==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=11-JAN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 05-MAR-12 4ALW . COMPND 2 MOLECULE: PIM-1 KINASE; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR T.J.STOUT,L.ADAMS . 273 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 12918.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 177 64.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 52 19.0 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.7 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 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 22 8.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 74 27.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.5 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 0 1 2 0 2 1 1 0 0 0 0 0 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 1 1 2 1 1 0 2 1 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 . 2 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 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 34 A L > 0 0 147 0, 0.0 2,-1.4 0, 0.0 3,-1.1 0.000 360.0 360.0 360.0 172.3 7.0 -40.4 -12.0 2 35 A E T 3 + 0 0 49 1,-0.3 5,-0.1 2,-0.2 75,-0.0 -0.504 360.0 98.0 -91.6 62.3 8.6 -41.8 -8.7 3 36 A S T 3 S+ 0 0 80 -2,-1.4 -1,-0.3 3,-0.1 22,-0.0 0.171 75.9 72.2 -97.2 -5.3 7.5 -45.3 -9.1 4 37 A Q S < S+ 0 0 77 -3,-1.1 21,-3.2 1,-0.1 22,-0.5 0.621 97.9 54.5 -79.0 -12.0 11.1 -45.4 -10.4 5 38 A Y E -A 24 0A 15 19,-0.3 2,-0.7 20,-0.1 19,-0.2 -0.982 68.7-144.6-129.4 131.1 12.4 -45.0 -6.8 6 39 A Q E -A 23 0A 122 17,-2.4 17,-1.3 -2,-0.4 2,-0.3 -0.842 29.7-137.7 -84.8 116.4 11.9 -46.7 -3.6 7 40 A V E -A 22 0A 84 -2,-0.7 15,-0.3 15,-0.2 3,-0.1 -0.567 25.6-178.1 -70.0 128.2 12.0 -44.0 -0.8 8 41 A G E - 0 0 26 13,-3.7 3,-0.1 -2,-0.3 -1,-0.1 -0.165 42.7 -30.2-107.5-154.0 14.1 -45.0 2.3 9 42 A P E - 0 0 94 0, 0.0 12,-2.8 0, 0.0 -1,-0.3 -0.176 67.1 -98.0 -65.9 151.4 14.6 -43.0 5.6 10 43 A L E -A 20 0A 90 10,-0.2 10,-0.3 1,-0.1 3,-0.1 -0.522 34.2-170.6 -59.1 131.3 14.8 -39.3 5.9 11 44 A L E - 0 0 108 8,-3.4 2,-0.3 1,-0.4 9,-0.2 0.706 59.7 -35.1 -96.9 -27.6 18.5 -38.2 5.9 12 45 A G E -A 19 0A 30 7,-1.7 7,-3.0 2,-0.0 -1,-0.4 -0.947 51.3-162.2 179.5 161.3 18.0 -34.5 6.8 13 46 A S E +A 18 0A 81 -2,-0.3 2,-0.3 5,-0.3 5,-0.3 -0.981 21.5 131.5-153.3 169.5 15.9 -31.5 6.5 14 47 A G