==== 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 4ALU . COMPND 2 MOLECULE: SERINE/THREONINE-PROTEIN KINASE PIM-1; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR T.J.STOUT,L.ADAMS . 274 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13315.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 173 63.1 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 . 47 17.2 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 . 16 5.8 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 . 76 27.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.1 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 . 2 1 3 1 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 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 0 144 0, 0.0 3,-0.1 0, 0.0 77,-0.0 0.000 360.0 360.0 360.0-169.4 8.3 40.5 15.7 2 34 A L > - 0 0 125 1,-0.1 3,-1.7 2,-0.1 2,-1.2 0.143 360.0 -73.1 93.6 152.2 7.0 40.4 12.0 3 35 A E T 3 S+ 0 0 51 1,-0.3 5,-0.2 2,-0.2 -1,-0.1 -0.231 106.1 90.6 -84.0 44.4 8.2 42.0 8.7 4 36 A S T 3 S+ 0 0 105 -2,-1.2 -1,-0.3 -3,-0.1 -2,-0.1 0.340 84.3 69.8 -85.4 -12.3 7.2 45.5 9.4 5 37 A Q S < S+ 0 0 54 -3,-1.7 21,-2.6 21,-0.1 22,-0.7 0.753 101.5 38.7 -71.5 -31.9 10.8 45.2 10.6 6 38 A Y B S-A 25 0A 14 19,-0.2 2,-0.7 20,-0.1 19,-0.2 -0.939 72.3-134.1-124.7 150.5 12.4 44.8 7.1 7 39 A Q - 0 0 125 17,-2.1 2,-0.4 -2,-0.3 17,-0.3 -0.897 26.8-133.9-105.4 107.7 11.8 46.5 3.8 8 40 A V - 0 0 84 -2,-0.7 15,-0.3 -5,-0.2 3,-0.1 -0.432 28.4-179.4 -65.3 109.4 11.8 43.8 1.0 9 41 A G - 0 0 30 13,-4.1 -1,-0.1 -2,-0.4 3,-0.1 0.141 42.1 -33.4 -85.7-154.4 13.8 44.9 -2.1 10 42 A P - 0 0 93 0, 0.0 12,-2.9 0, 0.0 2,-0.4 -0.181 67.1 -96.5 -62.2 156.0 14.4 43.1 -5.4 11 43 A L E -B 21 0B 98 10,-0.2 10,-0.3 1,-0.1 3,-0.1 -0.639 33.7-170.2 -71.8 124.0 14.6 39.3 -5.9 12 44 A L E - 0 0 102 8,-3.3 2,-0.3 -2,-0.4 9,-0.2 0.693 58.0 -41.6 -89.2 -22.4 18.3 38.3 -5.9 13 45 A G E -B 20 0B 33 7,-1.4 7,-2.8 2,-0.0 -1,-0.3 -0.955 48.9-151.9 170.5 174.0 17.9 34.7 -6.9 14 46 A S E +B 19 0B 89 -2,-0.3 2,-0.3 5,-0.2 5,-0.2 -0.982 32.0 98.6-159.9 156.6 16.0 31.5 -6.6 15 47 A G S S- 0 0 31 3,-2.7 3,-0.5 -2,-0.3 -2,-0.0 -0.910 89.4 -14.8 172.5-138.1 16.3 27.7 -6.9 16 48 A G S S+ 0 0 89 -2,-0.3 3,-0.1 1,-0.2 -1,-0.1 0.580 132.3 66.0 -63.6 -19.3 16.7 