==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-NOV-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 18-DEC-00 1GHI . COMPND 2 MOLECULE: BETA-LACTAMASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STAPHYLOCOCCUS AUREUS; . AUTHOR C.C.H.CHEN,O.HERZBERG . 257 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11423.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 184 71.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 38 14.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.8 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 . 0 0.0 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 . 13 5.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 14.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 75 29.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 2.7 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 1 1 4 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 0 1 1 1 0 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 ANTIPARALLEL BRIDGES PER LADDER . 2 0 0 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 31 A K 0 0 139 0, 0.0 2,-0.4 0, 0.0 3,-0.1 0.000 360.0 360.0 360.0-173.0 30.6 -13.1 -22.5 2 32 A E > - 0 0 108 1,-0.1 4,-1.5 2,-0.0 5,-0.1 -0.922 360.0-149.4-114.2 144.4 30.1 -15.9 -19.9 3 33 A L H > S+ 0 0 20 -2,-0.4 4,-2.6 2,-0.2 5,-0.1 0.846 105.2 56.0 -84.2 -30.3 26.9 -16.4 -18.0 4 34 A N H > S+ 0 0 90 1,-0.2 4,-2.1 2,-0.2 5,-0.2 0.920 109.1 49.2 -61.1 -40.6 28.9 -17.8 -15.1 5 35 A D H > S+ 0 0 74 2,-0.2 4,-2.0 1,-0.2 -2,-0.2 0.857 109.9 48.7 -63.2 -41.7 30.7 -14.5 -15.4 6 36 A L H X S+ 0 0 0 -4,-1.5 4,-1.7 2,-0.2 5,-0.3 0.853 108.5 56.1 -68.4 -28.6 27.4 -12.6 -15.4 7 37 A E H X>S+ 0 0 38 -4,-2.6 4,-2.0 1,-0.2 5,-1.5 0.939 112.3 40.7 -64.9 -47.7 26.4 -14.7 -12.3 8 38 A K H <5S+ 0 0 173 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.834 112.9 55.0 -68.7 -39.1 29.5 -13.6 -10.4 9 39 A K H <5S+ 0 0 118 -4,-2.0 -1,-0.2 -5,-0.2 -2,-0.2 0.837 123.5 24.9 -65.5 -35.0 29.2 -10.1 -11.6 10 40 A Y H <5S- 0 0 37 -4,-1.7 -2,-0.2 2,-0.2 -1,-0.2 0.554 97.7-129.5-103.9 -16.0 25.6 -9.7 -10.4 11 41 A N T <5 + 0 0 102 -4,-2.0 224,-0.4 1,-0.3 2,-0.2 0.924 69.9 121.1 59.7 50.7 25.7 -12.3 -7.6 12 42 A A < - 0 0 7 -5,-1.5 2,-0.4 -6,-0.3 -1,-0.3 -0.750 65.8-113.4-137.1 167.1 22.6 -13.7 -9.1 13 43 A H E -A 233 0A 51 220,-2.6 220,-1.2 -2,-0.2 2,-0.4 -0.908 29.5-156.3-107.6 137.0 21.5 -17.1 -10.6 14 44 A I E -A 232 0A 0 -2,-0.4 2,-0.4 218,-0.2 218,-0.2 -0.939 13.7-175.7-122.4 140.2 20.7 -17.4 -14.2 15 45 A G E +A 231 0A 0 216,-2.2 216,-2.4 -2,-0.4 2,-0.4 -0.998 15.0 176.1-131.0 127.7 18.5 -19.9 -16.1 16 46 A V E +AB 230 29A 0 13,-2.9 13,-1.9 -2,-0.4 2,-0.3 -0.985 15.7 171.7-137.9 140.3 18.4 -19.7 -19.8 17 47 A Y E +AB 229 28A 3 212,-1.4 212,-3.0 -2,-0.4 2,-0.4 -0.961 11.3 176.1-143.8 130.6 16.8 -21.7 -22.6 18 48 A A E -AB 228 27A 0 9,-1.5 9,-1.9 -2,-0.3 2,-0.4 -0.995 6.6-175.7-139.9 133.6 16.8 -20.5 -26.2 19 49 A L E -AB 227 26A 17 208,-2.3 208,-2.8 -2,-0.4 2,-0.7 -0.994 18.3-150.1-137.4 120.9 15.5 -22.3 -29.2 20 50 A D E > -A 226 0A 16 5,-1.9 4,-2.4 -2,-0.4 5,-0.5 -0.854 14.3-156.3 -84.9 113.1 15.8 -20.9 -32.7 21 51 A T T 4 S+ 0 0 39 204,-2.2 -1,-0.1 -2,-0.7 205,-0.1 0.651 86.4 61.7 -71.6 -14.0 12.7 -22.5 -34.3 22 52 A K T 4 S+ 0 0 129 203,-0.3 -1,-0.2 202,-0.1 204,-0.1 