E > -A 17 0A 39 3,-2.8 3,-0.7 -2,-0.3 -2,-0.0 -0.900 69.8 -28.6 178.0-153.8 16.1 -27.7 7.0 15 48 A G T 3 S+ 0 0 64 -2,-0.3 22,-0.1 1,-0.2 3,-0.1 0.850 130.6 51.9 -56.2 -34.6 15.3 -24.3 5.4 16 49 A F T 3 S- 0 0 67 1,-0.2 21,-1.7 20,-0.1 2,-0.3 0.792 118.3 -98.3 -73.4 -32.5 15.7 -25.7 1.9 17 50 A G E < -AB 14 36A 3 -3,-0.7 -3,-2.8 19,-0.2 2,-0.3 -0.976 54.0 -55.6 144.0-137.4 13.3 -28.8 2.3 18 51 A S E -AB 13 35A 35 17,-1.4 17,-3.0 -2,-0.3 2,-0.4 -0.975 32.9-148.2-146.7 152.4 14.2 -32.5 3.0 19 52 A V E -AB 12 34A 26 -7,-3.0 -8,-3.4 -2,-0.3 -7,-1.7 -0.979 12.6-168.9-134.0 139.8 16.3 -35.3 1.7 20 53 A Y E -AB 10 33A 74 13,-2.2 13,-3.2 -2,-0.4 -10,-0.2 -0.887 26.9-115.0-121.5 153.3 15.7 -39.1 1.7 21 54 A S E + B 0 32A 18 -12,-2.8 -13,-3.7 -2,-0.3 2,-0.3 -0.521 47.8 167.8 -77.7 146.8 17.7 -42.1 1.1 22 55 A G E -AB 7 31A 1 9,-2.0 9,-2.1 -15,-0.3 2,-0.4 -0.942 30.5-136.4-155.9 175.7 16.4 -43.9 -2.0 23 56 A I E -AB 6 30A 51 -17,-1.3 -17,-2.4 -2,-0.3 2,-0.6 -0.994 26.2-120.2-144.6 130.0 17.1 -46.7 -4.4 24 57 A R E >> -AB 5 29A 60 5,-2.8 4,-2.3 -2,-0.4 5,-0.6 -0.700 24.3-146.5 -78.2 121.6 16.5 -46.5 -8.1 25 58 A V T 45S+ 0 0 77 -21,-3.2 -1,-0.2 -2,-0.6 -20,-0.1 0.893 88.9 56.0 -59.4 -47.5 14.1 -49.4 -8.8 26 59 A S T 45S+ 0 0 103 -22,-0.5 -1,-0.2 1,-0.2 -21,-0.1 0.940 130.8 7.1 -53.9 -62.3 15.4 -50.4 -12.3 27 60 A D T 45S- 0 0 80 2,-0.1 -1,-0.2 0, 0.0 -2,-0.2 0.367 95.0-117.6-102.9 6.7 19.0 -51.0 -11.3 28 61 A N T <5 + 0 0 114 -4,-2.3 -3,-0.2 1,-0.2 -2,-0.1 0.718 52.5 167.9 60.8 21.0 19.0 -50.7 -7.5 29 62 A L E < -B 24 0A 58 -5,-0.6 -5,-2.8 -6,-0.1 -1,-0.2 -0.492 39.6-117.4 -66.0 128.9 21.4 -47.7 -7.7 30 63 A P E +B 23 0A 42 0, 0.0 59,-1.1 0, 0.0 2,-0.3 -0.477 46.7 166.1 -64.2 133.4 21.7 -45.9 -4.4 31 64 A V E -BC 22 88A 0 -9,-2.1 -9,-2.0 57,-0.2 2,-0.4 -0.895 33.8-130.1-137.0 172.9 20.4 -42.3 -4.7 32 65 A A E -BC 21 87A 13 55,-2.7 55,-2.7 -2,-0.3 2,-0.6 -0.968 19.1-147.7-124.8 148.0 19.4 -39.4 -2.5 33 66 A I E -BC 20 86A 3 -13,-3.2 -13,-2.2 -2,-0.4 2,-0.6 -0.954 13.5-165.7-125.0 107.9 16.1 -37.7 -3.1 34 67 A K E -BC 19 85A 12 51,-3.2 51,-3.5 -2,-0.6 2,-0.6 -0.885 6.9-158.2-106.6 123.9 16.0 -34.0 -2.4 35 68 A H E -BC 18 84A 38 -17,-3.0 -17,-1.4 -2,-0.6 2,-0.5 -0.859 8.4-165.4-100.2 118.9 12.8 -32.1 -2.1 36 69 A V E -BC 17 83A 6 47,-2.7 47,-2.5 -2,-0.6 2,-0.4 -0.931 