==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER STRUCTURAL GENOMICS 11-JUN-01 1JCU . COMPND 2 MOLECULE: CONSERVED PROTEIN MTH1692; . SOURCE 2 ORGANISM_SCIENTIFIC: METHANOTHERMOBACTER . AUTHOR G.KOZLOV,I.EKIEL,K.GEHRING . 208 1 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14827.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 118 56.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 11 5.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 25 12.0 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 . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 1.0 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 . 18 8.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 13 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 40 19.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 1.0 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 1 0 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 3 1 0 2 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 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 0 0 1 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 1 A M 0 0 195 0, 0.0 3,-0.1 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 149.7 -8.7 -4.6 -37.8 2 2 A L + 0 0 179 1,-0.1 2,-0.1 2,-0.0 0, 0.0 0.818 360.0 54.2-105.3 -66.0 -11.8 -6.5 -36.8 3 3 A I S S- 0 0 132 1,-0.1 2,-1.2 0, 0.0 -1,-0.1 -0.431 93.7-104.2 -74.3 146.9 -11.5 -7.4 -33.1 4 4 A R + 0 0 239 -2,-0.1 -1,-0.1 -3,-0.1 2,-0.1 -0.590 52.8 176.4 -74.8 97.7 -10.8 -4.6 -30.5 5 5 A K - 0 0 154 -2,-1.2 2,-0.3 1,-0.1 -1,-0.0 -0.315 27.6-103.1 -94.2-179.9 -7.2 -5.1 -29.7 6 6 A I - 0 0 149 1,-0.1 -1,-0.1 -2,-0.1 0, 0.0 -0.749 32.1-110.6-106.4 153.8 -4.8 -3.1 -27.4 7 7 A T - 0 0 108 -2,-0.3 -1,-0.1 1,-0.1 3,-0.1 0.005 18.7-129.3 -69.7-178.0 -2.1 -0.6 -28.5 8 8 A R S S+ 0 0 252 1,-0.2 2,-0.4 0, 0.0 -1,-0.1 0.869 86.6 47.7 -99.1 -65.2 1.6 -1.2 -28.1 9 9 A K S S- 0 0 192 1,-0.0 -1,-0.2 3,-0.0 -2,-0.1 -0.683 76.3-144.0 -84.7 129.4 3.1 1.9 -26.4 10 10 A N - 0 0 122 -2,-0.4 -1,-0.0 -3,-0.1 0, 0.0 -0.790 26.2-104.1 -96.3 132.7 1.3 3.0 -23.2 11 11 A P - 0 0 102 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.275 31.5-157.3 -55.3 129.6 1.0 6.8 -22.4 12 12 A S - 0 0 90 4,-0.0 5,-0.1 3,-0.0 -3,-0.0 -0.878 9.1-154.3-116.1 99.6 3.4 7.8 -19.7 13 13 A P > - 0 0 69 0, 0.0 4,-1.7 0, 0.0 5,-0.2 0.106 34.5 -95.5 -59.7 179.8 2.4 11.0 -17.9 14 14 A D H > S+ 0 0 123 1,-0.2 4,-1.0 2,-0.2 5,-0.1 