==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-SEP-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE/TRANSFERASE INHIBITOR 19-AUG-13 4MBL . COMPND 2 MOLECULE: SERINE/THREONINE-PROTEIN KINASE PIM-1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR R.AZEVEDO,T.O.FISCHMANN . 274 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13466.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 171 62.4 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 . 51 18.6 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 . 14 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 23 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 74 27.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 5 1.8 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 3 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 . 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 33 A P 0 0 162 0, 0.0 3,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -51.3 40.2 -13.6 -17.8 2 34 A L - 0 0 130 1,-0.2 3,-0.2 2,-0.1 0, 0.0 0.434 360.0 -95.5 64.0 158.3 38.8 -14.5 -14.2 3 35 A E S S+ 0 0 26 1,-0.2 3,-0.3 2,-0.1 -1,-0.2 -0.009 100.8 90.1 -96.0 29.8 39.4 -12.5 -10.9 4 36 A S + 0 0 96 -3,-0.3 -1,-0.2 1,-0.2 -2,-0.1 -0.245 50.9 96.4-123.4 48.1 42.4 -14.7 -9.7 5 37 A Q S S+ 0 0 68 -3,-0.2 21,-2.0 21,-0.0 22,-0.6 0.189 81.7 68.4-108.2 6.4 45.2 -12.6 -11.4 6 38 A Y E S-A 25 0A 19 -3,-0.3 2,-0.6 19,-0.2 19,-0.2 -0.975 78.0-138.1-128.0 140.2 45.4 -10.9 -7.9 7 39 A Q E -A 24 0A 119 17,-2.8 17,-0.7 -2,-0.3 2,-0.1 -0.889 25.9-132.3-100.8 112.0 46.7 -12.5 -4.6 8 40 A V E +A 23 0A 85 -2,-0.6 15,-0.2 15,-0.2 3,-0.1 -0.378 31.8 169.9 -69.2 137.4 44.5 -11.5 -1.6 9 41 A G E - 0 0 27 13,-2.5 -1,-0.1 1,-0.2 14,-0.1 -0.270 43.2 -20.1-124.1-156.7 46.1 -10.2 1.6 10 42 A P E - 0 0 98 0, 0.0 12,-2.8 0, 0.0 2,-0.5 -0.289 66.4-107.1 -61.0 144.7 45.0 -8.6 4.9 11 43 A L E -A 21 0A 85 10,-0.2 10,-0.3 1,-0.2 3,-0.1 -0.576 29.7-167.1 -69.9 117.5 41.6 -6.7 5.2 12 44 A L E - 0 0 104 8,-2.0 2,-0.3 -2,-0.5 9,-0.2 0.858 58.5 -42.5 -77.1 -38.7 42.6 -3.0 5.3 13 45 A G E -A 20 0A 24 7,-1.8 7,-3.0 2,-0.0 -1,-0.3 -0.976 