24.5 -4.9 17 49 A S S S- 0 0 35 1,-0.3 2,-0.5 20,-0.0 -1,-0.2 0.779 108.4-129.4 -66.7 -32.7 17.7 27.4 -2.4 18 50 A G - 0 0 4 -3,-0.5 -3,-2.7 19,-0.1 2,-0.4 -0.959 53.5 -44.2 101.3-130.3 14.1 28.8 -2.3 19 51 A S E -BC 14 36B 34 17,-1.9 17,-2.4 -2,-0.5 2,-0.5 -0.997 48.0-156.7-145.8 132.6 14.2 32.6 -3.0 20 52 A V E -BC 13 35B 31 -7,-2.8 -8,-3.3 -2,-0.4 -7,-1.4 -0.939 11.1-170.3-118.5 128.1 16.4 35.3 -1.7 21 53 A Y E -BC 11 34B 77 13,-2.6 13,-3.4 -2,-0.5 -10,-0.2 -0.874 25.5-115.9-116.1 149.2 15.4 39.0 -1.6 22 54 A S E + C 0 33B 15 -12,-2.9 -13,-4.1 -2,-0.3 2,-0.3 -0.538 44.5 173.0 -80.3 147.5 17.4 42.1 -0.9 23 55 A G E - C 0 32B 0 9,-2.3 9,-1.8 -15,-0.3 2,-0.4 -0.865 30.7-139.3-153.9 175.5 16.3 43.9 2.2 24 56 A I E - C 0 31B 60 -17,-0.3 -17,-2.1 -2,-0.3 2,-0.5 -0.951 27.6-124.0-152.5 115.5 17.0 46.7 4.6 25 57 A R B >> -A 6 0A 70 5,-2.7 4,-3.5 -2,-0.4 3,-1.1 -0.553 20.9-150.8 -67.9 116.6 16.6 46.3 8.3 26 58 A V T 34 S+ 0 0 75 -21,-2.6 -1,-0.2 -2,-0.5 -20,-0.1 0.915 90.2 67.1 -66.3 -38.7 14.2 49.3 9.0 27 59 A S T 34 S- 0 0 87 -22,-0.7 -1,-0.3 1,-0.2 -21,-0.1 0.819 132.5 -9.4 -32.4 -50.0 15.6 49.7 12.5 28 60 A D T <4 S- 0 0 87 -3,-1.1 -2,-0.2 2,-0.1 -1,-0.2 0.308 90.7-110.0-148.9 12.9 19.0 50.8 11.2 29 61 A N < + 0 0 109 -4,-3.5 -3,-0.2 1,-0.2 -2,-0.0 0.764 54.5 165.9 59.4 26.2 19.1 50.3 7.4 30 62 A L - 0 0 62 -5,-0.5 -5,-2.7 1,-0.1 -1,-0.2 -0.601 44.0-113.6 -68.6 129.1 21.6 47.5 7.6 31 63 A P E +C 24 0B 42 0, 0.0 59,-0.8 0, 0.0 2,-0.3 -0.495 48.8 171.0 -61.3 140.0 21.6 45.8 4.3 32 64 A V E -CD 23 89B 0 -9,-1.8 -9,-2.3 57,-0.2 2,-0.4 -0.908 32.0-127.0-147.1 167.3 20.2 42.2 4.6 33 65 A A E -CD 22 88B 10 55,-2.6 55,-3.0 -2,-0.3 2,-0.7 -0.992 15.8-152.2-125.9 131.7 19.1 39.2 2.6 34 66 A I E -CD 21 87B 2 -13,-3.4 -13,-2.6 -2,-0.4 2,-0.4 -0.902 13.7-169.4-111.2 104.4 15.7 37.6 3.1 35 67 A K E -CD 20 86B 6 51,-3.1 51,-3.4 -2,-0.7 2,-0.5 -0.846 3.7-164.1 -97.1 128.3 15.7 33.9 2.2 36 68 A H E -CD 19 85B 40 -17,-2.4 -17,-1.9 -2,-0.4 2,-0.5 -0.951 6.5-175.8-112.7 124.3 12.4 32.0 2.1 37 69 A V E - D 0 84B 16 47,-2.1 47,-2.2 -2,-0.5 2,-0.3 -0.995 23.5-128.9-121.7 124.4 12.5 28.2 2.1 38 70 A E E > - D 0 83B 99 -2,-0.5 4,-0.6 45,-0.2 45,-0.3 -0.542 10.1-136.0 -74.3 135.8 9.3 26.3 1.7 39 71 A K T >4 S+ 0 0 39 43,-2.6 3,-1.9 -2,-0.3 