.3 118 2471 A I S < S+ 0 0 37 -4,-1.1 2,-1.2 1,-0.3 -3,-0.1 0.718 92.5 63.9 -21.7 -49.0 23.3 169.4 68.8 119 2472 A N S S+ 0 0 127 -4,-0.4 2,-0.4 -75,-0.1 -1,-0.3 -0.109 85.9 106.2 -77.3 40.1 21.9 168.4 72.2 120 2473 A V + 0 0 1 -2,-1.2 2,-0.3 -3,-0.3 5,-0.1 -0.924 44.6 173.8-118.7 144.7 21.9 164.8 70.8 121 2474 A N > - 0 0 55 -2,-0.4 3,-1.6 3,-0.2 76,-0.1 -0.977 52.7 -87.9-152.1 144.4 24.5 162.3 71.9 122 2475 A S T 3 S+ 0 0 2 -2,-0.3 3,-0.4 1,-0.3 4,-0.1 0.629 127.4 50.7 -20.4 -38.5 24.9 158.6 71.2 123 2476 A K T > S+ 0 0 127 1,-0.2 2,-1.1 2,-0.1 3,-0.8 0.917 108.1 47.9 -74.3 -50.0 22.6 157.9 74.3 124 2477 A N T < S+ 0 0 45 -3,-1.6 -1,-0.2 1,-0.2 -3,-0.2 -0.458 83.4 94.9 -94.1 59.8 19.7 160.2 73.4 125 2478 A A T 3 S+ 0 0 0 -2,-1.1 -1,-0.2 -3,-0.4 4,-0.2 0.509 78.1 56.9-118.9 -21.8 19.3 159.1 69.9 126 2479 A E S < S+ 0 0 81 -3,-0.8 39,-0.4 -4,-0.1 -2,-0.1 0.790 115.2 42.0 -78.9 -28.7 16.6 156.5 70.6 127 2480 A Y S S+ 0 0 172 -4,-0.2 2,-1.1 1,-0.1 38,-0.8 0.825 78.0 104.3 -77.7-106.2 14.6 159.4 72.1 128 2481 A F - 0 0 53 1,-0.1 -1,-0.1 36,-0.1 36,-0.1 -0.452 46.9-169.9 70.4 -93.2 14.7 162.6 70.1 129 2482 A Q - 0 0 69 -2,-1.1 35,-0.3 -4,-0.2 -1,-0.1 0.838 26.4-112.4 63.5 115.7 11.5 163.1 68.2 130 2483 A F B -C 163 0C 4 33,-3.4 33,-2.7 1,-0.1 2,-0.8 -0.320 23.3-118.7 -71.0 159.5 11.4 165.9 65.6 131 2484 A D >> - 0 0 41 31,-0.2 3,-1.8 1,-0.1 4,-1.3 -0.826 15.0-154.9-104.6 93.7 9.2 169.0 66.1 132 2485 A I T 34 S+ 0 0 2 -2,-0.8 5,-0.2 29,-0.4 30,-0.1 0.466 92.7 54.6 -46.9 -0.9 6.7 169.1 63.3 133 2486 A Q T >> S+ 0 0 130 28,-0.4 4,-0.7 3,-0.1 3,-0.6 0.736 103.4 48.8-104.9 -33.4 6.5 172.9 63.9 134 2487 A D T <4 S+ 0 0 123 -3,-1.8 -2,-0.2 1,-0.2 -4,-0.0 0.839 115.2 44.1 -76.4 -35.9 10.2 174.0 63.6 135 2488 A H T 3< S+ 0 0 60 -4,-1.3 -1,-0.2 1,-0.1 -3,-0.1 -0.080 122.3 31.7-100.6 31.4 10.8 172.1 60.3 136 2489 A F T <4 - 0 0 41 -3,-0.6 2,-0.6 -5,-0.1 3,-0.3 0.460 68.7-152.8-147.4 -61.6 7.6 173.1 58.5 137 2490 A G < - 0 0 51 -4,-0.7 -1,-0.1 -5,-0.2 -2,-0.0 -0.706 68.8 -50.0 114.0 -82.4 5.8 176.4 59.0 138 2491 A K S S+ 0 0 122 -2,-0.6 4,-0.4 -92,-0.0 3,-0.3 