==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=17-JUN-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSCRIPTION ACTIVATOR 25-APR-12 4EV0 . COMPND 2 MOLECULE: TRANSCRIPTION REGULATOR, CRP FAMILY; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMUS THERMOPHILUS; . AUTHOR B.P.HUDSON,K.TURO,J.J.BIRKTOFT,C.L.LAWSON . 427 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 20638.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 323 75.6 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 . 89 20.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 1 0.2 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 . 20 4.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 36 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 158 37.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 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 0 0 2 0 6 0 2 0 0 2 0 0 1 0 0 0 0 0 1 0 0 0 0 0 0 0 1 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 . 1 4 2 4 2 3 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 . 0 2 4 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 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 4 A S > 0 0 66 0, 0.0 3,-2.4 0, 0.0 68,-0.1 0.000 360.0 360.0 360.0 125.0 30.2 54.3 38.1 2 5 A P G > + 0 0 75 0, 0.0 3,-1.4 0, 0.0 67,-0.1 0.681 360.0 71.8 -61.6 -18.0 30.8 55.8 41.5 3 6 A L G 3 S+ 0 0 1 1,-0.3 112,-0.2 3,-0.0 113,-0.1 0.705 103.5 43.6 -65.9 -19.1 34.6 55.5 41.1 4 7 A F G X S+ 0 0 19 -3,-2.4 3,-2.0 111,-0.1 -1,-0.3 0.140 81.4 143.2-113.6 18.0 34.3 58.3 38.6 5 8 A H T < S+ 0 0 143 -3,-1.4 3,-0.1 1,-0.3 110,-0.1 -0.386 72.8 17.3 -61.7 128.3 31.9 60.5 40.6 6 9 A G T 3 S+ 0 0 60 1,-0.3 2,-0.3 -2,-0.1 -1,-0.3 0.314 94.5 128.0 91.4 -10.1 32.7 64.2 40.1 7 10 A L < - 0 0 21 -3,-2.0 -1,-0.3 1,-0.1 5,-0.1 -0.610 62.3-116.6 -83.3 139.9 34.8 63.6 36.9 8 11 A A >> - 0 0 30 -2,-0.3 4,-2.2 1,-0.1 3,-1.0 -0.293 35.1-104.3 -60.8 155.3 34.1 65.6 33.7 9 12 A P H 3> S+ 0 0 104 0, 0.0 4,-1.6 0, 0.0 -1,-0.1 0.857 123.8 48.2 -53.9 -37.1 33.0 63.4 30.8 10 13 A E H 3> S+ 0 0 129 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.692 109.4 54.4 -78.3 -16.9 36.5 63.7 29.1 11 14 A E H <> S+ 