15.8-136.4-113.1 117.3 13.3 -28.3 -2.6 37 70 A E E > - C 0 82A 60 -21,-1.7 3,-1.5 -2,-0.5 4,-0.4 -0.603 10.6-137.7 -75.7 125.6 10.3 -26.2 -1.5 38 71 A K G > S+ 0 0 38 43,-3.0 3,-2.0 -2,-0.4 44,-0.1 0.889 98.4 56.0 -45.6 -46.8 9.5 -23.4 -4.1 39 72 A D G 3 S+ 0 0 128 42,-0.4 -1,-0.2 1,-0.3 43,-0.1 0.514 106.9 51.4 -75.8 -7.2 8.9 -20.6 -1.6 40 73 A R G < S+ 0 0 123 -3,-1.5 2,-0.8 -24,-0.2 -1,-0.3 0.429 76.6 118.6-104.5 -2.6 12.3 -21.1 -0.1 41 74 A I < - 0 0 26 -3,-2.0 3,-0.1 -4,-0.4 115,-0.1 -0.490 46.1-167.0 -66.9 105.3 14.2 -21.0 -3.4 42 75 A S S S+ 0 0 52 -2,-0.8 2,-0.3 113,-0.3 -1,-0.2 0.707 71.7 20.7 -66.3 -20.3 16.5 -17.9 -3.0 43 76 A D - 0 0 56 112,-0.2 12,-2.5 -3,-0.0 13,-0.4 -0.976 63.0-159.5-153.0 137.2 17.3 -17.9 -6.9 44 77 A W E +E 54 0B 72 -2,-0.3 2,-0.2 10,-0.3 8,-0.1 -0.777 14.8 167.6-113.6 159.3 15.9 -19.2 -10.1 45 78 A G E -E 53 0B 18 8,-2.6 8,-1.2 -2,-0.3 2,-0.3 -0.707 24.0-120.8-146.9-168.7 17.5 -19.8 -13.4 46 79 A E E -E 52 0B 130 -2,-0.2 6,-0.2 6,-0.2 -2,-0.0 -0.992 21.7-101.3-152.8 164.5 16.5 -21.5 -16.6 47 80 A L - 0 0 12 4,-1.1 11,-0.0 -2,-0.3 5,-0.0 -0.229 36.4-102.6 -86.2 159.8 17.7 -24.3 -18.8 48 81 A P S S+ 0 0 129 0, 0.0 -1,-0.1 0, 0.0 10,-0.0 0.956 134.5 39.1 -40.7 -59.8 19.6 -24.3 -22.1 49 82 A N S S- 0 0 137 1,-0.1 -3,-0.0 2,-0.0 0, 0.0 0.979 129.0-113.6 -49.2 -52.7 16.2 -25.0 -23.7 50 83 A G + 0 0 32 1,-0.1 2,-0.3 0, 0.0 -1,-0.1 0.754 54.9 159.3 120.1 43.1 14.9 -22.5 -21.1 51 84 A T - 0 0 53 1,-0.0 -4,-1.1 0, 0.0 2,-1.0 -0.705 50.2-106.9 -85.2 140.6 12.6 -24.1 -18.5 52 85 A R E +E 46 0B 150 -2,-0.3 -6,-0.2 -6,-0.2 -1,-0.0 -0.546 58.8 153.0 -76.6 102.8 12.1 -22.2 -15.2 53 86 A V E -E 45 0B 0 -8,-1.2 -8,-2.6 -2,-1.0 5,-0.0 -0.790 52.1 -80.1-122.5 158.1 14.1 -24.3 -12.5 54 87 A P E >> -E 44 0B 2 0, 0.0 4,-1.5 0, 0.0 3,-1.2 -0.382 40.5-121.6 -52.9 141.7 15.9 -23.6 -9.3 55 88 A M H 3> S+ 0 0 25 -12,-2.5 4,-3.3 1,-0.3 5,-0.3 0.891 113.1 70.2 -48.4 -39.5 19.4 -22.1 -9.9 56 89 A E H 3> S+ 0 0 13 -13,-0.4 4,-2.5 1,-0.2 -1,-0.3 0.890 98.6 47.7 -48.7 -43.8 20.6 -25.2 -7.9 57 90 A V H <> S+ 0 0 0 -3,-1.2 4,-2.2 2,-0.2 -1,-0.2 0.940 110.9 50.2 -66.2 -39.8 19.5 -27.4 -10.9 58 91 A V H X S+ 0 0 20 -4,-1.5 4,-2.3 1,-0.2 -2,-0.2 0.948 113.7 46.1 -61.1 -44.2 21.3 -25.1 -13.4 59 92 A L H X S+ 0 0 0 -4,-3.3 4,-1.7 1,-0.2 -2,-0.2 0.925 110.2 51.9 -67.5 -42.8 24.5 -25.2 -11.2 60 93 A L H X S+ 0 0 3 -4,-2.5 4,-1.0 -5,-0.3 13,-0.3 0.888 109.6 50.7 -61.0 -38.2 24.4 -28.9 -10.8 61 94 A K H >< S+ 0 0 98 -4,-2.2 3,-0.7 1,-0.2 -2,-0.2 0.942 107.5 53.7 -66.5 -40.9 24.1 -29.4 -14.6 62 95 A K H 3< S+ 0 0 96 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.862 115.0 40.0 -60.5 -36.3 27.1 -27.1 -15.2 63 96 A V H 3< S+ 0 0 2 -4,-1.7 -1,-0.3 -5,-0.1 -2,-0.2 0.535 84.6 121.8 -93.7 -7.6 29.3 -29.1 -12.9 64 97 A S << + 0 0 47 -4,-1.0 2,-0.3 -3,-0.7 8,-0.1 -0.308 35.0 120.5 -54.6 126.1 28.0 -32.6 -13.9 65 98 A S S S- 0 0 39 2,-0.2 5,-0.1 5,-0.2 -2,-0.0 -0.958 78.8 -84.5-168.0-178.3 30.9 -34.8 -15.1 66 99 A G S S+ 0 0 68 -2,-0.3 2,-0.5 2,-0.0 -2,-0.1 0.479 89.7 115.8 -79.5 -2.0 32.8 -38.1 -14.3 67 100 A F > - 0 0 76 -4,-0.2 3,-0.9 1,-0.2 -2,-0.2 -0.577 58.5-155.5 -67.0 117.4 34.8 -36.1 -11.8 68 101 A S T 3 S+ 0 0 42 -2,-0.5 -1,-0.2 1,-0.2 4,-0.1 0.474 75.6 83.8 -80.0 0.7 33.8 -37.7 -8.5 69 102 A G T 3 S+ 0 0 6 81,-0.1 82,-2.4 2,-0.1 2,-0.4 0.576 89.6 50.4 -81.9 -12.3 34.6 -34.6 -6.3 70 103 A V B < S-f 151 0C 6 -3,-0.9 -5,-0.2 80,-0.3 82,-0.2 -0.989 98.8-103.7-122.8 137.9 31.3 -32.9 -6.9 71 104 A I - 0 0 5 80,-2.8 2,-0.5 -2,-0.4 -2,-0.1 -0.237 35.0-124.7 -60.1 145.7 27.9 -34.7 -6.5 72 105 A R - 0 0 98 -8,-0.1 16,-2.2 -4,-0.1 2,-0.6 -0.868 7.6-139.9 -97.8 125.1 26.2 -35.8 -9.6 73 106 A L E -D 87 0A 22 -2,-0.5 14,-0.2 -13,-0.3 3,-0.1 -0.744 21.5-178.9 -74.6 116.9 22.5 -34.8 -10.4 74 107 A L E - 0 0 60 12,-3.2 2,-0.3 -2,-0.6 13,-0.2 0.762 58.9 -30.9 -87.9 -32.7 20.9 -37.9 -11.9 75 108 A D E -D 86 0A 59 11,-1.5 11,-2.9 2,-0.0 -1,-0.4 -0.974 54.1-151.6-174.9 169.6 17.5 -36.6 -12.6 76 109 A W E -D 85 0A 47 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.973 2.8-160.3-157.9 158.4 14.9 -34.1 -11.5 77 110 A F E -D 84 0A 37 7,-2.0 7,-2.8 -2,-0.3 2,-0.3 -0.940 15.5-132.5-140.7 146.6 11.1 -33.6 -11.4 78 111 A E E +D 83 0A 101 -2,-0.3 5,-0.2 5,-0.2 -25,-0.0 -0.841 24.6 176.1 -99.2 146.3 8.8 -30.7 -11.0 79 112 A R - 0 0 107 3,-2.3 3,-0.3 -2,-0.3 -2,-0.0 -0.904 47.0 -91.8-139.7 164.3 5.7 -30.6 -8.6 80 113 A P S S+ 0 0 114 0, 0.0 3,-0.1 0, 0.0 -2,-0.0 0.826 120.2 13.1 -50.2 -39.2 3.2 -27.9 -7.7 81 114 A D S S+ 0 0 106 1,-0.1 -43,-3.0 -43,-0.1 -42,-0.4 0.455 129.0 23.4-119.7 3.0 5.2 -26.7 -4.6 82 115 A S E -C 37 0A 10 -3,-0.3 -3,-2.3 -45,-0.3 2,-0.3 -0.955 61.9-124.2-153.6 160.3 8.5 -28.3 -4.9 83 116 A F E -CD 36 78A 0 -47,-2.5 -47,-2.7 -2,-0.3 2,-0.5 -0.922 21.7-142.9-105.7 161.3 11.2 -29.8 -7.1 84 117 A V E -CD 35 77A 0 -7,-2.8 -7,-2.0 -2,-0.3 2,-0.5 -0.964 13.5-164.3-125.7 117.5 12.6 -33.3 -6.6 85 118 A L E -CD 34 76A 0 -51,-3.5 -51,-3.2 -2,-0.5 2,-0.5 -0.884 7.7-152.1-100.2 135.3 16.3 -33.8 -7.3 86 119 A I E -CD 33 75A 0 -11,-2.9 -12,-3.2 -2,-0.5 -11,-1.5 -0.921 24.9-179.4-108.0 121.3 17.8 -37.2 -7.7 87 120 A L E -CD 32 73A 18 -55,-2.7 -55,-2.7 -2,-0.5 -14,-0.2 -0.865 33.0 -92.9-126.2 153.3 21.4 -37.3 -6.7 88 121 A E E -C 31 0A 53 -16,-2.2 -57,-0.2 -2,-0.3 -1,-0.1 -0.200 37.0-156.5 -49.4 145.1 24.2 -39.8 -6.5 89 122 A R - 0 0 35 -59,-1.1 2,-0.1 -58,-0.1 -1,-0.1 -0.913 3.1-150.9-138.6 109.9 24.5 -41.5 -3.1 90 123 A P - 0 0 11 0, 0.0 3,-0.2 0, 0.0 52,-0.1 -0.377 26.1-122.6 -68.0 154.4 27.9 -43.0 -2.0 91 124 A E S S+ 0 0 119 1,-0.4 2,-0.1 -2,-0.1 52,-0.1 -0.908 91.9 22.6-156.8 121.0 27.5 -45.9 0.4 92 125 A P S S+ 0 0 44 0, 0.0 52,-1.1 0, 0.0 53,-0.6 0.621 94.9 158.5 -74.1 151.6 28.7 -46.2 3.2 93 126 A V E -G 143 0C 49 50,-0.2 2,-0.3 -3,-0.2 50,-0.2 -0.953 23.0-175.9-139.5 156.3 28.9 -42.3 3.5 94 127 A Q E -G 142 0C 36 48,-1.4 48,-2.6 -2,-0.3 2,-0.1 -0.953 28.1-119.0-153.1 136.8 29.1 -39.8 6.3 95 128 A D E > -G 141 0C 36 -2,-0.3 4,-2.5 46,-0.3 46,-0.2 -0.358 28.1-115.3 -73.4 160.3 29.2 -36.0 6.1 96 129 A L H > S+ 0 0 0 44,-2.7 4,-2.3 41,-0.9 42,-0.2 0.815 111.6 60.4 -72.3 -27.9 32.1 -34.2 7.3 97 130 A F H > S+ 0 0 88 40,-0.7 4,-2.4 43,-0.3 -1,-0.2 0.945 110.3 41.9 -60.8 -44.3 30.3 -32.4 10.2 98 131 A D H > S+ 0 0 73 2,-0.2 4,-2.3 1,-0.2 5,-0.2 0.877 111.4 56.0 -72.1 -37.4 29.3 -35.8 11.7 99 132 A F H X S+ 0 0 4 -4,-2.5 4,-2.9 2,-0.2 -1,-0.2 0.945 111.2 43.4 -55.8 -50.3 32.8 -37.2 11.1 100 133 A I H X S+ 0 0 7 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.898 111.4 54.9 -63.3 -40.8 34.3 -34.3 13.1 101 134 A T H < S+ 0 0 98 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.907 116.1 38.9 -57.0 -35.8 31.6 -34.7 15.8 102 135 A E H < S+ 0 0 139 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.913 128.6 29.1 -88.3 -35.8 32.5 -38.3 16.2 103 136 A R H < S- 0 0 101 -4,-2.9 -3,-0.2 1,-0.2 -2,-0.2 0.532 91.8-145.3-104.8 -4.7 36.3 -38.0 15.8 104 137 A G < + 0 0 32 -4,-2.3 -1,-0.2 -5,-0.2 101,-0.2 -0.256 62.9 3.1 67.1-158.7 37.2 -34.5 17.1 105 138 A A S S- 0 0 37 99,-0.3 2,-0.3 98,-0.1 98,-0.2 -0.196 83.8-121.0 -56.9 137.7 40.0 -32.5 15.6 106 139 A L - 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0 0 19 -2,-0.3 -9,-0.1 1,-0.1 -10,-0.1 -0.333 31.8-130.6 -73.4 157.5 34.9 -23.2 13.7 208 241 A P S S+ 0 0 18 0, 0.0 2,-0.4 0, 0.0 13,-0.2 0.794 83.2 44.4 -82.5 -23.1 36.9 -20.2 14.9 209 242 A F + 0 0 4 -36,-0.3 3,-0.1 1,-0.1 -2,-0.1 -0.941 42.5 165.1-126.1 129.8 34.2 -17.4 15.0 210 243 A E + 0 0 109 -2,-0.4 2,-0.2 1,-0.1 -1,-0.1 0.634 66.7 56.3-103.6 -36.5 30.7 -17.4 16.4 211 244 A H S > S- 0 0 109 1,-0.1 4,-2.2 -38,-0.0 3,-0.5 -0.606 80.7-121.7-103.2 152.6 29.8 -13.7 16.6 212 245 A D H > S+ 0 0 46 1,-0.2 4,-2.6 -2,-0.2 5,-0.2 0.865 114.4 57.7 -51.4 -38.2 29.9 -11.0 13.9 213 246 A E H > S+ 0 0 131 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.896 105.5 48.7 -66.2 -39.5 32.3 -9.1 16.0 214 247 A E H > S+ 0 0 77 -3,-0.5 4,-2.6 2,-0.2 5,-0.5 0.896 110.9 51.8 -65.4 -40.3 34.8 -12.0 16.0 215 248 A I H < S+ 0 0 0 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.967 111.9 45.4 -57.9 -50.2 34.4 -12.3 12.2 216 249 A I H < S+ 0 0 61 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.835 112.3 49.8 -68.5 -34.0 35.2 -8.6 11.6 217 250 A R H < S- 0 0 173 -4,-1.9 -1,-0.2 -5,-0.2 -2,-0.2 0.901 88.7-161.2 -72.4 -36.0 38.2 -8.6 14.0 218 251 A G < + 0 0 15 -4,-2.6 2,-0.6 1,-0.2 -3,-0.1 0.723 30.1 152.9 74.2 21.2 39.6 -11.7 12.2 219 252 A Q - 0 0 106 -5,-0.5 2,-0.5 2,-0.0 -1,-0.2 -0.740 32.2-151.3 -94.3 122.0 41.9 -12.7 15.1 220 253 A V - 0 0 4 -2,-0.6 2,-0.5 11,-0.0 -11,-0.1 -0.826 11.7-170.0 -99.7 129.5 42.5 -16.5 15.1 221 254 A F - 0 0 155 -2,-0.5 2,-0.6 -13,-0.2 -2,-0.0 -0.955 17.8-138.9-114.4 127.5 43.2 -18.4 18.3 222 255 A F - 0 0 22 -2,-0.5 4,-0.1 1,-0.1 -18,-0.0 -0.782 18.8-178.3 -88.1 120.3 44.4 -22.1 18.0 223 256 A R S S+ 0 0 113 -2,-0.6 2,-0.3 2,-0.1 -1,-0.1 0.563 70.2 44.1 -96.4 -10.2 42.7 -24.1 20.7 224 257 A Q S S- 0 0 99 -21,-0.0 2,-0.5 0, 0.0 -21,-0.0 -0.831 103.5 -87.1-123.4 166.5 44.5 -27.5 19.6 225 258 A R + 0 0 212 -2,-0.3 2,-0.4 -21,-0.0 -2,-0.1 -0.639 56.3 169.4 -76.6 121.3 48.1 -28.0 18.8 226 259 A V - 0 0 3 -2,-0.5 -4,-0.1 -4,-0.1 5,-0.0 -0.990 38.1-100.9-137.5 144.1 48.4 -27.3 15.1 227 260 A S > - 0 0 25 -2,-0.4 