44,-0.1 0.926 102.4 55.9 -53.7 -54.5 8.6 23.6 4.3 40 72 A D T 34 S+ 0 0 147 42,-0.4 -1,-0.2 1,-0.3 43,-0.1 0.879 108.3 50.4 -44.8 -44.3 7.4 20.9 1.8 41 73 A R T 34 S+ 0 0 143 -3,-0.2 2,-0.6 2,-0.0 -1,-0.3 0.616 89.5 95.1 -80.6 -7.4 10.7 21.3 0.0 42 74 A I << + 0 0 25 -3,-1.9 3,-0.1 -4,-0.6 -5,-0.0 -0.732 43.0 174.5 -84.0 118.6 12.9 20.9 3.2 43 75 A S + 0 0 93 -2,-0.6 2,-0.6 1,-0.1 -1,-0.1 0.819 60.9 62.3 -88.7 -35.8 14.2 17.3 3.8 44 76 A D + 0 0 66 112,-0.2 12,-3.1 115,-0.0 13,-0.4 -0.841 59.0 173.9-105.6 115.6 16.5 17.8 6.8 45 77 A W E +F 55 0C 60 -2,-0.6 2,-0.2 10,-0.3 8,-0.1 -0.734 4.3 163.3-111.6 159.5 15.3 19.0 10.1 46 78 A G E -F 54 0C 18 8,-2.5 8,-1.5 -2,-0.3 2,-0.3 -0.656 29.6-113.2-143.3-153.4 17.0 19.3 13.4 47 79 A E E -F 53 0C 125 -2,-0.2 6,-0.2 6,-0.2 -2,-0.0 -0.990 30.0 -91.3-157.8 154.6 16.2 21.2 16.6 48 80 A L > - 0 0 16 4,-1.4 2,-4.9 -2,-0.3 3,-1.2 -0.294 37.3-105.0 -72.9 138.4 17.6 24.1 18.6 49 81 A P T 3 S+ 0 0 121 0, 0.0 -1,-0.2 0, 0.0 0, 0.0 -0.145 131.0 40.9 -39.4 37.7 20.2 24.1 21.3 50 82 A N T 3 S- 0 0 123 -2,-4.9 -2,-0.0 2,-0.1 0, 0.0 0.092 122.1-100.5-153.0 -26.3 16.9 24.7 23.2 51 83 A G < + 0 0 33 -3,-1.2 2,-0.3 1,-0.3 -4,-0.1 0.811 67.6 119.8 102.3 86.8 14.4 22.3 21.6 52 84 A T - 0 0 86 -6,-0.0 -4,-1.4 2,-0.0 2,-0.5 -0.841 68.3 -89.0-163.7 150.2 11.8 23.3 18.9 53 85 A R E +F 47 0C 163 -2,-0.3 -6,-0.2 -6,-0.2 -8,-0.0 -0.479 57.9 154.1 -75.4 111.8 11.6 21.9 15.4 54 86 A V E -F 46 0C 1 -8,-1.5 -8,-2.5 -2,-0.5 2,-0.2 -0.794 48.2 -89.7-127.3 168.0 13.7 23.9 12.7 55 87 A P E >> -F 45 0C 2 0, 0.0 3,-1.9 0, 0.0 4,-1.4 -0.575 38.4-117.6 -77.2 150.1 15.4 23.1 9.4 56 88 A M H 3> S+ 0 0 29 -12,-3.1 4,-3.3 1,-0.3 5,-0.2 0.876 111.0 70.6 -54.5 -35.2 18.9 21.9 9.6 57 89 A E H 3> S+ 0 0 15 -13,-0.4 4,-2.9 1,-0.2 -1,-0.3 0.839 100.4 45.6 -46.9 -39.0 20.0 25.0 7.7 58 90 A V H <> S+ 0 0 0 -3,-1.9 4,-2.4 2,-0.2 -1,-0.2 0.896 111.3 51.1 -80.6 -42.3 19.2 27.2 10.7 59 91 A V H X S+ 0 0 11 -4,-1.4 4,-2.3 2,-0.2 -2,-0.2 0.958 113.9 45.8 -50.2 -49.8 20.9 24.9 13.2 60 92 A L H X S+ 0 0 0 -4,-3.3 4,-1.7 1,-0.2 3,-0.4 0.969 113.1 48.9 -63.0 -52.5 24.0 24.9 11.0 61 93 A L H X S+ 0 0 3 -4,-2.9 4,-0.8 1,-0.3 13,-0.4 0.808 110.0 52.3 -54.4 -35.3 23.9 28.7 10.5 62 94 A K H < S+ 0 0 106 -4,-2.4 3,-0.3 1,-0.2 -1,-0.3 