0.930 124.2 14.2 -73.5 -46.3 14.2 -22.3 -37.8 23 53 A S T 4 S- 0 0 79 2,-0.1 -2,-0.2 -3,-0.0 3,-0.1 0.642 95.8-124.3 -98.1 -27.4 17.2 -24.7 -37.1 24 54 A G < + 0 0 43 -4,-2.4 2,-0.5 1,-0.3 -3,-0.2 0.730 54.3 158.2 85.1 19.7 16.1 -26.2 -33.8 25 55 A K - 0 0 88 -5,-0.5 -5,-1.9 2,-0.0 2,-0.3 -0.713 23.8-159.3 -82.1 124.0 19.3 -25.0 -32.2 26 56 A E E -B 19 0A 82 -2,-0.5 2,-0.4 -7,-0.2 -7,-0.2 -0.776 12.5-161.7-106.5 146.0 19.1 -24.7 -28.4 27 57 A V E -B 18 0A 20 -9,-1.9 -9,-1.5 -2,-0.3 2,-0.4 -0.978 19.7-173.5-120.7 131.2 21.3 -22.7 -25.9 28 59 A K E +B 17 0A 98 -2,-0.4 2,-0.3 -11,-0.2 -11,-0.2 -0.995 21.7 165.1-134.0 139.2 21.1 -23.9 -22.3 29 60 A F E S-B 16 0A 34 -13,-1.9 -13,-2.9 -2,-0.4 -2,-0.0 -0.888 88.7 -22.3-149.4 110.9 22.4 -22.6 -18.9 30 61 A N S > S+ 0 0 69 -2,-0.3 3,-2.0 -15,-0.2 121,-0.1 0.785 86.2 158.5 55.4 30.9 20.9 -24.1 -15.7 31 62 A S T 3 + 0 0 8 1,-0.3 120,-2.9 -15,-0.2 121,-0.4 0.562 66.7 50.8 -64.4 -6.1 17.9 -24.9 -18.0 32 63 A D T 3 S+ 0 0 123 117,-0.2 2,-0.3 118,-0.2 -1,-0.3 0.191 85.0 102.1-121.0 22.9 16.7 -27.5 -15.6 33 64 A K S < S- 0 0 72 -3,-2.0 2,-0.4 115,-0.0 118,-0.1 -0.754 74.1-115.5-103.2 142.6 16.7 -25.6 -12.4 34 65 A R + 0 0 73 -2,-0.3 2,-0.3 115,-0.2 115,-0.2 -0.759 35.6 172.8 -87.0 133.1 13.4 -24.3 -11.0 35 66 A F E -E 148 0B 1 113,-2.3 113,-1.4 -2,-0.4 2,-0.5 -0.899 44.6 -97.6-131.0 148.8 12.7 -20.5 -10.7 36 67 A A E -E 147 0B 2 -2,-0.3 111,-0.2 111,-0.2 196,-0.2 -0.643 32.8-160.3 -66.5 122.7 9.4 -18.8 -9.8 37 68 A Y > + 0 0 7 109,-0.9 3,-1.6 -2,-0.5 -1,-0.2 0.809 25.8 168.1 -76.0 -27.2 7.9 -17.9 -13.2 38 69 A A G > + 0 0 0 108,-0.6 3,-2.1 98,-0.3 4,-0.2 -0.151 65.0 0.5 53.8-139.1 5.5 -15.2 -11.8 39 70 A S G > S+ 0 0 10 1,-0.3 3,-1.0 2,-0.2 4,-0.3 0.472 115.8 79.9 -60.4 -2.2 3.8 -12.9 -14.3 40 71 A T G X> S+ 0 0 0 -3,-1.6 3,-1.6 1,-0.2 4,-0.5 0.806 80.8 70.4 -75.1 -21.2 5.5 -14.6 -17.3 41 72 A S H <> S+ 0 0 8 -3,-2.1 4,-2.4 1,-0.3 3,-0.3 0.680 79.3 78.3 -64.0 -15.2 2.7 -17.3 -16.8 42 73 A K H <> S+ 0 0 0 -3,-1.0 4,-2.4 1,-0.2 -1,-0.3 0.874 90.0 53.4 -62.8 -30.2 0.3 -14.6 -18.1 43 74 A A H <> S+ 0 0 0 -3,-1.6 4,-1.4 -4,-0.3 -1,-0.2 0.837 109.5 47.1 -74.2 -29.8 1.4 -15.4 -21.6 44 75 A I H X S+ 0 0 5 -4,-0.5 4,-2.0 -3,-0.3 -2,-0.2 0.944 112.4 49.0 -74.2 -46.1 0.7 -19.1 -21.1 45 76 A N H X S+ 0 0 10 -4,-2.4 4,-1.6 1,-0.2 3,-0.2 0.928 111.9 50.0 -58.7 -48.3 -2.7 -18.5 -19.6 46 77 A S H X S+ 0 0 0 -4,-2.4 4,-1.6 -5,-0.2 -1,-0.2 0.864 110.6 48.5 -59.9 -38.6 -3.6 -16.1 -22.5 47 78 A A H < S+ 0 0 0 -4,-1.4 4,-0.3 2,-0.2 -1,-0.2 0.813 106.6 55.9 -70.7 -34.0 -2.5 -18.5 -25.1 48 79 A I H >< S+ 0 0 2 -4,-2.0 3,-0.7 -3,-0.2 4,-0.3 0.882 109.7 46.7 -66.8 -38.0 -4.5 -21.4 -23.6 49 80 A L H >X S+ 0 0 2 -4,-1.6 3,-1.6 1,-0.2 4,-1.0 0.895 108.0 56.5 -67.1 -43.8 -7.7 -19.4 -23.8 50 81 A L T 3< S+ 0 0 4 -4,-1.6 117,-0.4 1,-0.3 -1,-0.2 0.511 97.8 63.5 -63.2 -12.9 -7.0 -18.3 -27.4 51 82 A E T <4 S+ 0 0 44 -3,-0.7 -1,-0.3 -4,-0.3 -2,-0.2 0.624 113.1 33.7 -84.7 -19.4 -6.8 -21.9 -28.4 52 83 A Q T <4 S+ 0 0 107 -3,-1.6 -2,-0.2 -4,-0.3 -1,-0.1 0.490 110.5 62.3-116.5 -2.7 -10.4 -22.3 -27.4 53 84 A V S < S- 0 0 19 -4,-1.0 -1,-0.2 33,-0.0 5,-0.1 -0.945 79.5-133.3-127.4 110.5 -12.0 -19.0 -28.3 54 87 A P > - 0 0 54 0, 0.0 3,-1.5 0, 0.0 4,-0.4 -0.134 26.5-109.5 -56.0 152.4 -11.9 -18.0 -32.0 55 88 A Y G > S+ 