0.243 92.6 126.2-174.1 4.8 2.1 176.0 58.2 139 2492 A E S > S- 0 0 104 -3,-0.3 3,-1.0 1,-0.2 4,-0.1 0.888 86.8 -4.5 -39.7-109.7 2.0 174.2 54.7 140 2493 A D T 3 S+ 0 0 102 1,-0.2 6,-1.0 2,-0.1 5,-0.4 0.120 117.1 88.0 -81.8 21.4 0.0 170.9 54.4 141 2494 A L T 3 + 0 0 10 -3,-0.3 -1,-0.2 1,-0.1 -2,-0.2 0.429 69.9 71.3 -97.7 -5.7 -0.6 171.2 58.2 142 2495 A C S < S+ 0 0 98 -3,-1.0 -1,-0.1 -4,-0.4 -2,-0.1 0.652 97.1 54.2 -83.9 -19.2 -3.8 173.3 57.9 143 2496 A A S S- 0 0 69 3,-0.1 -92,-0.1 -4,-0.1 -2,-0.1 0.757 104.3 -96.5 -81.2-115.0 -5.8 170.4 56.5 144 2497 A G S S+ 0 0 22 -4,-0.2 -3,-0.1 -97,-0.1 -90,-0.0 0.092 100.9 82.9-163.7 20.7 -6.2 167.0 58.3 145 2498 A K - 0 0 119 -5,-0.4 2,-0.7 1,-0.2 -4,-0.1 0.835 67.3-163.9 -97.8 -48.4 -3.5 165.0 56.5 146 2499 A G - 0 0 8 -6,-1.0 2,-0.4 10,-0.1 -1,-0.2 -0.866 49.7 -22.7 101.2-113.8 -0.3 166.0 58.3 147 2500 A F B -D 155 0D 2 8,-0.9 8,-1.6 -2,-0.7 2,-0.7 -0.971 42.1-161.6-144.6 125.4 2.9 165.2 56.5 148 2501 A Q - 0 0 112 -2,-0.4 2,-0.8 6,-0.2 6,-0.2 -0.933 19.7-159.8-102.5 114.6 3.7 162.6 53.8 149 2502 A L - 0 0 15 -2,-0.7 3,-0.1 4,-0.4 -2,-0.0 -0.836 35.5 -80.9-106.8 101.8 7.5 162.2 53.8 150 2503 A A S S+ 0 0 43 -2,-0.8 2,-1.4 1,-0.2 -1,-0.2 0.549 108.0 50.9 30.2 176.0 8.9 160.7 50.6 151 2504 A D S S- 0 0 47 -3,-0.1 2,-0.3 24,-0.1 -1,-0.2 0.256 116.6 -90.6 53.4 -16.0 9.1 157.1 49.4 152 2505 A G S S+ 0 0 15 -2,-1.4 -3,-0.3 1,-0.3 23,-0.2 -0.864 84.9 102.4 115.8-153.2 5.4 157.0 50.2 153 2506 A G - 0 0 8 21,-0.5 2,-0.4 -2,-0.3 -4,-0.4 0.453 65.3 -97.3 52.9 158.7 3.8 156.0 53.6 154 2507 A W - 0 0 64 16,-0.2 2,-0.4 -6,-0.2 20,-0.2 -0.927 17.3-153.5-121.5 137.3 2.4 158.4 56.1 155 2508 A L B -D 147 0D 4 -8,-1.6 -8,-0.9 -2,-0.4 13,-0.1 -0.849 14.8-145.2-100.7 135.9 3.8 160.0 59.3 156 2509 A I - 0 0 22 -2,-0.4 2,-0.6 -10,-0.1 3,-0.1 -0.539 19.1-134.5-102.9 66.3 1.1 160.9 61.9 157 2510 A P - 0 0 12 0, 0.0 4,-0.3 0, 0.0 6,-0.2 0.280 38.1-124.8 -20.1 62.5 2.7 164.1 63.5 158 2511 A S >> - 0 0 31 -2,-0.6 3,-2.0 3,-0.1 4,-1.4 0.304 26.7 -88.8 -25.0 133.7 1.9 162.8 66.9 159 2512 A N T 34 S+ 0 0 63 1,-0.3 4,-0.0 2,-0.2 -1,-0.0 0.606 115.8 49.9 -6.6 -94.7 -0.2 165.0 69.2 160 2513 A D T 34 S- 0 0 132 1,-0.2 -1,-0.3 2,-0.0 -2,-0.1 0.508 125.0 -88.6 -39.9 -11.2 2.0 167.4 71.3 161 2514 A G T <4 S+ 0 0 12 -3,-2.0 -29,-0.4 1,-0.3 -28,-0.4 0.693 91.6 122.3 102.2 27.3 3.8 168.4 68.1 162 2515 A K < - 0 0 103 -4,-1.4 2,-0.4 -31,-0.2 -1,-0.3 -0.953 39.2-172.2-125.6 142.5 6.5 165.7 68.2 163 2516 A A B +C 130 0C 1 -33,-2.7 -33,-3.4 -2,-0.4 2,-0.2 -0.934 35.9 121.8-134.4 106.7 7.4 162.9 65.7 164 2517 A G > - 0 0 0 -2,-0.4 4,-1.2 -35,-0.3 5,-0.3 -0.552 64.9 -16.5-140.6-154.2 9.9 160.4 66.9 165 2518 A K H > S+ 0 0 54 -38,-0.8 4,-1.2 -39,-0.4 -38,-0.1 0.713 127.0 38.3 -17.2 -80.3 10.5 156.7 67.5 166 2519 A E H >> S+ 0 0 110 2,-0.2 3,-2.4 1,-0.2 4,-1.3 0.936 111.1 55.3 -43.3 -77.1 7.0 155.3 67.4 167 2520 A E H >> S+ 0 0 17 1,-0.3 4,-4.2 2,-0.2 3,-1.0 0.787 108.1 47.3 -22.5 -74.8 5.4 157.4 64.6 168 2521 A F H 3< S+ 0 0 2 -4,-1.2 -1,-0.3 1,-0.3 -2,-0.2 0.756 104.7 62.3 -46.6 -34.3 8.0 156.5 62.0 169 2522 A Y H XX S+ 0 0 37 -3,-2.4 4,-2.4 -4,-1.2 3,-0.5 0.962 117.4 29.4 -57.6 -51.2 7.7 152.8 62.9 170 2523 A R H - 0 0 19 -2,-0.6 3,-2.6 1,-0.1 2,-1.2 -0.713 6.7-166.8-106.6 79.3 5.4 144.6 55.5 180 2533 A P T 3 S+ 0 0 28 0, 0.0 3,-0.3 0, 0.0 -1,-0.1 0.341 78.8 84.7 -49.9 13.3 5.3 145.5 59.2 181 2534 A K T 3 S+ 0 0 113 -2,-1.2 -3,-0.0 1,-0.2 -8,-0.0 0.545 90.4 45.9 -91.2 -14.3 4.7 141.8 59.7 182 2535 A L S < S+ 0 0 95 -3,-2.6 2,-0.3 2,-0.0 -1,-0.2 0.096 111.6 58.2-115.1 19.2 8.5 141.3 59.6 183 2536 A I - 0 0 22 -3,-0.3 2,-0.2 -4,-0.1 -14,-0.0 -0.918 60.8-143.5-145.1 170.7 9.5 144.1 62.0 184 2537 A S > - 0 0 39 -2,-0.3 4,-0.5 1,-0.0 -2,-0.0 -0.789 32.0-111.9-130.1 172.1 9.1 145.6 65.5 185 2538 A S T 4 S+ 0 0 29 -2,-0.2 -16,-0.1 2,-0.2 -15,-0.1 0.468 120.7 43.0 -82.6 -3.8 8.8 149.1 67.2 186 2539 A I T >> S+ 0 0 111 2,-0.2 3,-3.5 3,-0.1 4,-2.5 0.744 102.4 61.4-104.8 -46.1 12.2 148.4 68.8 187 2540 A W H 3> S+ 0 0 43 1,-0.3 4,-1.1 2,-0.2 -2,-0.2 0.789 115.0 41.4 -52.1 -24.9 14.0 146.9 65.7 188 2541 A V H 3< S+ 0 0 1 -4,-0.5 4,-0.4 2,-0.2 -1,-0.3 0.347 104.6 64.8-103.8 -0.1 13.2 150.4 64.5 189 