48.3-149.3-178.8 169.1 39.1 -1.9 6.4 14 46 A S E +A 19 0A 78 -2,-0.3 2,-0.2 5,-0.2 5,-0.2 -0.985 30.7 115.8-153.3 155.6 35.4 -2.1 6.1 15 47 A G E > S-A 18 0A 47 3,-2.2 3,-0.9 -2,-0.3 -2,-0.0 -0.789 83.6 -33.5-176.7-141.5 32.2 0.0 6.4 16 48 A G T 3 S+ 0 0 55 1,-0.2 3,-0.1 -2,-0.2 25,-0.0 0.766 129.5 65.9 -73.8 -27.7 29.4 1.3 4.2 17 49 A F T 3 S- 0 0 77 1,-0.2 2,-0.4 20,-0.1 -1,-0.2 0.463 113.0-119.4 -66.5 -11.8 32.0 1.6 1.4 18 50 A G E < -A 15 0A 15 -3,-0.9 -3,-2.2 19,-0.1 2,-0.4 -0.842 50.9 -37.6 107.1-136.6 32.2 -2.3 1.5 19 51 A S E -AB 14 36A 34 17,-1.7 17,-2.4 -2,-0.4 2,-0.4 -0.996 46.9-157.7-135.0 129.9 35.5 -4.1 2.3 20 52 A V E -AB 13 35A 28 -7,-3.0 -8,-2.0 -2,-0.4 -7,-1.8 -0.895 12.7-172.9-112.7 133.8 39.1 -3.1 1.2 21 53 A Y E -AB 11 34A 70 13,-2.1 13,-2.8 -2,-0.4 2,-0.3 -0.948 28.6-116.7-124.8 150.7 41.9 -5.7 1.1 22 54 A S E + B 0 33A 18 -12,-2.8 -13,-2.5 -2,-0.3 2,-0.3 -0.635 47.4 175.0 -81.3 134.0 45.6 -5.4 0.5 23 55 A G E -AB 8 32A 1 9,-3.0 9,-2.0 -2,-0.3 2,-0.3 -0.832 27.3-142.6-135.8 174.0 46.4 -7.3 -2.7 24 56 A I E -AB 7 31A 58 -17,-0.7 -17,-2.8 -2,-0.3 2,-0.6 -0.991 23.6-123.6-140.0 135.1 49.3 -8.1 -5.2 25 57 A R E >>> -AB 6 30A 61 5,-2.7 4,-1.4 -2,-0.3 3,-1.1 -0.747 17.8-150.3 -83.5 119.0 49.0 -8.4 -9.0 26 58 A V T 345S+ 0 0 90 -21,-2.0 3,-0.2 -2,-0.6 -1,-0.2 0.853 90.3 63.4 -56.3 -40.5 50.3 -11.9 -9.8 27 59 A S T 345S- 0 0 98 -22,-0.6 -1,-0.2 1,-0.2 -21,-0.1 0.673 130.6 -1.4 -57.1 -30.5 51.7 -10.8 -13.3 28 60 A D T <45S- 0 0 77 -3,-1.1 -1,-0.2 2,-0.1 -2,-0.2 0.146 93.1-109.2-153.3 24.7 54.2 -8.3 -11.8 29 61 A N T <5 + 0 0 127 -4,-1.4 -3,-0.2 -3,-0.2 -2,-0.0 0.666 59.8 165.6 48.9 25.5 54.0 -8.3 -8.0 30 62 A L E < -B 25 0A 61 -5,-0.6 -5,-2.7 1,-0.1 -1,-0.2 -0.532 39.8-117.9 -72.3 128.1 52.4 -4.8 -8.2 31 63 A P E +B 24 0A 41 0, 0.0 59,-1.0 0, 0.0 2,-0.3 -0.400 43.2 170.8 -66.7 140.6 50.8 -3.8 -5.0 32 64 A V E -BC 23 89A 0 -9,-2.0 -9,-3.0 57,-0.2 2,-0.4 -0.938 31.9-130.6-143.1 163.9 47.0 -3.2 -5.2 33 65 A A E -BC 22 88A 12 55,-2.0 55,-2.7 -2,-0.3 2,-0.5 -0.959 20.1-152.4-116.0 135.4 43.9 -2.5 -3.0 34 66 A I E -BC 21 87A 0 -13,-2.8 -13,-2.1 -2,-0.4 2,-0.5 -0.964 10.1-167.8-113.4 