0 0 90 1,-0.3 3,-1.4 2,-0.2 4,-0.2 0.859 117.1 56.2 -55.4 -41.1 -10.9 -14.4 -32.8 56 89 A N G 3 S+ 0 0 118 1,-0.3 3,-0.4 2,-0.1 -1,-0.3 0.697 105.2 54.0 -66.5 -16.5 -14.3 -13.3 -33.9 57 90 A K G X S+ 0 0 117 -3,-1.5 3,-2.1 1,-0.2 -1,-0.3 0.421 75.5 97.8 -98.9 1.3 -15.7 -14.4 -30.5 58 91 A L T < + 0 0 2 -3,-1.4 29,-2.1 -4,-0.4 28,-0.5 0.646 69.9 72.6 -63.2 -16.8 -13.3 -12.4 -28.4 59 92 A N T 3 S+ 0 0 110 -3,-0.4 -1,-0.3 27,-0.2 -2,-0.1 0.579 71.1 119.3 -69.7 -18.0 -16.1 -9.7 -28.1 60 93 A K < - 0 0 117 -3,-2.1 26,-2.2 25,-0.1 27,-0.3 -0.256 59.5-136.4 -49.3 141.2 -17.9 -12.1 -25.7 61 94 A K E -F 85 0C 125 24,-0.3 2,-0.3 25,-0.1 24,-0.2 -0.738 17.2-163.4-110.1 154.3 -18.3 -10.6 -22.2 62 95 A V E -F 84 0C 14 22,-2.4 22,-2.4 -2,-0.3 2,-0.3 -0.955 27.3-114.8-131.4 148.6 -17.9 -11.8 -18.7 63 96 A H E -F 83 0C 97 -2,-0.3 2,-0.5 20,-0.2 20,-0.2 -0.666 27.2-158.7 -87.5 136.2 -19.2 -10.2 -15.5 64 97 A I + 0 0 0 18,-2.7 17,-1.8 -2,-0.3 18,-0.3 -0.945 15.6 172.2-115.5 132.3 -16.8 -8.8 -13.0 65 98 A N >> - 0 0 66 -2,-0.5 3,-2.6 15,-0.2 4,-0.9 -0.767 47.7 -83.7-132.9-179.6 -17.5 -8.2 -9.4 66 99 A K T 34 S+ 0 0 152 1,-0.3 3,-0.2 -2,-0.2 14,-0.1 0.740 121.6 58.2 -47.5 -38.9 -16.0 -7.2 -6.0 67 100 A D T 34 S+ 0 0 144 1,-0.2 -1,-0.3 3,-0.0 -3,-0.0 0.521 100.8 58.9 -72.5 -7.2 -14.9 -10.8 -5.3 68 101 A D T <4 S+ 0 0 38 -3,-2.6 -1,-0.2 8,-0.1 -2,-0.2 0.774 80.4 101.1 -90.4 -30.7 -12.8 -10.8 -8.5 69 102 A I < + 0 0 48 -4,-0.9 2,-0.3 -3,-0.2 3,-0.0 -0.363 45.5 171.6 -63.3 123.4 -10.6 -7.9 -7.6 70 103 A V - 0 0 41 -2,-0.1 30,-0.3 1,-0.1 29,-0.1 -0.830 46.3 -63.0-121.2 167.1 -7.1 -8.9 -6.4 71 104 A A S S+ 0 0 58 -2,-0.3 28,-0.3 1,-0.2 -1,-0.1 -0.162 112.3 21.8 -53.9 142.0 -4.2 -6.5 -5.8 72 105 A Y + 0 0 147 1,-0.2 27,-2.0 26,-0.1 -1,-0.2 0.984 68.2 149.5 62.4 66.4 -2.7 -4.5 -8.6 73 106 A S > + 0 0 3 25,-0.2 4,-1.7 26,-0.2 5,-0.2 -0.680 15.2 174.6-127.4 71.9 -5.4 -4.6 -11.1 74 107 A P T 4 S+ 0 0 42 0, 0.0 -1,-0.1 0, 0.0 23,-0.1 0.799 80.9 23.1 -52.2 -32.3 -4.8 -1.3 -12.9 75 108 A I T >4 S+ 0 0 45 -3,-0.1 3,-1.6 17,-0.1 4,-0.2 0.878 119.5 53.4-101.3 -51.2 -7.6 -1.9 -15.5 76 109 A L G >4 S+ 0 0 0 1,-0.3 3,-1.6 2,-0.2 4,-0.1 0.654 91.9 71.9 -62.9 -18.9 -10.0 -4.4 -14.0 77 110 A E G >< S+ 0 0 96 -4,-1.7 3,-0.6 1,-0.3 -1,-0.3 0.701 93.4 59.5 -73.3 -15.3 -10.7 -2.5 -10.8 78 111 A K G < S+ 0 0 139 -3,-1.6 -1,-0.3 1,-0.2 -2,-0.2 0.584 96.8 63.2 -84.0 -7.6 -12.6 -0.1 -12.9 79 112 A Y G X + 0 0 69 -3,-1.6 3,-3.1 -4,-0.2 -15,-0.3 0.288 64.9 138.9-101.5 13.2 -14.9 -2.9 -14.0 80 113 A V T < S+ 0 0 48 -3,-0.6 -15,-0.2 1,-0.3 3,-0.1 -0.385 83.5 8.2 -60.0 123.1 -16.4 -3.8 -10.6 81 114 A G T 3 S+ 0 0 47 -17,-1.8 -1,-0.3 1,-0.3 -16,-0.1 0.359 119.0 91.4 84.3 -1.2 -20.0 -4.4 -11.3 82 115 A K S < S- 0 0 124 -3,-3.1 -18,-2.7 -18,-0.3 2,-0.4 -0.361 73.2-107.8-115.2-170.4 -19.6 -4.2 -15.1 83 116 A D E -F 63 0C 84 -20,-0.2 2,-0.3 -2,-0.1 -20,-0.2 -0.930 26.1-166.8-121.9 153.1 -18.9 -6.5 -17.9 84 117 A I E -F 62 0C 3 -22,-2.4 -22,-2.4 -2,-0.4 2,-0.1 -0.976 21.4-117.3-140.7 142.8 -15.7 -6.9 -20.0 85 118 A T E > -F 61 0C 29 -2,-0.3 4,-1.7 -24,-0.2 -24,-0.3 -0.465 25.6-118.9 -75.6 158.2 -14.9 -8.6 -23.2 86 119 A L H > S+ 0 0 0 -26,-2.2 4,-2.0 -28,-0.5 5,-0.2 0.840 115.5 60.2 -64.2 -30.9 -12.4 -11.5 -23.3 87 120 A K H > S+ 0 0 72 -29,-2.1 4,-2.3 -27,-0.3 -1,-0.2 