0.865 126.3 50.4 -68.2 -37.5 4.8 13.3 -16.1 15 15 A V H > S+ 0 0 28 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.787 106.8 56.7 -71.3 -28.1 4.1 11.7 -12.7 16 16 A L H > S+ 0 0 30 1,-0.2 4,-1.6 2,-0.2 -2,-0.2 0.937 110.4 41.2 -68.9 -48.0 4.7 8.3 -14.2 17 17 A E H X S+ 0 0 102 -4,-1.7 4,-0.7 1,-0.2 -1,-0.2 0.702 112.1 58.6 -72.5 -20.9 8.2 9.1 -15.4 18 18 A E H X S+ 0 0 43 -4,-1.0 4,-1.3 2,-0.2 -1,-0.2 0.842 105.9 47.3 -75.8 -35.1 8.9 10.9 -12.2 19 19 A A H X S+ 0 0 21 -4,-1.5 4,-1.2 1,-0.2 -2,-0.2 0.868 113.4 46.2 -74.2 -40.2 8.2 7.8 -10.1 20 20 A I H X S+ 0 0 91 -4,-1.6 4,-1.0 2,-0.2 -1,-0.2 0.691 105.9 64.2 -75.7 -18.7 10.3 5.5 -12.1 21 21 A S H >X S+ 0 0 73 -4,-0.7 4,-0.9 2,-0.2 3,-0.6 0.962 105.2 40.5 -68.2 -53.9 13.1 8.1 -12.2 22 22 A V H ><>S+ 0 0 18 -4,-1.3 5,-1.2 1,-0.2 3,-0.5 0.844 110.4 60.6 -63.8 -33.5 13.7 8.0 -8.4 23 23 A M H ><5S+ 0 0 39 -4,-1.2 3,-0.9 1,-0.2 -1,-0.2 0.815 99.9 56.2 -63.4 -30.3 13.3 4.3 -8.5 24 24 A E H <<5S+ 0 0 174 -4,-1.0 -1,-0.2 -3,-0.6 -2,-0.2 0.797 103.6 53.6 -71.8 -29.2 16.3 4.1 -10.9 25 25 A G T <<5S- 0 0 70 -4,-0.9 -1,-0.2 -3,-0.5 -2,-0.2 0.434 117.8-113.4 -85.1 1.0 18.5 6.0 -8.4 26 26 A G T < 5 + 0 0 29 -3,-0.9 2,-0.2 -4,-0.3 -3,-0.2 0.961 67.4 140.4 67.2 53.4 17.6 3.4 -5.7 27 27 A G < - 0 0 6 -5,-1.2 2,-0.4 24,-0.0 15,-0.3 -0.719 54.0 -99.9-122.0 172.7 15.6 5.7 -3.4 28 28 A I E -a 163 0A 8 134,-1.8 136,-1.8 -2,-0.2 2,-0.4 -0.783 30.2-158.5 -96.4 136.3 12.5 5.6 -1.3 29 29 A V E -aB 164 40A 8 11,-0.9 11,-3.6 -2,-0.4 2,-0.2 -0.949 4.2-156.4-116.8 131.6 9.2 7.0 -2.5 30 30 A I E + B 0 39A 7 134,-1.9 9,-0.3 -2,-0.4 7,-0.0 -0.628 11.5 178.4-102.3 162.5 6.3 8.1 -0.3 31 31 A Y - 0 0 21 7,-2.2 2,-0.2 -2,-0.2 8,-0.1 -0.627 13.9-152.9-168.0 104.4 2.6 8.3 -1.2 32 32 A P + 0 0 5 0, 0.0 5,-0.2 0, 0.0 2,-0.1 -0.519 20.3 178.7 -80.2 145.5 -0.3 9.3 1.1 33 33 A T - 0 0 5 3,-1.7 138,-1.2 -2,-0.2 139,-0.9 -0.265 55.6 -43.4-123.0-150.7 -3.8 8.0 0.4 34 34 A D S S+ 0 0 15 137,-0.3 139,-0.7 136,-0.2 141,-0.2 0.725 134.4 33.6 -55.4 -22.4 -7.3 8.2 1.9 35 35 A T S S- 0 0 9 1,-0.3 136,-0.2 137,-0.2 137,-0.2 0.557 116.5 -46.8 -99.7-112.8 -5.6 7.6 5.2 36 36 A I S S- 0 0 28 1,-0.2 -3,-1.7 -5,-0.1 -1,-0.3 -0.275 81.9 -41.7-112.6-161.7 -2.2 8.9 6.2 37 37 A Y - 0 0 32 104,-0.3 104,-1.5 -5,-0.2 2,-0.2 -0.456 60.9-168.3 -68.7 134.2 1.3 9.0 4.6 38 38 A G E - C 0 140A 9 102,-0.2 -7,-2.2 -2,-0.2 2,-0.4 -0.614 13.1-128.7-116.5 178.1 2.2 5.8 2.8 39 39 A L E +BC 30 