114.7 40.8 -4.7 -3.7 35 67 A K E -BC 20 86A 11 51,-2.4 51,-2.6 -2,-0.5 2,-0.6 -0.913 5.6-159.1-107.2 125.5 37.4 -3.1 -2.8 36 68 A H E -BC 19 85A 41 -17,-2.4 -17,-1.7 -2,-0.5 2,-0.5 -0.916 8.8-169.7-104.5 121.0 34.3 -5.2 -2.7 37 69 A V E - C 0 84A 19 47,-2.9 47,-2.3 -2,-0.6 2,-0.3 -0.968 19.5-132.5-114.4 120.9 31.1 -3.2 -3.0 38 70 A E E > - C 0 83A 118 -2,-0.5 3,-0.7 45,-0.2 4,-0.3 -0.542 14.2-133.3 -72.2 131.8 27.7 -5.0 -2.4 39 71 A K G > S+ 0 0 40 43,-2.2 3,-1.2 -2,-0.3 44,-0.1 0.837 104.9 57.3 -54.5 -35.6 25.2 -4.3 -5.2 40 72 A D G 3 S+ 0 0 143 42,-0.4 -1,-0.2 1,-0.3 43,-0.1 0.860 104.2 51.9 -64.3 -39.2 22.4 -3.6 -2.5 41 73 A R G < S+ 0 0 168 -3,-0.7 2,-0.6 -25,-0.0 -1,-0.3 0.440 80.2 114.0 -80.3 0.8 24.5 -0.8 -0.9 42 74 A I < + 0 0 20 -3,-1.2 3,-0.1 -4,-0.3 -25,-0.0 -0.645 39.3 176.7 -78.5 117.6 25.2 1.0 -4.2 43 75 A S + 0 0 72 -2,-0.6 2,-0.5 1,-0.3 -1,-0.2 0.968 66.3 32.1 -80.9 -68.6 23.4 4.4 -3.9 44 76 A D S S- 0 0 67 112,-0.3 12,-1.8 114,-0.1 -1,-0.3 -0.839 75.6-159.6-100.3 119.4 24.2 6.2 -7.1 45 77 A W E -E 55 0B 60 -2,-0.5 2,-0.2 10,-0.2 8,-0.0 -0.640 5.5-165.1 -95.6 156.7 24.7 4.1 -10.3 46 78 A G E -E 54 0B 12 8,-3.5 8,-1.6 -2,-0.2 2,-0.3 -0.628 11.7-131.6-126.2-177.8 26.5 5.0 -13.4 47 79 A E E -E 53 0B 126 6,-0.2 6,-0.2 -2,-0.2 5,-0.1 -0.966 11.5-136.5-145.9 132.2 26.7 3.7 -17.0 48 80 A L > - 0 0 17 4,-2.3 3,-2.9 -2,-0.3 4,-0.1 -0.545 36.6-105.2 -81.5 149.6 29.8 3.0 -19.2 49 81 A P T 3 S+ 0 0 139 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 0.828 120.8 61.3 -44.2 -37.9 29.6 4.2 -22.8 50 82 A N T 3 S- 0 0 128 1,-0.1 -2,-0.0 2,-0.1 0, 0.0 0.313 123.5-102.3 -73.9 7.0 29.1 0.5 -23.9 51 83 A G S < S+ 0 0 37 -3,-2.9 2,-0.2 1,-0.3 -1,-0.1 0.184 71.3 145.8 95.6 -14.6 25.8 0.3 -21.9 52 84 A T - 0 0 44 -5,-0.1 -4,-2.3 1,-0.1 2,-0.5 -0.398 48.1-132.6 -64.0 125.3 27.1 -1.6 -18.8 53 85 A R E +E 47 0B 158 -6,-0.2 -6,-0.2 -2,-0.2 -1,-0.1 -0.694 43.0 161.2 -78.5 120.5 25.3 -0.5 -15.6 54 86 A V E -E 46 0B 0 -8,-1.6 -8,-3.5 -2,-0.5 2,-0.1 -0.877 45.5 -78.2-135.8 168.9 28.1 0.1 -13.0 55 87 A P E >> -E 45 0B 7 0, 0.0 3,-1.2 0, 0.0 4,-1.1 -0.410 43.9-118.7 -67.1 149.5 