0 0 64 -3,-1.0 4,-2.7 2,-0.2 -1,-0.2 0.837 103.6 54.2 -79.9 -35.4 38.1 62.8 32.4 12 15 A V H X S+ 0 0 36 -4,-2.2 4,-2.8 2,-0.2 -2,-0.2 0.949 109.6 49.6 -59.3 -45.6 36.0 59.7 32.6 13 16 A D H X S+ 0 0 113 -4,-1.6 4,-0.8 1,-0.2 -2,-0.2 0.907 111.0 48.2 -58.3 -46.3 37.4 58.9 29.2 14 17 A L H >< S+ 0 0 60 -4,-1.6 3,-0.7 1,-0.2 4,-0.4 0.898 112.1 49.3 -62.4 -41.0 40.9 59.5 30.3 15 18 A A H >< S+ 0 0 0 -4,-2.7 3,-2.0 1,-0.2 4,-0.5 0.940 106.1 56.4 -63.8 -45.5 40.5 57.4 33.4 16 19 A L H >< S+ 0 0 63 -4,-2.8 3,-0.7 1,-0.3 -1,-0.2 0.687 94.5 68.7 -60.5 -18.8 39.0 54.5 31.4 17 20 A S T << S+ 0 0 83 -4,-0.8 -1,-0.3 -3,-0.7 -2,-0.2 0.668 90.7 61.0 -77.6 -18.2 42.2 54.5 29.3 18 21 A Y T < S+ 0 0 56 -3,-2.0 80,-0.4 -4,-0.4 -1,-0.2 0.680 93.6 85.3 -77.7 -17.8 44.2 53.2 32.2 19 22 A F < - 0 0 17 -3,-0.7 2,-0.4 -4,-0.5 78,-0.2 -0.342 67.8-144.6 -82.2 165.3 42.0 50.1 32.4 20 23 A Q E -A 96 0A 76 76,-2.0 76,-2.9 -2,-0.1 2,-0.3 -0.997 18.3-120.2-133.7 133.7 42.4 46.8 30.4 21 24 A R E +A 95 0A 151 -2,-0.4 2,-0.4 74,-0.2 74,-0.2 -0.545 30.0 179.9 -80.1 133.5 39.6 44.7 29.1 22 25 A R E -A 94 0A 92 72,-2.5 72,-2.9 -2,-0.3 2,-0.4 -0.999 14.6-146.3-132.9 136.0 39.4 41.0 30.2 23 26 A L E -A 93 0A 121 -2,-0.4 70,-0.2 70,-0.2 68,-0.0 -0.841 14.3-179.1-108.1 140.2 36.8 38.5 29.1 24 27 A Y E -A 92 0A 26 68,-2.9 68,-3.5 -2,-0.4 66,-0.1 -0.903 17.2-145.5-139.9 105.2 35.3 35.7 31.3 25 28 A P > - 0 0 73 0, 0.0 3,-1.8 0, 0.0 63,-0.2 -0.228 49.6 -62.6 -63.7 163.9 32.7 33.3 29.9 26 29 A Q T 3 S+ 0 0 132 1,-0.3 63,-0.2 63,-0.1 65,-0.1 -0.189 121.7 14.7 -57.0 129.7 30.0 32.0 32.3 27 30 A G T 3 S+ 0 0 52 61,-2.2 -1,-0.3 1,-0.3 62,-0.1 0.385 90.7 135.0 90.7 -2.6 31.2 30.0 35.3 28 31 A K < - 0 0 100 -3,-1.8 60,-2.4 62,-0.2 -1,-0.3 -0.659 57.8-119.2 -84.8 130.4 34.8 31.0 34.9 29 32 A P E -D 87 0B 50 0, 0.0 58,-0.3 0, 0.0 3,-0.1 -0.462 22.2-172.6 -66.2 131.5 36.8 32.0 38.0 30 33 A I E S- 0 0 18 56,-2.8 2,-0.3 1,-0.4 57,-0.2 0.840 70.8 -27.5 -89.3 -45.6 38.1 35.6 38.0 31 34 A F E -D 86 0B 13 55,-1.8 55,-2.7 6,-0.0 -1,-0.4 -0.967 60.1-126.3-160.0 163.6 40.1 35.1 41.2 32 35 A Y > - 0 0 132 -2,-0.3 3,-2.2 53,-0.2 50,-0.4 -0.848 36.3 -93.8-110.9 149.5 40.2 33.1 44.4 33 