0.879 108.7 50.6 -73.7 -34.8 23.5 29.2 14.2 63 95 A K H < S+ 0 0 83 -4,-2.3 -2,-0.2 -3,-0.4 -1,-0.2 0.808 116.0 40.6 -70.1 -31.2 26.5 27.0 14.9 64 96 A V H < S+ 0 0 2 -4,-1.7 2,-0.4 -5,-0.2 -1,-0.2 0.506 88.0 115.4 -95.1 -3.4 28.7 28.9 12.5 65 97 A S < + 0 0 39 -4,-0.8 2,-0.3 -3,-0.3 8,-0.1 -0.530 41.4 103.0 -76.9 122.5 27.4 32.4 13.3 66 98 A S S S- 0 0 44 -2,-0.4 5,-0.1 2,-0.3 -2,-0.0 -0.951 83.5 -59.5-172.4-174.5 30.0 34.7 14.9 67 99 A G S S+ 0 0 66 -2,-0.3 2,-0.1 2,-0.1 6,-0.1 0.800 93.8 107.6 -56.6 -32.6 32.5 37.6 14.4 68 100 A F > - 0 0 74 1,-0.2 3,-0.8 -4,-0.1 -2,-0.3 -0.276 59.7-157.0 -48.9 116.6 34.3 35.7 11.6 69 101 A S T 3 S+ 0 0 43 1,-0.2 -1,-0.2 -2,-0.1 4,-0.1 0.397 74.2 89.1 -80.5 9.0 33.4 37.4 8.4 70 102 A G T 3 S+ 0 0 6 81,-0.1 82,-1.5 51,-0.1 2,-0.4 0.521 87.7 44.4 -88.9 -7.2 34.2 34.3 6.4 71 103 A V B < S-g 152 0D 4 -3,-0.8 -5,-0.2 80,-0.3 82,-0.2 -0.999 98.8 -97.9-132.8 136.3 30.8 32.7 6.6 72 104 A I - 0 0 9 80,-2.7 2,-0.4 -2,-0.4 -8,-0.1 -0.242 40.9-127.4 -52.2 136.5 27.4 34.5 6.1 73 105 A R - 0 0 98 -8,-0.1 16,-1.9 -4,-0.1 2,-0.7 -0.700 7.4-135.2 -83.4 134.6 25.9 35.5 9.4 74 106 A L E -E 88 0B 16 -13,-0.4 14,-0.2 -2,-0.4 3,-0.1 -0.815 22.2-177.6 -80.9 117.9 22.3 34.6 10.3 75 107 A L E - 0 0 52 12,-3.1 2,-0.3 -2,-0.7 13,-0.2 0.917 59.1 -37.4 -85.5 -40.6 20.8 37.7 11.7 76 108 A D E -E 87 0B 60 11,-1.4 11,-2.8 2,-0.0 -1,-0.4 -0.938 52.0-146.9-167.0 174.6 17.4 36.3 12.6 77 109 A W E -E 86 0B 64 -2,-0.3 2,-0.3 9,-0.2 9,-0.2 -0.974 3.9-161.3-157.3 151.2 14.6 33.9 11.4 78 110 A F E -E 85 0B 24 7,-2.1 7,-2.1 -2,-0.3 2,-0.4 -0.867 16.0-133.6-125.3 156.6 10.8 33.6 11.5 79 111 A E E +E 84 0B 113 -2,-0.3 5,-0.2 5,-0.2 3,-0.1 -0.943 24.8 180.0-109.4 141.5 8.4 30.6 11.0 80 112 A R - 0 0 113 3,-2.9 3,-0.4 -2,-0.4 5,-0.0 -0.743 46.8 -85.7-126.0 172.0 5.3 31.0 8.7 81 113 A P S S+ 0 0 107 0, 0.0 -1,-0.1 0, 0.0 3,-0.0 0.960 121.4 7.7 -44.2 -61.5 2.6 28.5 7.8 82 114 A D S S+ 0 0 112 -43,-0.1 -43,-2.6 -3,-0.1 -42,-0.4 0.222 128.4 33.9-112.2 20.1 4.4 26.9 4.9 83 115 A S E -D 38 0B 19 -3,-0.4 -3,-2.9 -45,-0.3 2,-0.3 -0.988 62.9-126.1-162.0 157.6 7.9 28.4 5.0 84 116 A F E -DE 37 79B 0 -47,-2.2 -47,-2.1 -2,-0.3 2,-0.5 -0.848 21.9-146.3-105.5 153.9 10.8 29.7 7.1 85 117 A V E -DE 36 78B 0 -7,-2.1 -7,-2.1 -2,-0.3 