28.7 1.9 -9.6 56 88 A M H 3> S+ 0 0 18 -12,-1.8 4,-2.6 1,-0.2 5,-0.3 0.868 110.8 68.8 -59.4 -33.9 29.3 5.6 -10.1 57 89 A E H 3> S+ 0 0 13 -13,-0.3 4,-2.7 1,-0.2 -1,-0.2 0.811 98.0 51.2 -51.9 -36.8 32.8 5.3 -8.6 58 90 A V H <> S+ 0 0 0 -3,-1.2 4,-2.0 2,-0.2 -1,-0.2 0.916 111.0 48.5 -67.8 -43.4 33.9 3.3 -11.7 59 91 A V H X S+ 0 0 21 -4,-1.1 4,-1.7 2,-0.2 -2,-0.2 0.953 116.6 41.4 -60.2 -49.8 32.5 6.1 -13.9 60 92 A L H X S+ 0 0 0 -4,-2.6 4,-1.5 1,-0.2 -2,-0.2 0.882 113.8 51.5 -69.6 -40.9 34.2 8.9 -12.0 61 93 A L H X S+ 0 0 2 -4,-2.7 4,-1.9 -5,-0.3 13,-0.3 0.835 108.5 51.9 -68.0 -31.5 37.5 7.0 -11.5 62 94 A K H < S+ 0 0 110 -4,-2.0 4,-0.4 2,-0.2 -1,-0.2 0.899 107.8 53.0 -69.4 -35.5 37.7 6.3 -15.3 63 95 A K H < S+ 0 0 86 -4,-1.7 -2,-0.2 1,-0.2 -1,-0.2 0.853 122.9 29.0 -64.3 -34.5 37.2 10.1 -15.9 64 96 A V H < S+ 0 0 0 -4,-1.5 -2,-0.2 1,-0.1 -1,-0.2 0.516 98.7 83.9-103.4 -10.7 40.2 10.9 -13.6 65 97 A S < + 0 0 16 -4,-1.9 2,-2.6 1,-0.1 -1,-0.1 0.522 57.4 103.2 -75.7 -5.1 42.5 7.7 -13.9 66 98 A S S S- 0 0 85 -4,-0.4 -1,-0.1 -3,-0.2 -4,-0.0 -0.491 82.7-140.8 -74.1 72.0 44.1 9.1 -17.1 67 99 A G S S+ 0 0 33 -2,-2.6 2,-0.1 2,-0.1 -2,-0.1 0.221 81.2 95.3 -66.1-177.6 47.1 10.0 -14.9 68 100 A F S S+ 0 0 198 3,-0.1 2,-0.3 1,-0.1 -2,-0.1 0.444 72.9 119.2 -80.5 150.9 49.5 11.1 -13.5 69 101 A S S S- 0 0 19 2,-0.3 4,-0.1 -2,-0.1 53,-0.1 -0.932 76.3 -94.3-159.4 176.4 47.6 12.8 -10.6 70 102 A G S S+ 0 0 18 -2,-0.3 82,-2.2 48,-0.1 2,-0.4 -0.281 93.1 100.7 -90.3 39.4 47.0 12.9 -6.8 71 103 A V B S-f 152 0C 1 80,-0.3 2,-0.3 -7,-0.1 -2,-0.3 -0.992 83.2-113.3-127.6 132.4 44.1 10.4 -7.2 72 104 A I - 0 0 6 80,-2.5 2,-0.2 -2,-0.4 -2,-0.1 -0.563 45.3-126.0 -65.7 125.3 44.4 6.6 -6.5 73 105 A R - 0 0 76 -2,-0.3 16,-1.5 -4,-0.1 2,-0.7 -0.531 2.4-127.1 -83.3 141.4 44.0 5.1 -10.0 74 106 A L E +D 88 0A 18 -13,-0.3 14,-0.2 -2,-0.2 3,-0.1 -0.799 27.7 177.8 -83.9 114.0 41.4 2.4 -11.0 75 107 A L E - 0 0 61 12,-2.7 2,-0.3 -2,-0.7 13,-0.2 0.798 63.4 -29.5 -86.3 -36.2 43.6 -0.3 -12.6 76 108 A D E -D 87 0A 53 11,-1.4 11,-2.9 2,-0.0 -1,-0.4 -0.951 55.1-152.5-167.3 171.0 40.6 -2.7 -13.3 77 109 A W E -D 86 0A 48 