36 A Q T 3 S+ 0 0 45 -2,-0.3 50,-0.2 1,-0.3 52,-0.1 -0.306 114.8 34.2 -49.4 134.8 40.4 34.1 48.1 34 37 A G T 3 S+ 0 0 38 48,-2.3 -1,-0.3 1,-0.3 49,-0.1 0.186 86.7 132.7 94.9 -18.4 44.1 34.0 49.1 35 38 A D < - 0 0 68 -3,-2.2 47,-1.7 47,-0.1 2,-1.4 -0.359 65.4-119.1 -65.5 144.7 45.4 35.2 45.7 36 39 A L B -G 81 0C 137 45,-0.2 45,-0.2 -3,-0.1 -1,-0.1 -0.697 40.7-154.1 -82.3 95.2 47.9 38.0 45.5 37 40 A G - 0 0 11 -2,-1.4 3,-0.1 43,-0.7 42,-0.1 -0.384 25.2-177.7 -74.3 146.8 45.9 40.4 43.5 38 41 A Q + 0 0 134 1,-0.1 61,-2.4 -2,-0.1 2,-0.3 0.320 63.7 37.2-122.8 7.5 47.4 43.1 41.4 39 42 A A E -B 98 0A 0 59,-0.3 2,-0.3 33,-0.1 59,-0.2 -0.990 61.5-133.2-156.0 152.8 44.3 44.9 40.1 40 43 A L E -B 97 0A 1 57,-1.8 57,-2.8 -2,-0.3 2,-0.4 -0.709 30.6-141.4-102.0 168.0 40.8 46.1 40.8 41 44 A Y E -BC 96 71A 21 30,-3.0 30,-1.8 -2,-0.3 2,-0.4 -0.957 14.4-158.2-134.0 145.0 37.9 45.6 38.4 42 45 A L E -BC 95 70A 6 53,-2.8 53,-2.9 -2,-0.4 2,-0.7 -0.964 28.6-124.9-110.7 142.8 34.9 47.3 37.0 43 46 A V E +B 94 0A 2 26,-2.1 25,-3.2 -2,-0.4 51,-0.2 -0.778 30.5 173.8 -83.5 116.4 32.1 45.2 35.5 44 47 A A E S- 0 0 39 49,-2.6 2,-0.3 -2,-0.7 50,-0.2 0.863 70.8 -11.6 -85.0 -44.0 31.5 46.4 31.9 45 48 A S E S+B 93 0A 53 48,-1.7 48,-3.2 22,-0.1 -1,-0.4 -0.989 107.6 30.4-156.4 151.5 28.9 43.7 31.1 46 49 A G S S- 0 0 13 -2,-0.3 2,-0.3 46,-0.3 46,-0.2 -0.760 81.7 -71.6 102.0-149.0 27.7 40.4 32.7 47 50 A K - 0 0 80 -2,-0.3 42,-2.9 43,-0.2 43,-1.0 -0.973 31.8-159.7-157.8 132.6 27.5 39.4 36.3 48 51 A V E -EF 65 88B 0 17,-2.6 17,-3.0 -2,-0.3 2,-0.5 -0.937 6.9-152.0-118.3 137.5 30.0 38.5 39.0 49 52 A R E -EF 64 87B 61 38,-2.9 38,-2.1 -2,-0.4 2,-0.5 -0.942 9.6-159.8-105.5 127.7 29.4 36.6 42.3 50 53 A L E +EF 63 86B 25 13,-2.3 12,-2.6 -2,-0.5 13,-1.2 -0.911 18.7 170.1-102.4 134.1 31.7 37.4 45.2 51 54 A F E -EF 61 85B 28 34,-2.4 34,-4.0 -2,-0.5 2,-0.3 -0.997 20.1-149.1-148.6 149.4 32.0 34.8 47.9 52 55 A R E -E 60 0B 19 8,-2.7 8,-2.1 -2,-0.3 2,-0.7 -0.863 21.0-120.1-121.5 148.3 34.1 34.2 51.0 53 56 A T E -E 59 0B 63 -2,-0.3 2,-0.6 6,-0.2 6,-0.2 -0.806 25.8-168.4 -95.3 117.6 35.2 30.9 52.6 54 57 A H - 0 0 44 4,-2.8 4,-0.2 -2,-0.7 5,-0.1 -0.651 48.0 -64.1-116.0 75.2 34.1 