139A 14 100,-0.6 100,-0.6 -9,-0.3 2,-0.4 -0.994 20.5 176.0-133.4 139.2 5.4 4.3 1.4 40 40 A G E +BC 29 138A 9 -11,-3.6 -11,-0.9 -2,-0.4 2,-0.3 -0.970 16.4 137.2-145.8 124.5 6.1 2.7 -2.0 41 41 A V E - C 0 137A 8 96,-0.6 96,-2.9 -2,-0.4 2,-0.6 -0.980 64.1 -60.6-157.6 165.1 9.4 1.5 -3.4 42 42 A N E > - C 0 136A 37 -15,-0.3 3,-1.4 -2,-0.3 6,-0.5 -0.311 47.2-169.8 -55.5 100.6 10.9 -1.4 -5.4 43 43 A A T 3 S+ 0 0 6 92,-0.6 -1,-0.2 -2,-0.6 93,-0.1 0.882 83.4 55.7 -62.3 -42.1 10.1 -4.3 -3.1 44 44 A L T 3 S+ 0 0 101 91,-0.4 2,-0.3 4,-0.1 -1,-0.3 0.259 95.9 94.1 -77.5 15.6 12.3 -6.8 -4.9 45 45 A D S X> S- 0 0 59 -3,-1.4 3,-1.3 1,-0.1 4,-0.8 -0.843 79.2-132.9-110.4 146.2 15.1 -4.4 -4.4 46 46 A E H 3> S+ 0 0 165 -2,-0.3 4,-1.7 1,-0.3 3,-0.2 0.759 104.2 71.7 -65.1 -24.4 17.7 -4.5 -1.6 47 47 A D H 3> S+ 0 0 55 1,-0.2 4,-2.1 2,-0.2 -1,-0.3 0.801 93.7 55.4 -61.3 -29.2 17.1 -0.8 -1.1 48 48 A A H <> S+ 0 0 6 -3,-1.3 4,-1.0 -6,-0.5 -1,-0.2 0.886 104.6 51.1 -71.5 -40.3 13.7 -1.6 0.3 49 49 A V H X S+ 0 0 45 -4,-0.8 4,-1.4 2,-0.2 -2,-0.2 0.857 112.8 47.3 -65.4 -35.5 15.1 -3.9 3.0 50 50 A R H X S+ 0 0 198 -4,-1.7 4,-1.1 1,-0.2 -2,-0.2 0.942 113.4 44.8 -71.3 -50.3 17.5 -1.1 4.0 51 51 A R H X S+ 0 0 80 -4,-2.1 4,-1.2 1,-0.2 -1,-0.2 0.631 108.1 63.5 -69.7 -13.7 15.0 1.7 4.2 52 52 A L H X S+ 0 0 44 -4,-1.0 4,-2.4 2,-0.2 5,-0.3 0.939 101.2 46.1 -75.2 -49.5 12.6 -0.7 6.0 53 53 A F H < S+ 0 0 110 -4,-1.4 -2,-0.2 1,-0.2 -1,-0.2 0.775 107.6 62.1 -63.9 -25.6 14.8 -1.2 9.1 54 54 A R H < S+ 0 0 178 -4,-1.1 -1,-0.2 1,-0.1 -2,-0.2 0.924 110.4 36.4 -66.2 -45.9 15.3 2.6 9.1 55 55 A V H < S+ 0 0 33 -4,-1.2 89,-0.3 -3,-0.3 -2,-0.2 0.949 135.0 21.9 -72.4 -52.2 11.6 3.3 9.6 56 56 A K < + 0 0 83 -4,-2.4 -3,-0.2 -5,-0.1 88,-0.1 0.973 67.9 172.5 -79.8 -74.1 10.8 0.4 11.9 57 57 A G + 0 0 41 -5,-0.3 -4,-0.1 2,-0.1 -3,-0.1 0.888 47.9 103.4 63.7 40.6 14.1 -0.7 13.5 58 58 A R S S- 0 0 191 1,-0.2 -5,-0.0 4,-0.0 -1,-0.0 0.695 84.3 -14.9-112.4 -80.7 12.4 -3.2 15.8 59 59 A S > - 0 0 56 1,-0.0 3,-1.3 3,-0.0 -1,-0.2 -0.993 42.3-148.7-137.1 129.2 12.6 -6.9 14.9 60 60 A P T 3 S+ 0 0 88 0, 0.0 52,-0.0 0, 0.0 -7,-0.0 0.138 92.1 75.2 -80.3 22.1 13.7 -8.4 11.5 61 61 A H T 3 S+ 0 0 132 51,-0.2 52,-0.9 52,-0.1 53,-0.1 0.482 73.5 94.2-108.9 -8.9 11.3 -11.3 12.2 62 62 A K S < S- 0 0 119 -3,-1.3 50,-0.1 50,-0.2 -4,-0.0 -0.655 78.4-113.9 -88.1 141.3 8.1 -9.5 11.5 63 63 A P - 0 0 46 0, 0.0 2,-0.3 0, 0.0 48,-0.2 -0.153 27.9-126.7 -67.1 165.6 6.5 -9.7 8.0 64 64 A V - 0 0 25 46,-1.4 54,-2.5 52,-0.3 2,-0.4 -0.819 12.2-122.7-116.4 156.8 6.2 -6.6 5.6 65 65 A S E -d 118 0A 32 -2,-0.3 73,-2.3 52,-0.2 54,-0.3 -0.812 26.7-167.1-101.0 137.4 3.3 -5.1 3.8 66 66 A I E -dE 119 137A 18 52,-2.1 54,-0.7 -2,-0.4 2,-0.4 -0.645 14.8-123.4-115.7 173.4 3.2 -4.6 0.0 67 67 A C E +dE 120 136A 7 69,-2.7 69,-1.5 52,-0.2 2,-0.3 -0.948 33.1 155.9-122.2 141.7 1.1 -2.7 -2.5 68 68 A V - 0 0 2 52,-1.6 64,-0.2 -2,-0.4 63,-0.1 -0.897 46.4-115.9-150.0 177.0 -0.9 -4.0 -5.5 69 69 A S S S- 0 0 14 62,-0.3 2,-0.3 1,-0.3 -1,-0.1 0.895 84.7 -35.2 -86.1 -46.8 -3.8 -3.2 -7.7 70 70 A C >> - 0 0 39 61,-0.1 3,-1.2 62,-0.1 4,-0.9 -0.963 65.1 -83.4-164.2 175.9 -6.0 -6.2 -6.9 71 71 A V T 34 S+ 0 0 47 -2,-0.3 3,-0.4 1,-0.3 7,-0.2 0.824 124.7 60.2 -59.5 -31.8 -6.0 -9.9 -6.0 72 72 A D T 34 S+ 0 0 134 1,-0.2 -1,-0.3 2,-0.1 60,-0.0 0.761 101.1 54.2 -67.4 -26.0 -5.8 -10.7 -9.7 73 73 A E T <4 S+ 0 0 55 -3,-1.2 -1,-0.2 1,-0.2 -2,-0.2 0.738 109.6 47.7 -80.4 -24.0 -2.5 -8.8 -9.8 74 74 A I S X S+ 0 0 4 -4,-0.9 4,-1.2 -3,-0.4 3,-0.3 -0.381 70.8 135.9-113.5 54.8 -1.0 -10.9 -7.0 75 75 A P T >4 S+ 0 0 48 0, 0.0 3,-0.8 0, 0.0 -1,-0.1 0.981 84.7 19.6 -61.7 -83.1 -1.8 -14.5 -8.1 76 76 A R T 34 S+ 0 0 186 1,-0.2 28,-0.1 -3,-0.1 3,-0.1 0.179 115.9 80.2 -73.5 19.9 1.3 -16.5 -7.5 77 77 A F T 34 S+ 0 0 65 -3,-0.3 26,-1.0 1,-0.1 -1,-0.2 0.857 102.3 6.2 -93.2 -44.1 2.4 -13.7 -5.1 78 78 A S E << S-F 102 0A 3 -4,-1.2 24,-0.2 -3,-0.8 26,-0.1 -0.663 80.8 -96.5-128.1-175.4 0.4 -14.6 -2.0 79 79 A R E +F 101 0A 123 22,-0.8 22,-1.0 -2,-0.2 2,-0.1 -0.877 48.4 170.9-112.8 103.5 -1.8 -17.4 -0.8 80 80 A P - 0 0 60 0, 0.0 2,-0.2 0, 0.0 104,-0.1 -0.345 13.4-156.5-102.3-178.8 -5.6 -16.7 -1.2 81 81 A S > - 0 0 49 1,-0.2 4,-1.0 103,-0.1 5,-0.0 -0.823 26.8 -99.7-146.0-176.2 -8.8 -18.8 -0.9 82 82 A G H >> S+ 0 0 47 -2,-0.2 4,-1.4 2,-0.2 3,-0.6 0.963 114.6 22.2 -75.1 -85.0 -12.4 -19.0 -2.0 83 83 A D H 3> S+ 0 0 110 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.773 121.0 65.7 -55.0 -26.3 -14.7 -17.5 0.6 84 84 A A H 3> S+ 0 0 0 1,-0.2 4,-1.2 2,-0.2 3,-0.2 0.951 103.7 41.3 -61.2 -51.5 -11.7 -15.6 1.8 85 85 A M H X S+ 0 0 44 -4,-1.8 4,-0.8 -3,-0.2 3,-0.5 0.910 115.8 39.6 -60.1 -44.2 -15.1 -11.3 2.0 88 88 A M H 3< S+ 0 0 9 -4,-1.2 3,-0.2 1,-0.2 -1,-0.2 0.855 107.6 62.1 -74.6 -36.0 -12.6 -8.8 0.6 89 89 A E H 3< S+ 0 0 120 -4,-2.1 3,-0.4 1,-0.2 -1,-0.2 0.636 97.9 64.3 -64.2 -12.5 -14.2 -8.6 -2.8 90 90 A R H << S+ 0 0 193 -4,-0.6 -1,-0.2 -3,-0.5 2,-0.2 0.951 114.5 21.4 -75.6 -55.1 -17.3 -7.3 -1.0 91 91 A I S < S+ 0 0 92 -4,-0.8 -1,-0.2 -3,-0.2 -2,-0.1 -0.425 98.0 169.2-115.5 57.5 -15.9 -4.0 0.4 92 92 A L + 0 0 59 -3,-0.4 2,-0.2 -2,-0.2 -4,-0.0 -0.950 35.3 22.9-132.1 154.5 -12.9 -3.3 -1.9 93 93 A P S S+ 0 0 48 0, 0.0 30,-0.1 0, 0.0 -23,-0.0 0.508 79.6 112.8 -78.9-153.2 -11.0 -1.3 -2.6 94 94 A G S S- 0 0 3 27,-1.4 2,-0.5 -2,-0.2 27,-0.2 -0.895 78.5 -58.5 154.5 178.3 -10.5 1.3 0.2 95 95 A P S S+ 0 0 33 0, 0.0 83,-1.4 0, 0.0 2,-0.4 -0.011 96.3 108.1 -79.6 32.6 -8.2 2.7 2.8 96 96 A Y E -g 178 0A 58 -2,-0.5 25,-1.0 25,-0.4 2,-0.3 -0.873 65.8-130.4-112.7 146.6 -7.9 -0.7 4.4 97 97 A T E -gH 179 120A 13 81,-1.4 83,-2.0 -2,-0.4 2,-0.6 -0.724 13.4-147.4 -95.5 143.0 -4.9 -3.1 4.4 98 98 A V E -gH 180 119A 7 21,-1.9 21,-1.2 -2,-0.3 2,-0.5 -0.916 11.0-168.0-115.7 109.3 -5.2 -6.7 3.4 99 99 A V E + H 0 118A 20 81,-2.4 19,-0.2 -2,-0.6 2,-0.2 -0.832 17.4 162.9 -98.4 126.3 -2.9 -9.2 5.1 100 100 A L E - H 0 117A 4 17,-2.0 17,-1.8 -2,-0.5 83,-0.2 -0.659 39.8 -76.3-126.9-174.9 -2.7 -12.7 3.6 101 101 A E E -FH 79 116A 51 -22,-1.0 -22,-0.8 82,-0.5 2,-0.4 -0.097 49.7-104.9 -74.6-177.8 -0.5 -15.8 3.7 102 102 A R E -F 78 0A 57 13,-1.3 -24,-0.2 -24,-0.2 -1,-0.1 -0.918 24.1-139.6-119.0 138.2 2.8 -16.1 1.8 103 103 A N - 0 0 58 -26,-1.0 2,-1.5 -2,-0.4 -24,-0.1 0.117 54.4 -62.7 -75.0-165.6 3.6 -18.1 -1.3 104 104 A E S S+ 0 0 161 -28,-0.1 2,-0.5 -26,-0.1 -1,-0.1 -0.152 80.5 152.9 -76.7 43.6 6.7 -20.1 -2.1 105 105 A L - 0 0 57 -2,-1.5 6,-0.0 1,-0.2 -28,-0.0 -0.647 31.7-165.4 -80.5 124.7 8.8 -16.9 -1.9 106 106 A I + 0 0 128 -2,-0.5 2,-0.3 2,-0.0 -1,-0.2 0.942 62.1 94.7 -74.5 -50.7 12.4 -17.6 -0.9 107 107 A P >> - 0 0 50 0, 0.0 4,-1.3 0, 0.0 3,-0.9 -0.228 50.7-175.3 -49.3 103.9 13.5 -14.0 -0.0 108 108 A D H 3> S+ 0 0 94 -2,-0.3 4,-1.4 1,-0.2 6,-0.1 0.500 70.6 83.3 -80.9 -4.6 12.9 -13.9 3.7 109 109 A V H 34 S+ 0 0 85 2,-0.2 -1,-0.2 1,-0.2 4,-0.1 0.727 107.4 23.8 -70.5 -21.6 13.8 -10.2 3.7 110 110 A I H <4 S+ 0 0 20 -3,-0.9 -46,-1.4 2,-0.1 -2,-0.2 0.704 124.1 50.5-111.4 -35.6 10.2 -9.4 2.7 111 111 A T H ><>S- 0 0 1 -4,-1.3 5,-0.7 1,-0.2 3,-0.6 0.703 98.9-151.4 -77.0 -20.0 8.4 -12.4 4.0 112 112 A G T 3<5 - 0 0 5 -4,-1.4 -1,-0.2 1,-0.2 -50,-0.2 -0.295 43.7 -46.2 80.1-167.7 10.0 -12.0 7.4 113 113 A G T 3 5S+ 0 0 58 -52,-0.9 2,-0.2 -4,-0.1 -1,-0.2 0.376 124.0 59.7 -82.7 5.7 10.7 -14.8 9.8 114 114 A S T < 5S- 0 0 66 -3,-0.6 