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.970 5.4-157.4-153.2 159.0 37.2 -3.8 -12.0 78 110 A F E -D 85 0A 32 7,-2.4 7,-3.1 -2,-0.3 2,-0.4 -0.987 11.9-136.6-139.1 148.9 35.0 -6.9 -12.1 79 111 A E E -D 84 0A 102 -2,-0.3 5,-0.2 5,-0.2 -2,-0.0 -0.914 21.2-179.5-110.3 135.1 31.3 -7.7 -11.7 80 112 A R - 0 0 110 3,-3.2 3,-0.3 -2,-0.4 -2,-0.0 -0.708 45.5 -93.0-119.9 168.7 30.0 -10.6 -9.6 81 113 A P S S+ 0 0 110 0, 0.0 -1,-0.0 0, 0.0 3,-0.0 0.909 121.4 12.3 -52.9 -49.8 26.3 -11.7 -9.0 82 114 A D S S+ 0 0 123 -43,-0.0 -43,-2.2 -44,-0.0 -42,-0.4 0.209 129.8 39.2-113.3 12.0 25.8 -9.6 -5.8 83 115 A S E -C 38 0A 19 -3,-0.3 -3,-3.2 -45,-0.3 2,-0.4 -0.973 60.3-134.7-155.1 166.4 28.9 -7.4 -5.9 84 116 A F E -CD 37 79A 0 -47,-2.3 -47,-2.9 -2,-0.3 2,-0.5 -0.968 21.4-151.9-122.2 140.2 31.4 -5.2 -7.9 85 117 A V E -CD 36 78A 0 -7,-3.1 -7,-2.4 -2,-0.4 2,-0.4 -0.977 7.2-161.9-121.5 121.8 35.2 -5.5 -7.2 86 118 A L E -CD 35 77A 0 -51,-2.6 -51,-2.4 -2,-0.5 2,-0.6 -0.846 7.1-152.9-104.5 140.2 37.5 -2.6 -7.9 87 119 A I E +CD 34 76A 0 -11,-2.9 -12,-2.7 -2,-0.4 -11,-1.4 -0.958 25.7 177.3-112.2 115.7 41.3 -2.9 -8.3 88 120 A L E -CD 33 74A 16 -55,-2.7 -55,-2.0 -2,-0.6 -14,-0.2 -0.692 34.9 -90.4-120.0 164.1 43.1 0.3 -7.2 89 121 A E E -C 32 0A 51 -16,-1.5 -57,-0.2 -2,-0.2 -1,-0.1 -0.460 35.9-156.1 -77.5 144.1 46.6 1.4 -6.9 90 122 A R - 0 0 34 -59,-1.0 -1,-0.0 -2,-0.1 4,-0.0 -0.909 2.9-151.6-124.5 105.2 48.3 0.8 -3.5 91 123 A P - 0 0 17 0, 0.0 3,-0.2 0, 0.0 52,-0.1 -0.350 23.4-126.6 -67.4 155.5 51.3 3.0 -2.4 92 124 A E S S+ 0 0 117 1,-0.4 2,-0.1 -61,-0.1 52,-0.1 -0.880 92.5 29.6-155.9 120.7 53.8 1.2 -0.1 93 125 A P S S+ 0 0 45 0, 0.0 52,-1.3 0, 0.0 53,-0.5 0.521 95.3 167.4 -69.3 144.7 54.7 2.3 2.7 94 126 A V E -G 144 0C 48 50,-0.2 2,-0.3 -3,-0.2 50,-0.2 -0.990 20.2-173.8-135.9 141.8 51.3 4.1 3.0 95 127 A Q E -G 143 0C 33 48,-2.1 48,-2.8 -2,-0.3 2,-0.1 -1.000 25.9-120.9-140.8 140.4 49.4 5.9 5.8 96 128 A D E > -G 142 0C 35 -2,-0.3 4,-2.7 46,-0.2 46,-0.2 -0.420 21.6-130.4 -66.9 139.8 46.0 7.4 6.1 97 129 A L H > S+ 0 0 0 44,-2.5 4,-2.3 41,-1.0 42,-0.2 0.841 110.2 56.0 -67.0 -27.6 45.9 11.2 7.0 98 130 A F H > S+ 0 0 78 