30.6 56.2 55 58 A L S S+ 0 0 49 -2,-0.6 -1,-0.2 1,-0.1 333,-0.1 0.934 118.4 37.9 63.7 106.1 35.6 27.8 58.2 56 59 A G S S- 0 0 20 1,-0.1 327,-0.3 330,-0.1 -1,-0.1 0.080 127.9 -71.5 110.2 -21.0 35.1 24.1 57.2 57 60 A G S S+ 0 0 65 1,-0.3 2,-0.2 325,-0.1 -1,-0.1 0.454 92.5 136.5 113.7 8.4 35.2 24.8 53.5 58 61 A Q - 0 0 97 -4,-0.2 -4,-2.8 -3,-0.1 2,-0.5 -0.533 44.8-133.4 -94.1 155.6 31.8 26.6 53.1 59 62 A E E -E 53 0B 92 -6,-0.2 2,-0.5 -2,-0.2 -6,-0.2 -0.900 8.4-161.7-121.0 111.6 31.0 29.8 51.1 60 63 A R E -E 52 0B 130 -8,-2.1 -8,-2.7 -2,-0.5 2,-0.5 -0.738 26.8-129.2 -81.5 128.1 29.1 32.9 52.2 61 64 A T E -E 51 0B 69 -2,-0.5 -10,-0.3 -10,-0.2 3,-0.1 -0.701 23.6-174.6 -81.4 124.2 27.9 34.9 49.2 62 65 A L E - 0 0 71 -12,-2.6 2,-0.3 -2,-0.5 -11,-0.2 0.861 57.2 -32.4 -88.6 -40.7 28.9 38.6 49.6 63 66 A A E -E 50 0B 34 -13,-1.2 -13,-2.3 2,-0.0 2,-0.4 -0.981 41.5-124.4-168.1 164.6 27.3 40.2 46.6 64 67 A L E -E 49 0B 93 -2,-0.3 2,-0.4 -15,-0.2 -15,-0.2 -1.000 35.1-159.4-118.9 125.4 26.2 39.9 43.0 65 68 A L E +E 48 0B 15 -17,-3.0 -17,-2.6 -2,-0.4 3,-0.1 -0.897 11.8 179.9-115.1 134.3 27.7 42.6 40.9 66 69 A G > - 0 0 13 -2,-0.4 3,-2.0 1,-0.2 -23,-0.3 -0.547 48.9 -32.9-116.9-173.4 26.5 43.9 37.5 67 70 A P T 3 S+ 0 0 87 0, 0.0 -1,-0.2 0, 0.0 -23,-0.2 -0.043 125.2 21.3 -45.2 132.2 27.6 46.6 35.1 68 71 A G T 3 S+ 0 0 28 -25,-3.2 2,-0.2 1,-0.3 -24,-0.1 0.169 94.1 121.8 95.8 -16.4 29.2 49.7 36.7 69 72 A E < - 0 0 89 -3,-2.0 -26,-2.1 -26,-0.2 2,-0.3 -0.547 50.0-140.4 -91.0 150.8 30.1 48.0 40.0 70 73 A L E +C 42 0A 32 -2,-0.2 2,-0.3 -28,-0.2 -28,-0.2 -0.778 25.3 155.9-110.6 146.5 33.6 47.8 41.4 71 74 A F E +C 41 0A 3 -30,-1.8 -30,-3.0 -2,-0.3 15,-0.0 -0.975 48.4 55.3-157.5 169.9 35.6 45.0 43.3 72 75 A G > + 0 0 12 -2,-0.3 4,-0.9 -32,-0.2 -33,-0.1 0.666 61.6 132.7 77.1 18.7 39.1 43.8 44.0 73 76 A E H > + 0 0 19 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.810 57.9 67.3 -72.8 -28.2 40.1 47.1 45.5 74 77 A M H > S+ 0 0 9 2,-0.2 4,-3.0 1,-0.2 5,-0.4 0.958 103.6 39.4 -56.9 -61.9 41.8 45.6 48.7 75 78 A S H > S+ 0 0 2 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.826 114.5 57.4 -58.8 -33.7 44.7 43.8 47.1 76 79 A L H < S+ 0 0 0 -4,-0.9 -1,-0.2 -37,-0.2 -2,-0.2 0.961 114.3 37.5 -59.0 -48.7 45.1 46.7 44.8 77 80 A L H < S+ 0 0 4 -4,-2.6 -2,-0.2 1,-0.2 -3,-0.2 0.945 134.6 16.3 -71.9 -51.3 45.5 49.0 47.7 78 81 A D H < S- 0 0 29 -4,-3.0 -3,-0.2 -5,-0.2 -1,-0.2 0.389 90.0-125.3-110.4 0.1 47.5 47.0 50.3 79 82 A E < + 0 0 128 -4,-1.6 -4,-0.2 -5,-0.4 -3,-0.1 0.592 68.3 129.1 64.7 13.2 49.0 44.1 48.1 80 83 A G - 0 0 22 -6,-0.4 -43,-0.7 1,-0.2 -1,-0.2 -0.136 65.7 -60.9 -85.4-172.9 47.5 41.6 50.5 81 84 A E B -G 36 0C 87 -45,-0.2 2,-0.3 1,-0.1 -45,-0.2 -0.239 55.9 -96.8 -66.7 155.9 45.3 38.5 49.7 82 85 A R - 0 0 8 -47,-1.7 -48,-2.3 -50,-0.4 -1,-0.1 -0.593 30.9-151.2 -62.4 129.4 42.0 38.7 47.9 83 86 A S S S+ 0 0 19 -2,-0.3 2,-0.3 -50,-0.2 -1,-0.1 0.387 75.3 25.0 -91.1 3.8 39.5 38.5 50.8 84 87 A A S S- 0 0 9 -52,-0.1 2,-0.3 -32,-0.1 -32,-0.2 -0.982 79.9-111.6-153.5 163.7 36.9 36.9 48.6 85 88 A S E - F 0 51B 6 -34,-4.0 -34,-2.4 -2,-0.3 2,-0.4 -0.722 26.1-155.8 -95.8 153.7 36.6 34.8 45.5 86 89 A A E +DF 31 50B 1 -55,-2.7 -56,-2.8 -2,-0.3 -55,-1.8 -0.998 15.3 172.5-132.0 131.1 35.1 36.2 42.3 87 90 A V E -DF 29 49B 25 -38,-2.1 -38,-2.9 -2,-0.4 2,-0.4 -0.993 33.7-116.1-139.3 142.1 33.5 34.2 39.6 88 91 A A E - F 0 48B 1 -60,-2.4 -61,-2.2 -2,-0.4 -40,-0.2 -0.641 22.0-176.1 -74.9 130.8 31.5 35.1 36.5 89 92 A V S S+ 0 0 42 -42,-2.9 2,-0.3 -2,-0.4 -41,-0.2 0.498 76.5 24.7-104.6 -7.4 27.9 33.9 36.6 90 93 A E S S- 0 0 87 -43,-1.0 2,-0.4 -66,-0.1 -63,-0.2 -0.850 112.5 -68.8-132.6 175.1 27.3 35.1 33.0 91 94 A D S S- 0 0 110 -2,-0.3 2,-0.4 -66,-0.2 -2,-0.1 -0.605 72.2-162.3 -62.5 121.4 29.5 35.8 30.0 92 95 A T E -A 24 0A 6 -68,-3.5 -68,-2.9 -2,-0.4 2,-0.5 -0.902 29.0-158.5-127.9 139.9 31.3 38.8 31.5 93 96 A E E -AB 23 45A 50 -48,-3.2 -49,-2.6 -2,-0.4 -48,-1.7 -0.969 20.5-171.4-112.0 128.5 33.4 41.7 30.4 94 97 A L E -AB 22 43A 0 -72,-2.9 -72,-2.5 -2,-0.5 2,-0.6 -0.944 21.0-145.2-121.0 141.4 35.7 43.4 33.0 95 98 A L E -AB 21 42A 23 -53,-2.9 -53,-2.8 -2,-0.4 2,-0.4 -0.920 27.4-159.5 -97.9 121.9 37.8 46.6 33.0 96 99 A A E -AB 20 41A 0 -76,-2.9 -76,-2.0 -2,-0.6 2,-0.6 -0.880 12.6-160.5-112.3 134.4 40.9 45.9 35.1 97 100 A L E - B 0 40A 0 -57,-2.8 -57,-1.8 -2,-0.4 -78,-0.1 -0.908 