2,-0.5 -0.981 11.2-164.2-124.8 122.7 12.3 33.1 6.5 86 118 A L E -DE 35 77B 1 -51,-3.4 -51,-3.1 -2,-0.5 2,-0.6 -0.919 7.3-154.4-109.4 131.3 16.0 33.6 7.2 87 119 A I E +DE 34 76B 0 -11,-2.8 -12,-3.1 -2,-0.5 -11,-1.4 -0.948 24.5 175.6-105.3 116.4 17.5 37.1 7.5 88 120 A L E -DE 33 74B 16 -55,-3.0 -55,-2.6 -2,-0.6 -14,-0.2 -0.726 34.8 -93.7-117.5 157.9 21.2 37.0 6.5 89 121 A E E -D 32 0B 45 -16,-1.9 -57,-0.2 -2,-0.3 -1,-0.1 -0.292 33.8-155.0 -63.5 165.0 23.8 39.6 6.2 90 122 A R - 0 0 30 -59,-0.8 2,-0.0 -58,-0.1 -1,-0.0 -0.879 6.5-144.4-143.7 107.0 24.3 41.1 2.8 91 123 A P - 0 0 13 0, 0.0 3,-0.1 0, 0.0 52,-0.1 -0.379 28.5-122.0 -65.7 154.2 27.6 42.7 1.8 92 124 A E S S+ 0 0 114 1,-0.3 2,-0.1 -61,-0.1 52,-0.1 -0.963 92.3 24.2-149.6 122.5 27.2 45.7 -0.5 93 125 A P S S+ 0 0 46 0, 0.0 52,-0.7 0, 0.0 53,-0.6 0.745 94.6 163.7 -75.7 165.7 28.4 45.9 -3.2 94 126 A V E -H 144 0D 51 50,-0.2 2,-0.3 -3,-0.1 50,-0.2 -0.962 23.6-175.1-151.1 148.9 28.7 42.2 -3.7 95 127 A Q E -H 143 0D 40 48,-1.8 48,-2.4 -2,-0.3 2,-0.1 -0.950 26.5-121.1-151.2 135.7 29.2 39.6 -6.5 96 128 A D E >> -H 142 0D 42 -2,-0.3 4,-2.4 46,-0.2 3,-0.8 -0.451 27.2-117.6 -78.1 147.5 29.2 35.8 -6.4 97 129 A L H 3> S+ 0 0 0 44,-2.7 4,-2.5 41,-0.6 42,-0.2 0.836 111.9 59.9 -57.0 -31.9 32.2 33.9 -7.5 98 130 A F H 3> S+ 0 0 82 40,-1.0 4,-3.2 43,-0.3 -1,-0.3 0.917 109.4 41.0 -55.6 -48.3 30.3 32.3 -10.4 99 131 A D H <> S+ 0 0 74 -3,-0.8 4,-2.2 2,-0.2 5,-0.2 0.886 113.5 53.9 -70.8 -40.3 29.4 35.7 -12.0 100 132 A F H X S+ 0 0 2 -4,-2.4 4,-2.8 2,-0.2 5,-0.2 0.903 113.4 42.2 -58.9 -46.6 32.8 37.0 -11.3 101 133 A I H X S+ 0 0 7 -4,-2.5 4,-2.2 -5,-0.2 -2,-0.2 0.913 112.3 53.9 -71.7 -43.7 34.3 34.0 -13.1 102 134 A T H < S+ 0 0 100 -4,-3.2 -2,-0.2 -5,-0.2 -1,-0.2 0.863 118.1 38.4 -49.2 -36.6 31.8 34.2 -15.9 103 135 A E H < S+ 0 0 127 -4,-2.2 -2,-0.2 -5,-0.2 -1,-0.2 0.871 126.5 30.0 -92.9 -36.7 32.7 37.8 -16.4 104 136 A R H < S- 0 0 108 -4,-2.8 -3,-0.2 1,-0.2 -2,-0.2 0.549 94.4-145.1-107.1 -1.4 36.5 37.9 -15.9 105 137 A G < + 0 0 32 -4,-2.2 101,-0.2 -5,-0.2 -1,-0.2 -0.249 61.5 6.4 73.6-166.8 37.4 34.3 -17.1 106 138 A A S S- 0 0 34 99,-0.3 98,-0.2 1,-0.1 2,-0.2 -0.155 83.5-123.6 -43.7 132.6 40.2 32.3 -15.5 107 139 A L - 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0 0 15 -2,-0.3 -9,-0.1 1,-0.1 -10,-0.1 -0.357 35.4-133.9 -68.1 148.5 34.9 23.0 -13.6 209 241 A P S S+ 0 0 17 0, 0.0 2,-0.4 0, 0.0 13,-0.2 0.760 83.3 46.2 -77.7 -24.8 37.1 20.1 -14.9 210 242 A F + 0 0 5 -36,-0.2 -2,-0.1 1,-0.1 3,-0.1 -0.959 41.3 166.2-126.7 134.5 34.3 17.4 -15.1 211 243 A E + 0 0 110 -2,-0.4 2,-0.3 1,-0.1 -1,-0.1 0.677 67.1 58.4-107.2 -26.5 30.8 17.4 -16.4 212 244 A H S >> S- 0 0 109 1,-0.1 4,-1.7 -38,-0.1 3,-1.3 -0.797 78.4-119.7-120.6 149.2 30.1 13.6 -16.5 213 245 A D H 3> S+ 0 0 57 -2,-0.3 4,-2.6 1,-0.3 5,-0.2 0.803 114.1 50.9 -44.4 -43.3 30.0 10.7 -14.1 214 246 A E H 3> S+ 0 0 125 1,-0.2 4,-1.8 2,-0.2 -1,-0.3 0.758 106.2 56.0 -75.4 -23.9 32.7 8.8 -15.9 215 247 A E H <> S+ 0 0 78 -3,-1.3 4,-3.2 2,-0.2 5,-0.4 0.904 111.1 43.6 -72.2 -39.5 35.0 11.8 -15.9 216 248 A I H < S+ 0 0 2 -4,-1.7 -2,-0.2 2,-0.2 -3,-0.1 0.966 113.9 50.0 -64.0 -57.7 34.7 12.0 -12.0 217 249 A I H < S+ 0 0 55 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.887 116.9 42.6 -46.8 -43.2 35.2 8.3 -11.7 218 250 A R H < S- 0 0 171 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.938 86.0-167.3 -74.2 -48.0 38.3 8.6 -14.0 219 251 A G < + 0 0 18 -4,-3.2 2,-0.5 1,-0.2 -3,-0.1 0.755 26.1 152.6 68.3 25.6 39.6 11.8 -12.3 220 252 A Q - 0 0 111 -5,-0.4 2,-0.6 2,-0.0 -1,-0.2 -0.782 35.8-146.9 -83.6 124.1 42.2 12.5 -15.0 221 253 A V - 0 0 6 -2,-0.5 2,-0.4 -3,-0.1 -11,-0.0 -0.887 14.8-170.7-101.1 124.5 42.6 16.3 -14.9 222 254 A F - 0 0 152 -2,-0.6 2,-0.6 -13,-0.2 -2,-0.0 -0.877 16.8-137.9-107.6 144.8 43.3 18.0 -18.2 223 255 A F - 0 0 24 -2,-0.4 4,-0.1 1,-0.1 -2,-0.0 -0.918 18.5-176.7-112.1 121.4 44.3 21.7 -18.1 224 256 A R + 0 0 120 -2,-0.6 2,-0.3 2,-0.1 -1,-0.1 0.581 69.0 44.8 -90.5 -10.4 42.7 24.0 -20.6 225 257 A Q S S- 0 0 98 0, 0.0 2,-0.5 0, 0.0 -20,-0.0 -0.855 98.8 -82.9-127.1 162.2 44.6 27.1 -19.5 226 258 A R + 0 0 221 -2,-0.3 2,-0.4 -21,-0.0 -2,-0.1 -0.563 56.6 167.2 -66.9 120.0 48.1 28.1 -18.5 227 259 A V - 0 0 2 -2,-0.5 5,-0.0 -4,-0.1 -4,-0.0 -0.998 38.3-106.8-140.3 131.3 48.5 27.1 -14.9 228 260 A S > - 0 0 30 -2,-0.4 4,-2.2 1,-0.1 5,-0.2 -0.128 30.6-115.1 -54.5 154.9 51.7 26.9 -12.9 229 261 A S H > S+ 0 0 91 1,-0.2 4,-1.7 2,-0.2 -1,-0.1 0.772 114.7 54.3 -67.1 -27.6 53.0 23.5 -12.1 230 262 A E H > S+ 0 0 98 2,-0.2 4,-2.3 1,-0.2 