4,-2.3 1,-0.1 5,-0.2 -0.128 28.9-117.6 -67.4 153.8 51.7 -26.9 13.1 228 261 A S H > S+ 0 0 95 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.829 114.6 56.2 -65.5 -28.0 53.0 -23.4 12.3 229 262 A E H > S+ 0 0 101 2,-0.2 4,-2.1 1,-0.2 27,-0.3 0.934 109.7 44.8 -68.6 -44.4 52.7 -24.2 8.5 230 263 A C H > S+ 0 0 0 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.916 113.7 50.0 -61.2 -46.0 49.0 -25.1 8.9 231 264 A Q H X S+ 0 0 48 -4,-2.3 4,-2.7 2,-0.2 5,-0.2 0.912 109.1 52.9 -59.2 -41.4 48.4 -22.0 11.1 232 265 A H H X S+ 0 0 107 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.926 111.2 46.0 -61.4 -43.2 50.1 -19.8 8.5 233 266 A L H X S+ 0 0 0 -4,-2.1 4,-2.9 2,-0.2 -1,-0.2 0.912 113.2 49.2 -67.3 -43.1 47.8 -21.1 5.7 234 267 A I H X S+ 0 0 0 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.935 112.5 46.4 -63.6 -46.0 44.7 -20.7 7.9 235 268 A R H < S+ 0 0 98 -4,-2.7 -1,-0.2 1,-0.2 -2,-0.2 0.814 112.0 53.4 -71.7 -26.6 45.5 -17.1 8.8 236 269 A W H >< S+ 0 0 73 -4,-2.0 3,-1.9 -5,-0.2 -2,-0.2 0.961 108.3 47.6 -67.1 -51.4 46.4 -16.4 5.1 237 270 A C H 3< S+ 0 0 0 -4,-2.9 -41,-0.2 1,-0.3 -2,-0.2 0.831 112.9 52.5 -53.5 -33.8 42.9 -17.7 3.9 238 271 A L T 3< S+ 0 0 5 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.036 75.0 148.3 -98.8 29.2 41.4 -15.5 6.7 239 272 A A < - 0 0 17 -3,-1.9 6,-0.2 1,-0.1 5,-0.1 -0.370 50.3-134.6 -58.5 130.1 43.2 -12.2 5.7 240 273 A L S S+ 0 0 86 -23,-0.1 -62,-0.2 4,-0.1 -1,-0.1 0.928 91.8 65.6 -57.6 -46.9 40.8 -9.4 6.6 241 274 A R S > S- 0 0 145 1,-0.1 3,-2.3 -64,-0.1 4,-0.4 -0.720 83.5-139.6 -81.3 124.0 41.4 -7.7 3.2 242 275 A P G > S+ 0 0 47 0, 0.0 3,-1.6 0, 0.0 -1,-0.1 0.811 101.8 54.1 -49.3 -41.3 40.0 -9.8 0.4 243 276 A S G 3 S+ 0 0 91 1,-0.3 -3,-0.1 -3,-0.0 -2,-0.0 0.598 99.4 65.7 -80.0 -8.9 43.0 -9.1 -1.9 244 277 A D G < S+ 0 0 81 -3,-2.3 -1,-0.3 -5,-0.1 -4,-0.1 0.556 83.3 96.8 -80.7 -9.3 45.3 -10.3 0.9 245 278 A R S < S- 0 0 13 -3,-1.6 -8,-0.2 -4,-0.4 -9,-0.1 -0.422 82.8-104.5 -84.0 154.5 44.0 -13.9 0.7 246 279 A P - 0 0 4 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.370 28.0-124.5 -69.6 158.1 45.7 -16.6 -1.4 247 280 A T > - 0 0 76 1,-0.1 4,-2.4 -55,-0.0 5,-0.2 -0.473 38.2 -95.9 -84.4 175.2 44.4 -17.7 -4.8 248 281 A F H > S+ 0 0 30 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.884 128.3 53.4 -57.4 -40.6 