40,-1.0 4,-2.0 43,-0.3 -1,-0.2 0.970 112.0 40.2 -65.0 -53.6 43.4 10.4 9.8 99 131 A D H > S+ 0 0 76 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.897 112.8 56.7 -61.5 -39.6 45.8 7.8 11.4 100 132 A F H X S+ 0 0 2 -4,-2.7 4,-2.4 1,-0.2 5,-0.2 0.910 111.2 42.8 -57.4 -42.6 48.8 10.2 10.7 101 133 A I H X S+ 0 0 8 -4,-2.3 4,-1.9 2,-0.2 -1,-0.2 0.841 109.1 58.6 -73.8 -31.8 46.9 13.0 12.7 102 134 A T H < S+ 0 0 97 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.942 116.1 35.3 -61.1 -42.2 45.9 10.4 15.5 103 135 A E H < S+ 0 0 145 -4,-2.2 -2,-0.2 1,-0.1 -1,-0.2 0.926 130.9 27.3 -75.6 -51.6 49.6 9.6 16.0 104 136 A R H < S- 0 0 115 -4,-2.4 -3,-0.2 1,-0.2 -2,-0.2 0.532 90.3-154.6 -95.9 -7.1 51.3 13.0 15.5 105 137 A G < + 0 0 28 -4,-1.9 101,-0.3 -5,-0.2 -1,-0.2 -0.294 61.5 16.4 65.1-153.3 48.5 15.4 16.5 106 138 A A S S- 0 0 31 99,-0.3 2,-0.2 98,-0.1 98,-0.2 -0.258 83.5-129.1 -54.9 129.9 48.4 19.0 15.0 107 139 A L - 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0 0 20 -3,-1.9 6,-0.1 1,-0.1 -3,-0.1 -0.405 52.9-134.2 -61.5 130.4 32.5 31.6 5.0 241 273 A L S S+ 0 0 78 -23,-0.1 -62,-0.2 -22,-0.1 -1,-0.1 0.822 92.9 65.2 -62.1 -34.8 28.8 30.9 5.8 242 274 A R S > S- 0 0 155 1,-0.1 3,-1.4 -64,-0.1 4,-0.4 -0.823 82.1-142.7 -87.0 122.6 27.7 32.3 2.4 243 275 A P G > S+ 0 0 45 0, 0.0 3,-1.2 0, 0.0 -1,-0.1 0.781 99.5 57.5 -49.8 -41.9 29.0 30.1 -0.5 244 276 A S G 3 S+ 0 0 89 1,-0.2 -3,-0.0 -3,-0.0 -4,-0.0 0.777 100.6 59.5 -62.1 -30.0 29.7 33.1 -2.7 245 277 A D G < S+ 0 0 75 -3,-1.4 -1,-0.2 2,-0.0 -4,-0.1 0.562 88.5 94.6 -78.6 -7.8 31.9 34.5 0.0 246 278 A R S < S- 0 0 13 -3,-1.2 -8,-0.2 -4,-0.4 -9,-0.1 -0.441 80.1-107.3 -78.2 155.5 34.3 31.4 -0.1 247 279 A P - 0 0 5 0, 0.0 2,-0.2 0, 0.0 -1,-0.1 -0.223 23.4-120.1 -78.1 168.0 37.4 31.4 -2.2 248 280 A T > - 0 0 72 1,-0.1 4,-2.2 -55,-0.0 5,-0.2 -0.568 37.1 -99.4 -93.1 167.4 38.1 29.6 -5.5 249 281 A F H > S+ 0 0 25 1,-0.2 4,-2.5 -2,-0.2 5,-0.1 0.874 126.8 53.9 -58.8 -32.7 40.9 27.1 -5.8 250 282 A E H > S+ 0 0 136 1,-0.2 4,-1.4 2,-0.2 -1,-0.2 0.889 108.5 46.8 -66.8 -45.1 42.9 29.9 -7.5 251 283 A E H 4 S+ 0 0 84 2,-0.2 -1,-0.2 1,-0.2 -2,-0.2 