27,-0.2 0.887 107.1 49.5 -73.5 -38.4 52.5 24.0 -8.4 231 263 A C H > S+ 0 0 0 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.936 112.2 48.4 -62.2 -50.6 49.0 24.9 -8.8 232 264 A Q H X S+ 0 0 47 -4,-2.2 4,-2.8 1,-0.2 5,-0.3 0.874 108.9 55.4 -53.7 -40.0 48.4 21.8 -11.0 233 265 A H H X S+ 0 0 106 -4,-1.7 4,-2.1 1,-0.2 -1,-0.2 0.948 110.7 42.8 -64.4 -46.0 50.1 19.8 -8.3 234 266 A L H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 5,-0.2 0.896 113.9 51.6 -66.8 -38.2 47.8 21.1 -5.6 235 267 A I H X S+ 0 0 0 -4,-2.6 4,-1.4 2,-0.2 -2,-0.2 0.948 111.0 47.7 -62.4 -48.4 44.7 20.6 -7.8 236 268 A R H < S+ 0 0 97 -4,-2.8 -2,-0.2 2,-0.2 -1,-0.2 0.875 110.8 52.4 -64.4 -37.1 45.7 17.0 -8.7 237 269 A W H >< S+ 0 0 68 -4,-2.1 3,-2.2 -5,-0.3 -1,-0.2 0.961 108.6 47.6 -61.8 -57.6 46.3 16.2 -5.0 238 270 A C H 3< S+ 0 0 0 -4,-2.4 -41,-0.2 1,-0.3 -1,-0.2 0.790 113.3 53.1 -47.4 -33.0 42.9 17.5 -3.8 239 271 A L T 3< S+ 0 0 4 -4,-1.4 -1,-0.3 -5,-0.2 -2,-0.2 0.095 76.3 142.4-101.2 19.1 41.5 15.4 -6.7 240 272 A A < - 0 0 20 -3,-2.2 6,-0.1 1,-0.1 5,-0.1 -0.424 55.1-131.1 -50.1 126.8 43.2 12.1 -5.8 241 273 A L S S+ 0 0 85 -2,-0.1 -62,-0.2 -23,-0.1 -1,-0.1 0.874 92.6 66.0 -49.4 -49.0 40.9 9.2 -6.5 242 274 A R S >> S- 0 0 158 1,-0.1 3,-2.2 -64,-0.1 4,-0.5 -0.754 82.7-138.1 -85.9 121.1 41.4 7.6 -3.0 243 275 A P G >4 S+ 0 0 48 0, 0.0 3,-1.6 0, 0.0 -1,-0.1 0.821 101.9 51.8 -36.8 -50.9 40.1 9.8 -0.2 244 276 A S G 34 S+ 0 0 101 1,-0.3 -3,-0.0 -3,-0.0 -2,-0.0 0.702 98.0 65.2 -79.1 -12.2 43.0 9.2 2.1 245 277 A D G <4 S+ 0 0 77 -3,-2.2 -1,-0.3 -5,-0.1 -4,-0.1 0.570 86.8 98.1 -73.1 -12.3 45.5 10.2 -0.7 246 278 A R S << S- 0 0 14 -3,-1.6 -8,-0.2 -4,-0.5 2,-0.1 -0.471 82.4-105.4 -74.8 152.1 44.0 13.7 -0.4 247 279 A P - 0 0 3 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 -0.416 26.0-123.5 -72.0 148.3 45.6 16.5 1.6 248 280 A T > - 0 0 75 -2,-0.1 4,-2.3 1,-0.1 5,-0.2 -0.389 37.4 -99.8 -73.6 165.8 44.2 17.7 5.0 249 281 A F H > S+ 0 0 29 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.839 127.4 54.7 -59.3 -32.7 43.4 21.4 5.2 250 282 A E H > S+ 0 0 134 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.939 107.5 47.4 -70.1 -42.4 46.7 21.8 6.9 251 283 A E H 4 S+ 0 0 85 2,-0.2 -2,-0.2 1,-0.2 -1,-0.2 0.847 112.2 51.4 -62.6 -34.5 48.6 20.2 