2,-0.2 2,-0.2 -52,-0.0 -0.631 92.9-104.9-122.7-178.4 7.2 -16.2 9.3 115 115 A S T 5S+ 0 0 63 -2,-0.2 -13,-1.3 -52,-0.0 2,-0.3 -0.353 85.4 92.1-105.7 51.1 5.1 -17.5 6.4 116 116 A R E < - H 0 101A 89 -5,-0.7 2,-0.3 -15,-0.3 -52,-0.3 -0.994 48.8-168.3-144.5 149.2 2.9 -14.5 6.0 117 117 A V E - H 0 100A 16 -17,-1.8 -17,-2.0 -2,-0.3 2,-0.2 -0.997 15.6-134.3-139.6 142.6 2.9 -11.3 3.9 118 118 A G E -dH 65 99A 4 -54,-2.5 -52,-2.1 -2,-0.3 2,-0.3 -0.579 18.7-171.3 -95.8 158.9 0.9 -8.1 4.0 119 119 A I E -dH 66 98A 4 -21,-1.2 -21,-1.9 -54,-0.3 2,-0.3 -0.941 8.1-154.3-142.6 162.6 -0.8 -6.3 1.2 120 120 A R E -dH 67 97A 26 -54,-0.7 -52,-1.6 -2,-0.3 -23,-0.2 -0.973 7.4-163.7-146.6 128.2 -2.6 -2.9 0.6 121 121 A V + 0 0 13 -25,-1.0 -27,-1.4 -2,-0.3 -25,-0.4 -0.741 27.1 176.5-110.8 81.2 -5.2 -1.8 -1.9 122 122 A P - 0 0 6 0, 0.0 -28,-0.1 0, 0.0 -2,-0.0 -0.106 43.5-110.4 -76.4 178.7 -5.2 2.0 -1.8 123 123 A D S S+ 0 0 76 -30,-0.1 2,-0.8 4,-0.0 3,-0.1 0.275 73.1 130.0 -93.4 9.7 -7.2 4.5 -3.9 124 124 A D > - 0 0 14 1,-0.2 4,-1.2 -93,-0.1 5,-0.1 -0.544 41.2-167.2 -70.5 105.1 -4.0 5.6 -5.7 125 125 A E H > S+ 0 0 125 -2,-0.8 4,-1.1 2,-0.2 3,-0.2 0.930 87.7 43.2 -57.5 -50.0 -4.8 5.4 -9.4 126 126 A I H >> S+ 0 0 43 1,-0.2 4,-1.6 2,-0.2 3,-1.0 0.956 114.0 48.8 -62.2 -53.2 -1.2 5.8 -10.4 127 127 A C H 3> S+ 0 0 23 1,-0.3 4,-1.8 2,-0.2 -1,-0.2 0.697 105.3 63.7 -60.8 -18.3 0.2 3.4 -7.8 128 128 A R H 3X S+ 0 0 91 -4,-1.2 4,-1.0 -3,-0.2 -1,-0.3 0.850 102.8 46.2 -74.7 -35.9 -2.5 1.0 -8.9 129 129 A R H - 0 0 164 1,-0.1 4,-1.1 2,-0.0 3,-0.4 -0.982 63.0-155.4-128.4 126.6 4.5 20.2 3.3 152 152 A L H > S+ 0 0 80 -2,-0.4 4,-1.4 1,-0.2 3,-0.3 0.880 101.1 50.8 -63.2 -40.0 5.3 18.7 -0.1 153 153 A E H > S+ 0 0 145 1,-0.2 4,-0.9 2,-0.2 -1,-0.2 0.691 102.6 63.1 -71.8 -18.9 8.1 21.2 -0.6 154 154 A E H > S+ 0 0 62 -3,-0.4 4,-2.2 2,-0.2 5,-0.2 0.857 102.1 48.5 -73.6 -36.8 9.5 20.3 2.8 155 155 A I H X S+ 0 0 9 -4,-1.1 4,-2.7 -3,-0.3 8,-0.2 0.953 110.5 48.1 -68.8 -52.2 10.2 16.7 1.8 156 156 A V H < S+ 0 0 57 -4,-1.4 -1,-0.2 1,-0.2 -2,-0.2 0.794 112.9 53.3 -59.5 -27.2 12.0 17.5 -1.4 157 157 A R H < S+ 0 0 162 -4,-0.9 3,-0.4 -5,-0.2 -2,-0.2 0.966 116.7 32.8 -72.0 -55.9 14.1 20.0 0.5 158 158 A D H < S+ 0 0 107 -4,-2.2 2,-1.5 1,-0.3 -2,-0.2 0.966 122.5 46.5 -66.5 -55.8 15.3 17.8 3.3 159 159 A L S < S- 0 0 48 -4,-2.7 -1,-0.3 -5,-0.2 6,-0.1 -0.576 70.6-176.6 -91.1 73.9 15.5 14.5 1.3 160 160 A D S S- 0 0 145 -2,-1.5 -1,-0.2 -3,-0.4 -2,-0.1 0.804 88.0 -17.8 -37.1 -42.1 17.4 15.9 -1.8 161 161 A A S S+ 0 0 69 -3,-0.2 3,-0.3 3,-0.1 -1,-0.3 0.179 123.0 88.3-153.9 14.6 17.1 12.5 -3.3 162 162 A V S S+ 0 0 49 1,-0.2 -134,-1.8 -135,-0.1 2,-1.0 0.951 98.9 17.2 -80.7 -78.9 16.3 10.2 -0.3 163 163 A D E S-a 28 0A 37 -8,-0.2 -1,-0.2 -136,-0.2 -134,-0.2 -0.758 84.1-148.6-100.0 87.8 12.5 10.1 0.2 164 164 A L E -a 29 0A 43 -136,-1.8 -134,-1.9 -2,-1.0 -4,-0.1 -0.335 14.2-132.8 -59.1 129.8 11.1 11.4 -3.1 165 165 A V - 0 0 13 -136,-0.2 2,-0.3 -6,-0.1 -1,-0.1 0.117 21.6-106.3 -69.4-169.9 7.9 13.2 -2.6 166 166 A L - 0 0 0 1,-0.1 -1,-0.1 -137,-0.1 4,-0.1 -0.888 6.1-149.4-125.9 154.5 4.7 12.7 -4.7 167 167 A D S S+ 0 0 104 -2,-0.3 -1,-0.1 -152,-0.1 -136,-0.0 0.660 98.9 47.7 -92.5 -21.9 3.0 14.8 -7.4 168 168 A A S S- 0 0 65 1,-0.2 2,-0.2 -153,-0.1 -1,-0.1 0.918 88.5-169.4 -84.3 -51.7 -0.5 13.5 -6.5 169 169 A G - 0 0 5 -17,-0.0 -1,-0.2 -137,-0.0 -2,-0.1 -0.629 38.1 -17.2 97.1-155.6 -0.5 14.0 -2.8 170 170 A D - 0 0 107 -2,-0.2 -136,-0.2 1,-0.1 -137,-0.1 0.222 47.5-156.4 -70.9-161.5 -3.0 12.7 -0.2 171 171 A C - 0 0 57 -138,-1.2 -137,-0.3 -136,-0.2 -1,-0.1 0.430 61.5 -15.1-146.2 -53.3 -6.6 11.5 -1.0 172 172 A L S S- 0 0 119 -139,-0.9 2,-0.3 1,-0.2 -1,-0.2 -0.032 102.8 -10.6-130.9-128.6 -8.9 11.8 2.0 173 173 A D - 0 0 96 -139,-0.7 -1,-0.2 1,-0.1 -140,-0.1 -0.619 50.8-130.5 -85.6 144.6 -8.7 12.2 5.8 174 174 A M S S+ 0 0 117 -2,-0.3 -137,-0.1 1,-0.1 -1,-0.1 0.635 79.9 88.6 -65.3 -13.0 -5.3 12.0 7.6 175 175 A E + 0 0 115 -141,-0.2 2,-0.2 -140,-0.1 -1,-0.1 -0.988 66.4 9.6-159.4 155.3 -7.1 9.6 10.0 176 176 A P - 0 0 74 0, 0.0 2,-0.3 0, 0.0 17,-0.1 0.389 54.3-152.5 -91.9-139.7 -7.9 7.1 10.9 177 177 A S - 0 0 17 15,-0.4 15,-1.3 -2,-0.2 2,-0.4 -0.987 8.1-135.5-153.4 140.7 -6.8 3.8 9.2 178 178 A T E -gI 96 191A 25 -83,-1.4 -81,-1.4 -2,-0.3 2,-0.5 -0.793 13.3-165.3-101.4 141.0 -8.2 0.3 8.7 179 179 A V E +gI 97 190A 50 11,-1.5 11,-1.5 -2,-0.4 2,-0.5 -0.946 8.5 178.7-129.2 112.2 -6.2 -2.9 9.2 180 180 A I E -gI 98 189A 3 -83,-2.0 -81,-2.4 -2,-0.5 2,-0.6 -0.946 16.5-164.1-116.7 129.3 -7.5 -6.2 7.9 181 181 A D + 0 0 40 7,-1.0 2,-1.6 -2,-0.5 7,-0.3 -0.602 15.1 179.0-108.3 65.6 -5.6 -9.5 8.2 182 182 A L + 0 0 0 -2,-0.6 -81,-0.2 5,-0.2 3,-0.1 -0.550 16.3 153.4 -69.9 89.4 -7.5 -11.6 5.7 183 183 A T - 0 0 24 -2,-1.6 -82,-0.5 3,-0.6 -1,-0.2 0.949 61.2 -40.2 -81.2 -80.1 -5.6 -14.9 6.0 184 184 A V S S- 0 0 37 2,-0.5 -103,-0.1 -84,-0.1 -105,-0.0 0.089 106.4 -24.8-120.5-127.2 -7.9 -17.7 5.0 185 185 A N S S+ 0 0 109 1,-0.1 -98,-0.1 -3,-0.1 -104,-0.0 0.941 123.4 65.2 -59.2 -51.1 -11.6 -18.4 5.7 186 186 A P S S- 0 0 81 0, 0.0 -3,-0.6 0, 0.0 -2,-0.5 -0.650 81.1-149.3 -79.7 107.1 -11.7 -16.3 8.9 187 187 A P - 0 0 50 0, 0.0 -5,-0.2 0, 0.0 -2,-0.1 -0.544 7.8-150.2 -77.6 138.3 -11.1 -12.6 7.9 188 188 A R + 0 0 166 -7,-0.3 -7,-1.0 -2,-0.2 2,-0.5 -0.194 27.6 169.6-101.1 41.6 -9.4 -10.4 10.5 189 189 A V E +I 180 0A 71 -9,-0.3 2,-0.4 -8,-0.1 -9,-0.2 -0.375 7.1 166.6 -57.0 105.2 -11.1 -7.2 9.4 190 190 A L E -I 179 0A 115 -11,-1.5 -11,-1.5 -2,-0.5 2,-0.3 -0.815 15.7-168.6-132.1 94.6 -10.1 -4.9 12.2 191 191 A R E -I 178 0A 166 -2,-0.4 2,-1.6 -13,-0.2 -13,-0.2 -0.598 29.6-118.2 -83.7 140.1 -10.7 -1.1 11.7 192 192 A R + 0 0 175 -15,-1.3 -15,-0.4 -2,-0.3 -1,-0.1 -0.593 51.3 165.4 -79.5 87.2 -9.1 1.3 14.1 193 193 A G - 0 0 49 -2,-1.6 2,-0.1 1,-0.2 -16,-0.0 -0.150 33.7 -96.7 -91.4-170.5 -12.2 3.0 15.5 194 194 A K - 0 0 190 1,-0.2 -1,-0.2 -2,-0.1 4,-0.1 -0.194 50.7 -68.2 -96.1-169.7 -12.8 5.1 18.5 195 195 A G S S- 0 0 40 1,-0.1 2,-2.3 2,-0.1 -1,-0.2 0.028 73.9 -62.6 -70.5-175.6 -14.0 4.3 22.0 196 196 A P S S+ 0 0 135 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.434 107.2 93.6 -72.7 75.0 -17.6 3.2 23.0 197 197 A L + 0 0 111 -2,-2.3 -2,-0.1 -3,-0.0 3,-0.1 -0.067 50.0 169.1-157.1 40.4 -19.3 6.3 21.8 198 198 A D - 0 0 120 1,-0.1 2,-0.5 -4,-0.1 -3,-0.0 -0.247 49.9 -90.9 -59.9 146.0 -20.5 5.7 18.2 199 199 A P - 0 0 118 0, 0.0 -1,-0.1 0, 0.0 -2,-0.0 -0.447 48.8-152.3 -63.6 109.5 -22.9 8.3 16.7 200 200 A V - 0 0 103 -2,-0.5 -3,-0.0 -3,-0.1 0, 0.0 -0.098 20.0-118.5 -74.2 178.2 -26.4 7.0 17.5 201 201 A L + 0 0 170 2,-0.1 -1,-0.1 0, 0.0 3,-0.0 -0.076 68.6 127.6-110.1 31.6 -29.5 7.7 15.4 202 202 A L S S- 0 0 149 1,-0.1 2,-0.7 2,-0.0 0, 0.0 0.033 71.4 -80.5 -74.8-171.9 -31.4 9.5 18.2 203 203 A R + 0 0 239 2,-0.0 2,-0.2 0, 0.0 -1,-0.1 -0.848 69.9 130.6-100.3 109.3 -33.0 13.0 17.9 204 204 A G + 0 0 77 -2,-0.7 3,-0.0 1,-0.1 -2,-0.0 -0.689 9.9 150.9-162.5 103.6 -30.5 15.8 18.3 205 205 A A + 0 0 102 -2,-0.2 2,-1.6 1,-0.1 3,-0.1 0.530 56.3 93.8-107.7 -13.1 -30.0 18.8 16.1 206 206 A G + 0 0 72 1,-0.2 -1,-0.1 2,-0.0 0, 0.0 -0.606 39.0 162.4 -85.5 83.4 -28.8 21.2 18.8 207 207 A D 0 0 161 -2,-1.6 -1,-0.2 -3,-0.0 -2,-0.0 0.557 360.0 360.0 -76.0 -7.6 -25.0 20.8 18.4 208 208 A V 0 0 205 -3,-0.1 -3,-0.0 0, 0.0 -2,-0.0 -0.833 360.0 360.0 -96.6 360.0 -24.6 24.0 20.3