0.812 112.4 50.6 -66.9 -33.8 42.4 32.3 -4.6 252 284 A I H >< S+ 0 0 0 -4,-2.2 3,-1.8 1,-0.2 6,-0.3 0.982 113.6 44.6 -64.5 -56.1 43.3 29.5 -2.0 253 285 A Q H 3< S+ 0 0 13 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.691 114.2 50.1 -65.3 -20.2 46.5 28.7 -3.9 254 286 A N T 3< S+ 0 0 103 -4,-1.4 -1,-0.3 -5,-0.1 -2,-0.2 0.298 84.4 117.9 -96.4 5.1 47.4 32.5 -4.3 255 287 A H S X S- 0 0 7 -3,-1.8 3,-1.5 1,-0.1 4,-0.2 -0.490 78.3-118.6 -72.5 140.5 46.8 33.1 -0.6 256 288 A P G > S+ 0 0 74 0, 0.0 3,-1.0 0, 0.0 -1,-0.1 0.780 114.8 57.7 -51.7 -28.7 50.0 34.4 1.2 257 289 A W G 3 S+ 0 0 2 1,-0.2 -26,-0.1 -27,-0.2 -4,-0.1 0.795 99.6 59.2 -70.3 -29.3 49.8 31.2 3.5 258 290 A M G < S+ 0 0 2 -3,-1.5 3,-0.4 -6,-0.3 -1,-0.2 0.301 86.4 110.3 -84.6 14.6 50.0 29.0 0.4 259 291 A Q S < S+ 0 0 85 -3,-1.0 -5,-0.0 1,-0.2 -146,-0.0 -0.466 70.5 19.0 -91.9 156.1 53.4 30.5 -0.7 260 292 A D S S- 0 0 156 -2,-0.1 -1,-0.2 1,-0.1 -2,-0.0 0.834 81.6-176.0 54.4 44.3 56.9 28.8 -0.8 261 293 A V - 0 0 42 -3,-0.4 2,-0.1 1,-0.1 -1,-0.1 -0.263 22.8-116.7 -65.2 151.0 55.4 25.2 -0.6 262 294 A L - 0 0 22 -152,-0.3 -1,-0.1 1,-0.1 3,-0.0 -0.481 26.1-111.9 -84.0 163.1 57.7 22.3 -0.3 263 295 A L > - 0 0 113 -2,-0.1 4,-2.2 1,-0.1 3,-0.2 -0.641 34.4-104.9 -89.3 155.6 58.0 19.6 -2.9 264 296 A P H > S+ 0 0 41 0, 0.0 4,-1.9 0, 0.0 3,-0.2 0.891 120.3 47.1 -48.3 -50.9 56.7 16.1 -2.0 265 297 A Q H > S+ 0 0 76 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.881 111.0 51.4 -60.0 -42.8 60.2 14.5 -1.6 266 298 A E H > S+ 0 0 82 -3,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.873 109.9 51.4 -57.3 -44.7 61.5 17.5 0.5 267 299 A T H X>S+ 0 0 0 -4,-2.2 4,-2.6 1,-0.2 5,-0.6 0.869 110.1 48.1 -60.1 -43.1 58.4 17.1 2.8 268 300 A A H X>S+ 0 0 0 -4,-1.9 5,-3.0 -5,-0.2 4,-1.3 0.893 113.3 47.6 -67.5 -37.5 59.1 13.3 3.2 269 301 A E H <5S+ 0 0 119 -4,-2.2 -2,-0.2 3,-0.2 -1,-0.2 0.899 120.9 36.1 -70.5 -39.3 62.8 14.0 4.0 270 302 A I H <5S+ 0 0 95 -4,-2.3 -2,-0.2 -5,-0.1 -3,-0.2 0.866 136.9 13.5 -78.8 -44.8 62.0 16.8 6.6 271 303 A H H <5S+ 0 0 14 -4,-2.6 -3,-0.2 -5,-0.2 -2,-0.2 0.617 128.9 33.8-113.8 -21.8 58.8 15.4 8.2 272 304 A L T <