4.1 252 284 A I H >< S+ 0 0 0 -4,-2.3 3,-1.9 1,-0.2 6,-0.3 0.971 111.1 46.9 -63.4 -51.6 46.7 22.3 1.6 253 285 A Q H 3< S+ 0 0 12 -4,-2.7 -2,-0.2 1,-0.3 -1,-0.2 0.765 113.0 48.9 -68.2 -22.7 47.6 25.5 3.4 254 286 A N T 3< S+ 0 0 108 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.332 84.7 120.3 -92.7 5.7 51.2 24.6 3.8 255 287 A H S X S- 0 0 10 -3,-1.9 3,-2.0 -4,-0.1 4,-0.1 -0.474 76.9-116.8 -71.0 142.6 51.5 23.7 0.1 256 288 A P G > S+ 0 0 77 0, 0.0 3,-1.5 0, 0.0 -1,-0.1 0.821 112.9 60.6 -43.1 -40.5 54.1 25.7 -1.8 257 289 A W G 3 S+ 0 0 2 1,-0.3 -26,-0.1 -27,-0.2 -4,-0.1 0.741 98.6 56.9 -69.3 -16.9 51.4 27.2 -3.9 258 290 A M G < S+ 0 0 2 -3,-2.0 3,-0.4 -6,-0.3 -1,-0.3 0.248 81.1 122.8 -96.9 12.9 49.6 28.8 -1.0 259 291 A Q S < S+ 0 0 88 -3,-1.5 -5,-0.1 1,-0.2 -146,-0.0 -0.479 70.3 8.1 -79.0 141.3 52.6 30.7 0.2 260 292 A D S S- 0 0 152 -2,-0.2 -1,-0.2 1,-0.1 2,-0.1 0.942 78.3-171.9 59.8 60.3 52.6 34.5 0.6 261 293 A V - 0 0 41 -3,-0.4 2,-0.2 -148,-0.1 -1,-0.1 -0.463 24.9-109.7 -80.1 153.9 48.9 35.2 0.1 262 294 A L - 0 0 27 -152,-0.3 -1,-0.1 -2,-0.1 5,-0.0 -0.543 33.9-107.8 -75.7 147.1 47.7 38.8 -0.2 263 295 A L > - 0 0 110 -2,-0.2 4,-1.3 1,-0.1 5,-0.1 -0.413 34.1-110.5 -63.1 158.8 45.6 40.2 2.6 264 296 A P H >> S+ 0 0 41 0, 0.0 4,-2.0 0, 0.0 3,-0.8 0.947 119.1 53.7 -63.3 -47.0 41.9 40.6 1.6 265 297 A Q H 3> S+ 0 0 83 1,-0.3 4,-2.4 2,-0.2 3,-0.4 0.938 110.1 46.6 -46.8 -54.7 42.2 44.4 1.6 266 298 A E H 3> S+ 0 0 78 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.755 108.2 59.7 -59.0 -24.4 45.3 44.3 -0.8 267 299 A T H S+ 0 0 0 -4,-2.0 4,-2.1 -3,-0.4 5,-0.9 0.931 113.6 52.2 -70.9 -42.3 40.5 44.3 -3.5 269 301 A E H <5S+ 0 0 126 -4,-2.4 4,-0.4 4,-0.2 -2,-0.2 0.940 120.1 33.5 -57.8 -49.6 43.0 47.1 -4.1 270 302 A I H <5S+ 0 0 98 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.854 135.5 16.9 -73.7 -37.9 44.9 45.1 -6.7 271 303 A H H <5S+ 0 0 15 -4,-2.6 -3,-0.2 -5,-0.2 -2,-0.2 0.517 126.7 41.4-123.7 -12.7 42.3 43.0 -8.4 272 304 A L T <5S- 0 0 8 -4,-2.1 -3,-0.2 -5,-0.4 -4,-0.1 0.480 96.7-122.4-116.8 -5.9 38.8 44.4 -7.7 273 305 A H < 0 0 170 -5,-0.9 -4,-0.2 -4,-0.4 -3,-0.1 0.986 360.0 360.0 48.9 70.9 39.6 48.2 -8.0 274 306 A S 0 0 54 -6,-0.7 -1,-0.2 -9,-0.1 -2,-0.1 -0.987 360.0 360.0-145.8 360.0 38.4 49.1 -4.5