2542 A A H <> S+ 0 0 4 -3,-3.5 4,-1.7 3,-0.1 -2,-0.2 0.770 106.8 44.1 -88.4 -31.7 14.1 151.9 67.9 190 2543 A N H X S+ 0 0 17 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.982 115.4 43.8 -72.6 -64.8 17.7 150.8 67.2 191 2544 A H H X S+ 0 0 1 -4,-1.1 4,-1.5 1,-0.2 5,-0.3 0.792 111.5 56.8 -54.7 -31.5 18.0 151.8 63.6 192 2545 A Y H > S+ 0 0 0 -4,-0.4 4,-2.3 -6,-0.2 -1,-0.2 1.000 108.4 47.6 -60.1 -64.6 16.3 155.1 64.4 193 2546 A R H X S+ 0 0 29 -4,-1.7 4,-2.2 1,-0.2 5,-0.2 0.866 112.0 46.6 -36.6 -69.5 18.9 155.8 67.1 194 2547 A W H X S+ 0 0 9 -4,-2.1 4,-2.3 1,-0.2 -1,-0.2 0.932 113.1 47.9 -39.9 -72.2 22.0 155.1 65.0 195 2548 A I H X S+ 0 0 0 -4,-1.5 4,-2.0 1,-0.2 3,-0.2 0.876 111.2 51.0 -36.2 -65.9 20.9 157.0 61.9 196 2549 A V H X S+ 0 0 8 -4,-2.3 4,-2.7 -5,-0.3 -1,-0.2 0.903 110.6 48.9 -35.0 -71.3 19.9 160.1 63.9 197 2550 A W H X S+ 0 0 2 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.824 110.4 50.7 -38.2 -54.7 23.3 160.1 65.7 198 2551 A K H X S+ 0 0 3 -4,-2.3 4,-1.9 -5,-0.2 3,-0.3 0.983 114.5 43.5 -47.7 -71.5 25.2 159.8 62.5 199 2552 A L H X S+ 0 0 11 -4,-2.0 4,-1.4 1,-0.2 5,-0.2 0.890 107.8 57.6 -35.8 -71.4 23.3 162.7 60.8 200 2553 A A H >X S+ 0 0 6 -4,-2.7 4,-1.5 1,-0.2 3,-0.8 0.860 110.7 45.3 -26.7 -65.7 23.4 164.9 63.8 201 2554 A A H >< S+ 0 0 2 -4,-2.1 3,-1.8 -3,-0.3 5,-0.5 0.950 100.0 67.9 -43.0 -75.5 27.2 164.7 63.7 202 2555 A M H 3X S+ 0 0 11 -4,-1.9 4,-0.6 1,-0.3 -1,-0.2 0.634 102.9 46.1 -12.3 -58.6 27.4 165.2 59.9 203 2556 A E H << S+ 0 0 17 -4,-1.4 -1,-0.3 -3,-0.8 7,-0.3 0.961 109.5 65.2 -56.4 -55.0 26.2 168.8 60.4 204 2557 A F T << S+ 0 0 28 -3,-1.8 2,-1.4 -4,-1.5 -163,-0.1 -0.356 118.0 7.0 -67.6 147.8 28.6 169.2 63.2 205 2558 A A T 4 S+ 0 0 8 -165,-0.1 -104,-1.0 1,-0.1 -1,-0.2 0.105 135.5 54.6 65.7 -29.2 32.4 169.0 62.3 206 2559 A F < + 0 0 6 -2,-1.4 4,-0.2 -4,-0.6 -2,-0.2 -0.497 66.1 123.3-134.8 68.1 31.2 168.9 58.6 207 2560 A P + 0 0 46 0, 0.0 3,-0.3 0, 0.0 -1,-0.1 0.886 58.8 70.8 -90.4 -52.7 28.9 172.0 58.0 208 2561 A K S S+ 0 0 176 1,-0.3 3,-0.1 -3,-0.1 -5,-0.1 0.381 121.4 26.8 -52.4 11.6 30.6 173.9 55.1 209 2562 