0.911 106.4 44.5 -60.2 -48.4 -10.3 -9.3 -25.7 88 121 A A H > S+ 0 0 18 -30,-0.3 4,-1.9 -3,-0.2 -2,-0.2 0.805 108.8 57.8 -68.0 -28.5 -9.9 -6.5 -23.0 89 122 A L H X S+ 0 0 0 -4,-1.7 4,-2.0 2,-0.2 -2,-0.2 0.946 111.5 43.1 -63.5 -44.9 -9.1 -9.2 -20.3 90 123 A I H X S+ 0 0 0 -4,-2.0 4,-2.5 1,-0.2 5,-0.3 0.918 111.9 52.1 -68.7 -44.7 -6.2 -10.4 -22.5 91 124 A E H X>S+ 0 0 72 -4,-2.3 4,-2.0 1,-0.2 5,-0.6 0.888 113.2 46.0 -60.4 -35.3 -5.1 -6.9 -23.3 92 125 A A H X5S+ 0 0 4 -4,-1.9 6,-2.3 3,-0.2 4,-0.8 0.854 113.3 47.9 -74.7 -39.4 -5.1 -6.0 -19.5 93 126 A S H X5S+ 0 0 0 -4,-2.0 4,-0.5 4,-0.2 -2,-0.2 0.950 120.5 36.9 -64.5 -51.1 -3.3 -9.1 -18.4 94 127 A M H <5S+ 0 0 2 -4,-2.5 -2,-0.2 -5,-0.2 -3,-0.2 0.849 126.7 31.5 -74.1 -37.9 -0.5 -8.8 -21.1 95 128 A T H <5S+ 0 0 39 -4,-2.0 88,-0.2 -5,-0.3 -3,-0.2 0.898 133.6 25.0 -91.1 -44.0 0.0 -5.1 -21.3 96 129 A Y H < - 0 0 0 -6,-2.3 4,-1.5 1,-0.1 -25,-0.2 -0.375 18.8-155.7 -66.5 119.5 -3.3 -7.0 -14.4 99 132 A N H > S+ 0 0 4 -27,-2.0 4,-1.8 -2,-0.3 34,-0.3 0.848 90.1 51.7 -69.6 -37.4 -3.7 -9.7 -11.8 100 133 A T H > S+ 0 0 1 -30,-0.3 4,-3.2 2,-0.2 5,-0.2 0.940 107.1 53.2 -62.8 -46.2 -7.6 -9.9 -11.8 101 134 A A H > S+ 0 0 0 1,-0.3 4,-2.4 2,-0.2 -1,-0.2 0.886 111.3 47.8 -56.1 -43.4 -7.7 -10.2 -15.7 102 135 A N H X S+ 0 0 0 -4,-1.5 4,-2.7 2,-0.2 -1,-0.3 0.888 111.3 48.0 -64.6 -44.6 -5.4 -13.1 -15.4 103 136 A N H X S+ 0 0 18 -4,-1.8 4,-2.3 2,-0.2 -2,-0.2 0.923 114.0 48.8 -63.7 -38.3 -7.3 -14.8 -12.6 104 137 A K H X S+ 0 0 38 -4,-3.2 4,-2.1 1,-0.2 -2,-0.2 0.857 109.6 51.2 -66.6 -40.7 -10.4 -14.3 -14.7 105 138 A I H X S+ 0 0 0 -4,-2.4 4,-1.3 -5,-0.2 -1,-0.2 0.911 109.8 50.1 -63.3 -43.8 -8.8 -15.7 -17.7 106 139 A I H X>S+ 0 0 3 -4,-2.7 5,-3.2 1,-0.2 4,-1.6 0.918 110.6 50.5 -60.9 -43.3 -7.7 -18.8 -15.7 107 140 A K H <5S+ 0 0 107 -4,-2.3 -1,-0.2 3,-0.2 -2,-0.2 0.870 108.2 52.4 -59.7 -45.1 -11.3 -19.1 -14.5 108 141 A E H <5S+ 0 0 55 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.746 108.1 50.9 -61.0 -35.2 -12.5 -18.9 -18.1 109 142 A I H <5S- 0 0 16 -4,-1.3 -1,-0.2 -3,-0.4 -2,-0.2 0.794 133.4 -93.8 -72.9 -31.7 -10.2 -21.7 -19.1 110 143 A G T <5 - 0 0 39 -4,-1.6 -3,-0.2 -5,-0.2 3,-0.2 0.336 66.7 -74.9 134.1 -4.1 -11.6 -23.7 -16.2 111 144 A G >>< - 0 0 0 -5,-3.2 3,-2.1 -6,-0.2 4,-1.4 -0.244 66.6 -55.6 103.4 166.2 -9.2 -23.0 -13.4 112 145 A I H 3> S+ 0 0 13 1,-0.3 4,-3.7 2,-0.2 5,-0.2 0.740 132.0 62.3 -47.7 -38.4 -5.7 -24.0 -12.4 113 146 A K H 3> S+ 0 0 125 1,-0.2 4,-0.9 -3,-0.2 -1,-0.3 0.829 107.2 42.2 -59.0 -42.9 -6.8 -27.6 -12.6 114 147 A K H <> S+ 0 0 98 -3,-2.1 4,-1.4 2,-0.2 -1,-0.2 0.740 114.0 51.6 -80.0 -28.0 -7.6 -27.2 -16.3 115 148 A V H X S+ 0 0 4 -4,-1.4 4,-1.6 2,-0.2 3,-0.3 0.945 108.0 52.4 -69.1 -50.6 -4.4 -25.2 -16.9 116 149 A K H X S+ 0 0 67 -4,-3.7 4,-1.1 1,-0.2 -2,-0.2 0.810 109.3 51.8 -53.4 -31.1 -2.4 -27.9 -15.3 117 150 A Q H X S+ 0 0 91 -4,-0.9 4,-1.9 2,-0.2 -1,-0.2 0.871 104.2 52.4 -76.4 -42.4 -4.0 -30.5 -17.6 118 151 A R H X S+ 0 0 35 -4,-1.4 4,-1.4 -3,-0.3 -1,-0.2 0.803 107.4 56.3 -65.9 -26.1 -3.3 -28.7 -20.8 119 152 A L H <>S+ 0 0 2 -4,-1.6 5,-2.9 2,-0.2 4,-0.3 0.877 105.6 48.4 -70.7 -42.1 0.3 -28.6 -19.8 120 153 A K H ><5S+ 0 0 101 -4,-1.1 3,-1.0 3,-0.2 -2,-0.2 0.854 108.5 56.8 -65.0 -36.0 0.5 -32.3 -19.3 121 154 A E H 3<5S+ 0 0 119 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.828 