43.7 -21.5 -5.2 249 282 A E H > S+ 0 0 137 2,-0.2 4,-1.6 1,-0.2 -1,-0.2 0.935 107.8 48.8 -62.9 -44.6 47.0 -21.9 -6.8 250 283 A E H 4 S+ 0 0 86 1,-0.2 4,-0.5 2,-0.2 -2,-0.2 0.883 111.8 50.5 -64.6 -34.3 48.8 -20.2 -3.8 251 284 A I H >< S+ 0 0 0 -4,-2.4 3,-1.6 1,-0.2 6,-0.3 0.973 111.6 46.6 -67.1 -48.8 46.8 -22.5 -1.4 252 285 A Q H 3< S+ 0 0 12 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.715 113.4 50.0 -73.3 -16.0 47.8 -25.7 -3.3 253 286 A N T 3< S+ 0 0 101 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.460 83.8 121.0 -91.1 -0.2 51.5 -24.6 -3.5 254 287 A H S X S- 0 0 10 -3,-1.6 3,-1.8 -4,-0.5 4,-0.2 -0.317 75.7-120.4 -63.6 143.3 51.6 -23.8 0.2 255 288 A P G > S+ 0 0 74 0, 0.0 3,-1.3 0, 0.0 -1,-0.1 0.838 113.6 59.6 -53.2 -33.5 54.3 -25.8 2.1 256 289 A W G 3 S+ 0 0 1 -27,-0.3 -26,-0.1 1,-0.2 -4,-0.1 0.798 100.7 56.5 -65.8 -24.5 51.5 -27.3 4.3 257 290 A M G < S+ 0 0 2 -3,-1.8 3,-0.4 -6,-0.3 -1,-0.2 0.305 82.2 112.8 -86.6 4.9 49.8 -28.8 1.2 258 291 A Q S < S+ 0 0 85 -3,-1.3 -5,-0.0 1,-0.2 -146,-0.0 -0.431 71.9 19.0 -88.5 152.8 52.7 -30.9 -0.1 259 292 A D S S- 0 0 155 1,-0.2 -1,-0.2 -2,-0.1 2,-0.1 0.860 79.7-174.2 66.4 43.3 52.9 -34.7 -0.2 260 293 A V - 0 0 40 -3,-0.4 -1,-0.2 1,-0.1 2,-0.1 -0.413 25.1-110.9 -73.0 148.7 49.1 -35.2 0.1 261 294 A L - 0 0 23 -152,-0.4 -1,-0.1 1,-0.1 3,-0.0 -0.441 29.5-110.8 -69.8 153.3 47.9 -38.7 0.4 262 295 A L > - 0 0 116 -2,-0.1 4,-2.5 1,-0.1 5,-0.2 -0.423 32.9-110.0 -75.8 156.8 45.9 -40.4 -2.4 263 296 A P H > S+ 0 0 42 0, 0.0 4,-2.8 0, 0.0 5,-0.2 0.945 118.1 49.9 -56.6 -46.9 42.3 -40.9 -1.5 264 297 A Q H > S+ 0 0 77 1,-0.3 4,-2.4 2,-0.2 9,-0.2 0.896 112.3 48.3 -57.0 -45.2 42.6 -44.8 -1.3 265 298 A E H > S+ 0 0 70 1,-0.2 4,-2.9 2,-0.2 5,-0.3 0.854 109.5 54.3 -59.1 -39.2 45.6 -44.4 1.0 266 299 A T H X>S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 5,-0.9 0.931 109.2 46.7 -60.9 -42.8 43.6 -42.0 3.0 267 300 A A H X>S+ 0 0 0 -4,-2.8 4,-1.3 -121,-0.3 6,-1.2 0.939 113.9 48.8 -64.7 -44.6 40.8 -44.5 3.4 268 301 A E H <5S+ 0 0 123 -4,-2.4 4,-0.2 4,-0.2 -2,-0.2 0.923 120.2 34.3 -63.4 -47.6 43.3 -47.3 4.4 269 302 A I H <5S+ 0 0 96 -4,-2.9 -2,-0.2 -5,-0.1 -1,-0.2 0.883 135.7 15.8 -74.0 -41.8 45.1 -45.3 7.0 270 303 A H H <5S+ 0 0 10 -4,-2.5 -3,-0.2 -5,-0.3 -2,-0.2 0.655 128.9 39.0-114.3 -23.6 42.4 -43.1 8.4 271 304 A L T <