A E S S+ 0 0 44 1,-0.4 2,-0.3 -6,-0.2 -1,-0.3 0.367 129.3 39.7-146.3 -24.8 29.2 170.8 53.3 210 2563 A F + 0 0 8 -3,-0.3 -1,-0.4 -7,-0.3 2,-0.2 -0.945 50.8 145.5-136.8 158.2 26.3 169.8 55.5 211 2564 A A S > S- 0 0 16 -2,-0.3 3,-0.9 -3,-0.1 4,-0.2 -0.464 75.8 -29.9-151.5-136.5 23.4 171.3 57.6 212 2565 A N T 3 S+ 0 0 65 1,-0.2 -12,-0.0 -2,-0.2 -100,-0.0 0.051 102.6 105.4 -85.5 26.9 19.8 170.4 58.5 213 2566 A R T 3 S+ 0 0 78 1,-0.2 -1,-0.2 2,-0.1 3,-0.1 0.569 83.7 43.7 -78.7 -12.9 19.8 168.7 55.1 214 2567 A C S < S+ 0 0 9 -3,-0.9 6,-0.3 1,-0.1 -1,-0.2 0.679 95.2 71.7-104.3 -28.3 20.0 165.4 57.1 215 2568 A L + 0 0 8 -4,-0.2 -2,-0.1 -16,-0.1 -1,-0.1 0.208 68.1 121.8 -77.0 15.5 17.5 166.0 60.0 216 2569 A N > - 0 0 52 1,-0.2 4,-2.4 -3,-0.1 3,-0.3 -0.733 63.6-143.3 -84.7 105.6 14.6 165.7 57.5 217 2570 A P H > S+ 0 0 5 0, 0.0 4,-3.2 0, 0.0 5,-0.2 0.678 105.0 58.5 -42.1 -19.2 12.3 162.8 58.7 218 2571 A E H > S+ 0 0 82 2,-0.2 4,-2.5 3,-0.2 5,-0.1 0.976 108.7 40.5 -71.9 -64.5 12.0 162.1 55.0 219 2572 A R H >> S+ 0 0 51 -3,-0.3 4,-1.4 2,-0.2 3,-0.9 0.954 122.5 46.2 -40.9 -64.0 15.8 161.7 54.6 220 2573 A V H >X S+ 0 0 1 -4,-2.4 4,-2.2 -6,-0.3 3,-0.5 0.930 110.3 47.1 -43.7 -76.8 15.5 159.8 57.9 221 2574 A L H 3X S+ 0 0 9 -4,-3.2 4,-1.6 1,-0.2 -1,-0.3 0.752 107.5 68.2 -42.9 -22.4 12.5 157.6 57.1 222 2575 A L H XX S+ 0 0 9 -4,-2.5 4,-2.8 -3,-0.9 3,-1.2 0.995 103.7 34.0 -63.1 -65.9 14.4 157.0 54.0 223 2576 A Q H X S+ 0 0 22 -4,-2.8 3,-1.2 1,-0.3 4,-1.0 0.897 99.0 54.9 -33.1 -72.2 16.9 151.4 53.2 227 2580 A R H >X>S+ 0 0 3 -4,-2.6 4,-1.6 1,-0.3 3,-1.5 0.797 102.4 58.2 -30.1 -53.3 17.7 149.2 56.1 228 2581 A Y H S+ 0 0 8 -4,-1.0 5,-2.0 -3,-0.9 4,-1.6 0.931 103.0 51.3 -47.1 -56.2 14.6 147.1 55.3 229 2582 A D H <<>S+ 0 0 1 -4,-1.4 5,-0.8 -3,-1.2 -1,-0.3 0.676 121.1 34.4 -59.5 -17.1 15.7 146.4 51.7 230 2583 A V H S+ 0 0 2 -3,-1.5 5,-1.4 -4,-1.0 6,-0.9 0.868 120.3 36.8-101.3 -73.8 19.1 145.1 53.0 231 2584 A E H <5S+ 0 0 7 -4,-1.6 -3,-0.2 4,-0.2 -2,-0.1 0.756 139.4 17.7 -53.4 -27.2 18.9 143.4 56.4 232 2585 A I T < - 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