105.8 48.4 -62.7 -37.4 -1.1 -32.5 -22.7 122 155 A L T 3<5S- 0 0 11 -4,-1.4 -1,-0.3 2,-0.1 -2,-0.2 0.521 125.2-105.8 -77.5 -7.4 1.7 -30.5 -24.3 123 156 A G T < 5S+ 0 0 52 -3,-1.0 2,-1.2 -4,-0.3 -3,-0.2 0.502 76.2 139.8 93.4 7.1 4.2 -32.8 -22.5 124 157 A D < + 0 0 10 -5,-2.9 -1,-0.2 -6,-0.2 -2,-0.1 -0.726 13.0 160.5 -90.2 99.8 5.1 -30.2 -19.9 125 158 A K + 0 0 153 -2,-1.2 -1,-0.2 -3,-0.1 -5,-0.1 0.267 67.6 59.0 -98.7 7.0 5.4 -32.2 -16.8 126 159 A V S S+ 0 0 45 -7,-0.1 2,-0.2 23,-0.1 21,-0.2 0.806 73.5 90.6-103.1 -46.9 7.5 -29.5 -15.0 127 160 A T - 0 0 11 21,-0.1 21,-0.2 -8,-0.1 -8,-0.1 -0.433 60.9-161.5 -57.2 124.0 5.5 -26.2 -14.9 128 161 A N - 0 0 41 19,-3.0 18,-2.5 -2,-0.2 19,-0.5 -0.697 11.6-175.4-119.5 77.6 3.6 -26.3 -11.7 129 162 A P + 0 0 10 0, 0.0 -13,-0.1 0, 0.0 3,-0.1 -0.593 25.5 141.5 -70.9 123.6 0.6 -23.9 -11.4 130 163 A V + 0 0 54 -2,-0.4 2,-0.2 1,-0.3 -18,-0.1 0.627 54.4 40.0-129.3 -47.9 -0.8 -24.1 -7.9 131 164 A R S S- 0 0 49 1,-0.1 -1,-0.3 4,-0.1 2,-0.2 -0.542 70.9-123.6-106.9 165.3 -1.9 -20.7 -6.7 132 165 A Y > - 0 0 46 -2,-0.2 4,-1.2 1,-0.1 3,-0.4 -0.489 56.7 -39.6 -96.2 175.1 -3.7 -17.7 -8.3 133 166 A D T 4 S+ 0 0 3 1,-0.3 -1,-0.1 -34,-0.3 -62,-0.0 -0.549 122.9 13.6 -71.0 143.7 -2.4 -14.1 -8.4 134 167 A I T >4 S+ 0 0 41 -2,-0.2 3,-2.5 -64,-0.1 4,-0.3 -0.982 119.3 60.2-102.0 4.1 -1.0 -12.8 -6.2 135 168 A E G >4 S+ 0 0 114 -3,-0.4 3,-0.5 1,-0.3 -2,-0.2 0.626 98.0 65.8 -64.2 -13.3 -0.2 -15.7 -4.0 136 169 A L G 3< S+ 0 0 5 -4,-1.2 -1,-0.3 1,-0.2 -98,-0.3 0.709 90.2 66.7 -77.5 -18.4 1.8 -17.2 -6.8 137 170 A Q G < S+ 0 0 19 -3,-2.5 69,-2.1 -5,-0.2 2,-1.6 0.613 76.4 91.0 -74.1 -16.5 4.2 -14.2 -6.4 138 171 A Y < - 0 0 110 -3,-0.5 2,-0.2 -4,-0.3 -1,-0.1 -0.628 68.3-166.9 -84.8 87.6 5.4 -15.4 -2.9 139 172 A Y - 0 0 21 -2,-1.6 69,-0.1 98,-0.1 7,-0.1 -0.488 16.3-177.3 -82.4 144.4 8.3 -17.5 -3.9 140 173 A S > - 0 0 31 5,-0.2 3,-2.3 3,-0.2 5,-0.1 -0.986 25.5-146.4-139.2 123.3 10.2 -19.9 -1.7 141 174 A P T 3 S+ 0 0 71 0, 0.0 -107,-0.1 0, 0.0 -1,-0.1 0.708 102.9 63.4 -59.5 -20.7 13.2 -21.9 -2.9 142 175 A K T 3 S+ 0 0 165 -3,-0.0 2,-0.3 2,-0.0 -3,-0.0 0.559 100.2 61.5 -83.0 -5.6 11.9 -24.6 -0.6 143 176 A S < - 0 0 31 -3,-2.3 -3,-0.2 2,-0.1 0, 0.0 -0.876 62.5-151.6-124.2 154.0 8.7 -25.0 -2.7 144 177 A K > + 0 0 139 -2,-0.3 3,-1.0 3,-0.1 2,-0.3 0.297 55.7 130.3 -99.7 0.8 7.9 -26.1 -6.2 145 178 A K T 3 S- 0 0 55 1,-0.3 -5,-0.2 -5,-0.1 -2,-0.1 -0.461 79.5 -1.8 -67.5 130.7 4.7 -24.1 -6.3 146 179 A D T 3 S+ 0 0 1 -18,-2.5 -109,-0.9 -2,-0.3 -108,-0.6 0.943 107.3 121.3 57.4 50.7 4.3 -21.8 -9.2 147 180 A T E < +E 36 0B 1 -3,-1.0 -19,-3.0 -19,-0.5 2,-0.3 -0.922 33.3 172.8-135.9 164.0 7.7 -22.8 -10.7 148 181 A S E -E 35 0B 0 -113,-1.4 -113,-2.3 -2,-0.3 -21,-0.1 -0.898 33.9-106.6-157.2 172.9 9.1 -24.2 -13.9 149 182 A T > - 0 0 10 -2,-0.3 4,-2.0 -115,-0.2 5,-0.3 -0.693 32.9-113.2-103.7 158.7 12.5 -24.8 -15.3 150 183 A P H > S+ 0 0 0 0, 0.0 4,-1.8 0, 0.0 -118,-0.2 0.894 117.0 50.9 -61.5 -35.2 13.8 -22.7 -18.2 151 184 A A H > S+ 0 0 3 -120,-2.9 4,-2.0 1,-0.2 -119,-0.1 0.908 112.2 47.4 -64.7 -43.4 13.8 -25.7 -20.6 152 185 A A H > S+ 0 0 13 -121,-0.4 4,-1.9 2,-0.2 -1,-0.2 0.878 113.8 43.4 -64.0 -49.1 10.2 -26.6 -19.7 153 186 A F H X S+ 0 0 0 -4,-2.0 4,-2.9 2,-0.2 5,-0.2 0.953 114.2 54.2 -63.1 -48.9 8.6 -23.1 -20.0 154 187 A G H X S+ 0 0 0 -4,-1.8 4,-1.5 -5,-0.3 -2,-0.2 0.908 109.9 44.6 -51.4 -50.4 10.6 -22.6 -23.2 155 188 A K H X S+ 0 0 85 -4,-2.0 4,-2.2 1,-0.2 -1,-0.2 0.843 112.5 52.4 -66.0 -34.5 9.3 -25.7 -24.8 156 189 A T H X S+ 0 0 2 -4,-1.9 4,-1.2 1,-0.2 -2,-0.2 0.904 107.9 51.5 -67.9 -40.0 5.7 -25.0 -23.7 157 190 A L H X>S+ 0 0 0 -4,-2.9 4,-1.9 2,-0.2 5,-1.3 0.839 109.9 50.2 -66.1 -34.2 5.8 -21.5 -25.2 158 191 A N H <>S+ 0 0 31 -4,-1.5 5,-2.3 -5,-0.2 -2,-0.2 0.976 112.3 44.4 -70.7 -50.5 7.0 -22.9 -28.5 159 192 A K H <5S+ 0 0 97 -4,-2.2 6,-0.2 1,-0.2 -2,-0.2 0.661 120.5 42.8 -65.4 -17.8 4.3 -25.6 -28.8 160 193 A L H <5S+ 0 0 0 -4,-1.2 6,-0.3 4,-0.2 5,-0.3 0.855 134.0 4.7 -91.5 -50.1 1.5 -23.1 -27.7 161 194 A I T ><5S+ 0 0 1 -4,-1.9 3,-0.7 -5,-0.2 -3,-0.2 0.799 127.7 45.0-102.8 -62.6 2.4 -20.0 -29.6 162 195 A A T 3 - 0 0 45 -117,-0.4 4,-2.0 -2,-0.3 5,-0.2 -0.177 28.7-102.6 -72.9 174.8 -5.1 -19.2 -35.6 168 201 A K H > S+ 0 0 127 1,-0.2 4,-1.9 2,-0.2 5,-0.1 0.915 119.6 44.0 -62.2 -45.2 -3.4 -16.5 -37.6 169 202 A E H > S+ 0 0 101 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.876 114.8 45.7 -71.7 -42.0 -5.4 -13.7 -36.0 170 203 A N H > S+ 0 0 3 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.943 114.4 50.2 -68.7 -43.0 -5.2 -14.8 -32.4 171 204 A K H X S+ 0 0 37 -4,-2.0 4,-1.9 1,-0.2 -2,-0.2 0.870 113.0 45.4 -62.2 -36.6 -1.5 -15.5 -32.8 172 205 A K H X S+ 0 0 82 -4,-1.9 4,-2.5 2,-0.2 -1,-0.2 0.862 113.0 53.2 -70.1 -36.1 -1.0 -12.0 -34.3 173 206 A F H X S+ 0 0 18 -4,-2.1 4,-1.6 2,-0.2 -2,-0.2 0.933 110.7 43.7 -62.6 -49.8 -3.2 -10.6 -31.5 174 207 A L H X S+ 0 0 0 -4,-2.8 4,-1.6 1,-0.2 -2,-0.2 0.955 116.7 48.4 -60.7 -50.9 -1.2 -12.2 -28.7 175 208 A L H X S+ 0 0 10 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.803 105.7 54.8 -64.8 -34.3 2.1 -11.2 -30.4 176 209 A D H X S+ 0 0 86 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.935 107.2 52.7 -65.7 -40.0 1.3 -7.6 -31.1 177 210 A L H X S+ 0 0 21 -4,-1.6 4,-0.6 1,-0.2 -2,-0.2 0.903 112.5 44.6 -57.8 -44.5 0.5 -7.2 -27.4 178 211 A M H < S+ 0 0 1 -4,-1.6 22,-1.5 1,-0.2 -1,-0.2 0.800 111.0 53.9 -73.3 -27.2 3.8 -8.6 -26.6 179 212 A L H < S+ 0 0 42 -4,-2.1 -2,-0.2 20,-0.3 -1,-0.2 0.890 115.8 38.4 -74.3 -32.6 5.6 -6.4 -29.2 180 213 A N H < S+ 0 0 113 -4,-2.5 2,-0.9 -5,-0.2 -1,-0.2 0.412 79.9 125.3-101.0 6.5 4.1 -3.2 -27.9 181 214 A N >< - 0 0 2 -4,-0.6 3,-1.3 -5,-0.2 19,-0.1 -0.451 43.8-164.3 -64.4 102.3 4.4 -4.0 -24.2 182 215 A K G > S+ 0 0 156 -2,-0.9 3,-0.7 1,-0.2 -1,-0.2 0.567 75.1 79.5 -70.6 -0.6 6.4 -1.0 -22.8 183 216 A S G 3 S+ 0 0 63 1,-0.2 -1,-0.2 -88,-0.2 3,-0.2 0.502 87.4 54.0 -83.1 -9.7 7.1 -2.9 -19.5 184 217 A G G X > + 0 0 0 -3,-1.3 3,-1.4 1,-0.1 5,-1.0 0.253 69.6 109.0-112.9 18.1 9.9 -5.0 -20.9 185 218 A D T < 5S+ 0 0 69 -3,-0.7 -1,-0.1 1,-0.3 -2,-0.1 0.553 76.9 53.0 -68.2 -11.6 12.2 -2.4 -22.3 186 219 A T T 3 5S+ 0 0 73 -3,-0.2 61,-0.5 3,-0.1 -1,-0.3 0.371 110.6 51.2-106.0 5.4 14.9 -2.8 -19.7 187 220 A L T X>5S- 0 0 0 -3,-1.4 3,-2.3 59,-0.1 4,-1.1 0.291 123.7 -16.2-110.8-123.9 15.2 -6.5 -20.2 188 221 A I H >>5S+ 0 0 0 1,-0.3 4,-0.6 2,-0.2 3,-0.5 0.859 133.0 58.2 -57.8 -37.4 15.6 -8.6 -23.3 189 222 A K H 34 - 0 0 60 0, 0.0 3,-1.7 0, 0.0 -1,-0.1 -0.256 36.9-118.7 -52.3 145.1 20.6 -5.7 -31.5 194 227 A K T 3 S+ 0 0 179 1,-0.3 -2,-0.0 -4,-0.1 -3,-0.0 0.734 110.5 71.2 -65.2 -19.2 18.3 -2.9 -32.6 195 228 A D T 3 S+ 0 0 107 25,-0.1 -1,-0.3 2,-0.0 2,-0.2 0.748 86.9 85.9 -59.8 -33.0 17.7 -4.8 -35.8 196 229 A Y S < S- 0 0 41 -3,-1.7 2,-0.4 23,-0.1 -4,-0.1 -0.516 71.0-137.1 -80.3 147.4 15.7 -7.5 -33.9 197 230 A K E -C 218 0A 119 21,-1.9 21,-3.0 -2,-0.2 2,-0.5 -0.841 19.4-160.9-103.1 131.4 11.9 -7.5 -32.9 198 231 A V E -C 217 0A 10 -2,-0.4 2,-0.6 19,-0.2 19,-0.2 -0.980 13.2-176.4-120.4 119.2 11.2 -8.6 -29.3 199 232 A A E +C 216 0A 0 17,-2.3 17,-2.0 -2,-0.5 2,-0.3 -0.944 30.3 160.5-112.5 105.1 7.8 -9.8 -28.3 200 233 A D E -C 215 0A 0 -22,-1.5 2,-0.4 -2,-0.6 15,-0.2 -0.846 40.1-153.7-127.6 169.6 8.1 -10.4 -24.5 201 234 A K E -C 214 0A 3 13,-2.4 13,-1.4 -2,-0.3 2,-0.1 -0.971 27.4-154.8-139.2 114.9 6.1 -10.9 -21.2 202 235 A S E -C 213 0A 9 -2,-0.4 2,-0.3 11,-0.2 11,-0.2 -0.348 8.6-165.6 -85.7 169.1 8.2 -10.0 -18.1 203 236 A G E -C 212 0A 2 9,-1.9 9,-2.7 -164,-0.1 2,-0.3 -0.995 14.1-178.4-155.0 154.1 7.8 -11.2 -14.5 204 237 A Q E -C 211 0A 90 -2,-0.3 7,-0.2 7,-0.2 -165,-0.1 -0.806 15.0-152.8-156.7 113.7 8.9 -10.4 -11.0 205 238 A A - 0 0 4 5,-2.0 -67,-0.2 -2,-0.3 5,-0.1 -0.408 28.7-114.5 -81.1 166.5 8.0 -12.3 -7.9 206 239 A I S S+ 0 0 93 -69,-2.1 3,-0.3 -2,-0.1 2,-0.2 0.815 92.4 56.1 -70.5 -29.8 7.8 -10.7 -4.4 207 240 A T S > S+ 0 0 12 -70,-0.9 3,-1.6 1,-0.2 -2,-0.2 -0.683 100.0 12.4-114.7 160.9 10.8 -12.7 -3.1 208 241 A Y T 3 S- 0 0 42 29,-1.9 26,-2.1 1,-0.3 3,-0.2 0.760 110.8 -79.2 49.5 36.1 14.4 -13.5 -3.8 209 242 A A T 3 S- 0 0 4 30,-0.8 2,-0.9 28,-0.5 -1,-0.3 0.788 70.9-176.4 47.5 32.9 14.8 -10.7 -6.4 210 243 A S < + 0 0 2 -3,-1.6 -5,-2.0 -5,-0.1 2,-0.4 -0.540 7.8 169.5 -64.7 99.3 13.1 -13.2 -8.8 211 244 A R E +CD 204 232A 25 21,-1.3 21,-0.8 -2,-0.9 2,-0.2 -0.965 5.8 175.7-121.4 125.8 13.1 -11.2 -12.1 212 245 A N E -CD 203 231A 0 -9,-2.7 -9,-1.9 -2,-0.4 2,-0.3 -0.773 18.5-175.1-129.3 166.3 12.1 -12.9 -15.5 213 246 A D E -CD 202 230A 0 17,-1.8 17,-2.9 -11,-0.2 2,-0.4 -0.886 1.5-174.8-159.2 134.2 11.5 -12.3 -19.2 214 247 A V E +CD 201 229A 0 -13,-1.4 -13,-2.4 -2,-0.3 2,-0.3 -0.991 21.3 161.9-130.0 132.2 10.3 -14.6 -21.9 215 248 A A E -CD 200 228A 0 13,-2.2 13,-2.9 -2,-0.4 2,-0.5 -0.953 42.5-128.8-149.7 164.4 10.3 -13.5 -25.5 216 249 A F E -CD 199 227A 1 -17,-2.0 -17,-2.3 -2,-0.3 2,-0.4 -0.998 34.1-159.8-112.4 120.6 10.1 -14.4 -29.1 217 250 A V E -CD 198 226A 0 9,-2.2 9,-2.2 -2,-0.5 -19,-0.2 -0.905 6.3-159.2-107.8 128.5 13.0 -12.6 -30.9 218 251 A Y E -C 197 0A 28 -21,-3.0 -21,-1.9 -2,-0.4 3,-0.1 -0.903 14.1-144.6-111.9 103.4 12.9 -12.1 -34.7 219 252 A P > - 0 0 16 0, 0.0 3,-2.4 0, 0.0 2,-0.4 -0.302 36.1 -93.9 -60.9 144.4 16.4 -11.5 -36.1 220 253 A K T 3 S+ 0 0 145 1,-0.3 -24,-0.1 3,-0.0 3,-0.1 -0.536 119.9 27.6 -61.3 117.4 16.5 -9.0 -38.9 221 254 A G T 3 S+ 0 0 83 -2,-0.4 2,-0.4 1,-0.2 -1,-0.3 0.087 105.2 87.7 116.6 -19.8 16.2 -11.5 -41.8 222 255 A Q < - 0 0 39 -3,-2.4 -1,-0.2 1,-0.1 -200,-0.0 -0.904 46.4-172.5-118.0 137.3 14.4 -14.4 -40.2 223 256 A S S S+ 0 0 97 -2,-0.4 -1,-0.1 -3,-0.1 -3,-0.0 0.674 71.1 80.4 -99.0 -18.6 10.7 -14.8 -39.9 224 257 A E S S- 0 0 60 1,-0.1 -202,-0.1 -5,-0.0 2,-0.1 -0.625 84.0-127.0 -84.0 140.2 10.8 -17.8 -37.6 225 258 A P - 0 0 11 0, 0.0 -204,-2.2 0, 0.0 2,-0.6 -0.435 0.9-126.5 -90.9 168.5 11.4 -16.6 -34.0 226 259 A I E -AD 20 217A 