14.5-149.6-112.5 105.2 43.1 48.5 36.7 98 101 A F E >> - B 0 39A 54 -2,-0.6 4,-2.4 -80,-0.4 3,-0.6 -0.357 26.1-110.4 -73.4 153.9 46.6 47.2 37.6 99 102 A R H 3> S+ 0 0 60 -61,-2.4 4,-2.4 1,-0.3 5,-0.2 0.883 115.4 49.4 -55.8 -47.6 48.4 48.7 40.5 100 103 A E H 3> S+ 0 0 151 1,-0.2 4,-1.2 2,-0.2 -1,-0.3 0.836 115.1 46.4 -62.6 -30.8 51.2 50.6 38.6 101 104 A D H <> S+ 0 0 36 -3,-0.6 4,-2.0 2,-0.2 -1,-0.2 0.801 108.8 55.2 -79.8 -31.0 48.5 52.1 36.3 102 105 A Y H X S+ 0 0 1 -4,-2.4 4,-2.3 2,-0.2 5,-0.3 0.931 107.5 50.1 -61.9 -45.8 46.3 52.9 39.3 103 106 A L H X S+ 0 0 40 -4,-2.4 4,-0.8 1,-0.2 -2,-0.2 0.854 112.1 46.9 -62.8 -37.7 49.2 54.9 40.8 104 107 A A H X S+ 0 0 38 -4,-1.2 4,-0.8 -5,-0.2 -1,-0.2 0.873 111.4 53.5 -70.6 -36.2 49.8 56.8 37.6 105 108 A L H >X S+ 0 0 0 -4,-2.0 4,-3.3 1,-0.2 3,-1.1 0.935 106.8 46.6 -68.4 -49.2 46.1 57.5 37.3 106 109 A I H 3< S+ 0 0 0 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.755 106.0 61.9 -67.8 -20.7 45.4 59.1 40.7 107 110 A R H 3< S+ 0 0 136 -4,-0.8 -1,-0.3 -5,-0.3 -2,-0.2 0.798 115.8 33.2 -68.1 -27.2 48.5 61.2 40.1 108 111 A R H << S+ 0 0 140 -3,-1.1 -2,-0.2 -4,-0.8 -1,-0.2 0.735 135.1 26.2 -99.3 -33.1 46.6 62.6 37.1 109 112 A L >X + 0 0 9 -4,-3.3 3,-2.4 -5,-0.1 4,-0.6 -0.659 64.8 178.6-134.4 79.2 43.1 62.4 38.6 110 113 A P H >> S+ 0 0 24 0, 0.0 4,-2.1 0, 0.0 3,-0.9 0.779 76.4 71.4 -53.2 -31.9 43.3 62.6 42.4 111 114 A L H 3> S+ 0 0 55 1,-0.3 4,-2.6 2,-0.2 5,-0.1 0.752 89.9 62.1 -57.1 -27.2 39.5 62.5 42.8 112 115 A V H <> S+ 0 0 1 -3,-2.4 4,-1.4 2,-0.2 -1,-0.3 0.887 104.8 45.1 -66.4 -40.6 39.7 58.8 41.7 113 116 A A H S+ 0 0 24 -4,-1.4 5,-1.6 -3,-0.3 3,-0.3 0.908 110.0 50.7 -65.3 -39.7 22.2 24.7 84.6 151 154 A L H ><5S+ 0 0 41 -4,-2.1 3,-0.7 1,-0.2 -2,-0.2 0.870 113.3 44.9 -64.4 -38.4 20.0 22.2 82.8 152 155 A R H 3<5S+ 0 0 111 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.600 102.3 64.5 -84.5 -13.3 22.8 19.7 82.6 153 156 A Q T 3<5S- 0 0 112 -4,-1.2 -1,-0.2 -3,-0.3 -2,-0.2 0.379 127.3 -96.6 -87.6 2.9 23.8 20.2 86.2 154 157 A G T < 5S+ 0 0 64 -3,-0.7 -3,-0.2 1,-0.3 -2,-0.1 0.137 87.5 118.0 109.9 -18.4 20.4 18.8 87.1 155 158 A L < - 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