2 -9,-2.2 -9,-2.2 -206,-0.2 2,-0.5 -0.972 25.7-138.5-107.8 113.3 13.9 -17.6 -31.4 227 260 A V E -AD 19 216A 0 -208,-2.8 -208,-2.3 -2,-0.6 2,-0.5 -0.689 26.1-172.0 -71.5 121.0 12.1 -18.6 -28.2 228 261 A L E -AD 18 215A 0 -13,-2.9 -13,-2.2 -2,-0.5 2,-0.5 -0.937 12.5-176.7-127.2 117.7 14.1 -17.1 -25.3 229 262 A V E +AD 17 214A 0 -212,-3.0 -212,-1.4 -2,-0.5 2,-0.5 -0.927 2.5 179.1-114.9 112.7 13.5 -17.7 -21.6 230 263 A I E +AD 16 213A 0 -17,-2.9 -17,-1.8 -2,-0.5 2,-0.4 -0.951 3.5 175.2-116.5 109.2 15.5 -15.9 -19.0 231 264 A F E +AD 15 212A 0 -216,-2.4 -216,-2.2 -2,-0.5 2,-0.3 -0.908 7.5 176.1-109.7 136.2 14.8 -16.6 -15.3 232 265 A T E +AD 14 211A 3 -21,-0.8 -21,-1.3 -2,-0.4 2,-0.3 -0.996 7.2 162.5-141.9 150.8 16.9 -15.1 -12.5 233 266 A N E -A 13 0A 5 -220,-1.2 -220,-2.6 -2,-0.3 2,-0.2 -0.939 21.5-134.3-153.7 173.0 17.0 -15.0 -8.7 234 267 A K - 0 0 44 -26,-2.1 -222,-0.1 -2,-0.3 -223,-0.1 -0.677 29.4-104.0-125.3-177.1 19.3 -14.2 -5.7 235 268 A D S S+ 0 0 82 -224,-0.4 2,-0.4 -2,-0.2 -223,-0.1 0.680 92.5 66.1 -90.1 -15.1 20.1 -15.8 -2.4 236 269 A N S > S- 0 0 93 1,-0.1 3,-2.2 4,-0.1 -2,-0.2 -0.909 75.0-131.1-117.3 140.2 18.2 -13.6 -0.0 237 270 A K T 3 S+ 0 0 131 -2,-0.4 -29,-1.9 1,-0.3 -28,-0.5 0.836 107.4 41.3 -50.5 -42.0 14.6 -13.2 0.4 238 271 A S T 3 S+ 0 0 115 -31,-0.2 -1,-0.3 -30,-0.2 2,-0.1 0.282 83.0 132.3 -98.8 17.7 14.6 -9.5 0.4 239 272 A D < - 0 0 43 -3,-2.2 -30,-0.8 1,-0.1 -5,-0.1 -0.350 49.8-139.2 -68.2 136.9 17.2 -9.0 -2.4 240 273 A K - 0 0 175 -32,-0.1 2,-0.2 -31,-0.1 -4,-0.1 -0.774 19.5-130.8 -94.6 142.7 16.3 -6.5 -5.1 241 274 A P - 0 0 33 0, 0.0 2,-0.5 0, 0.0 -31,-0.1 -0.524 5.7-134.3 -90.2 162.7 17.2 -7.5 -8.8 242 275 A N > - 0 0 89 -2,-0.2 3,-1.8 -33,-0.1 4,-0.3 -0.995 6.5-150.2-118.5 118.3 19.0 -5.4 -11.3 243 276 A D T >> S+ 0 0 39 -2,-0.5 4,-1.8 1,-0.3 3,-1.5 0.781 90.5 75.1 -58.5 -33.4 17.4 -5.5 -14.8 244 277 A K H 3> S+ 0 0 84 1,-0.3 4,-2.8 2,-0.2 -1,-0.3 0.752 85.8 68.7 -54.5 -21.8 20.8 -5.0 -16.5 245 278 A L H <> S+ 0 0 6 -3,-1.8 4,-1.6 2,-0.2 -1,-0.3 0.922 102.7 40.1 -64.4 -42.2 21.3 -8.6 -15.7 246 279 A I H <> S+ 0 0 0 -3,-1.5 4,-2.7 -4,-0.3 5,-0.2 0.922 114.0 55.6 -72.9 -41.0 18.6 -9.9 -18.1 247 280 A S H X S+ 0 0 0 -4,-1.8 4,-2.0 -61,-0.5 -2,-0.2 0.959 112.2 41.8 -52.4 -52.4 19.7 -7.3 -20.7 248 281 A E H X S+ 0 0 32 -4,-2.8 4,-1.7 1,-0.2 -1,-0.2 0.802 111.2 54.2 -69.9 -29.1 23.3 -8.6 -20.6 249 282 A T H X S+ 0 0 0 -4,-1.6 4,-2.4 -5,-0.2 -1,-0.2 0.914 109.0 50.5 -71.0 -33.7 22.3 -12.2 -20.5 250 283 A A H X S+ 0 0 0 -4,-2.7 4,-1.9 1,-0.2 -2,-0.2 0.861 107.2 54.6 -69.0 -38.7 20.2 -11.6 -23.7 251 284 A K H X S+ 0 0 93 -4,-2.0 4,-0.6 -5,-0.2 -1,-0.2 0.936 112.3 41.8 -59.8 -48.2 23.1 -9.9 -25.4 252 285 A S H >< S+ 0 0 10 -4,-1.7 3,-1.2 1,-0.2 -2,-0.2 0.899 112.3 53.3 -66.8 -45.7 25.4 -12.9 -24.9 253 286 A V H >< S+ 0 0 2 -4,-2.4 3,-1.5 1,-0.3 4,-0.2 0.839 101.3 59.2 -62.6 -32.4 22.9 -15.5 -25.7 254 287 A M H >< S+ 0 0 8 -4,-1.9 3,-1.3 1,-0.3 -1,-0.3 0.716 90.2 73.7 -68.7 -18.5 22.1 -13.8 -29.0 255 288 A K T << S+ 0 0 130 -3,-1.2 -1,-0.3 -4,-0.6 -2,-0.2 0.528 88.9 61.6 -67.6 -12.8 25.8 -14.3 -30.0 256 289 A E T < 0 0 101 -3,-1.5 -1,-0.3 -4,-0.2 -2,-0.2 0.558 360.0 360.0 -87.7 -16.7 25.0 -18.0 -30.4 257 290 A F < 0 0 80 -3,-1.3 -2,-0.2 -4,-0.2 -3,-0.1 0.834 360.0 360.0-107.5 360.0 22.6 -17.4 -33.2