==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 15-OCT-04 1XRP . COMPND 2 MOLECULE: PROLINE IMINOPEPTIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: THERMOPLASMA ACIDOPHILUM; . AUTHOR P.GOETTIG,H.BRANDSTETTER,M.GROLL,W.GOEHRING,P.V.KONAREV, . 295 3 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 11865.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 224 75.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 29 9.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 17 5.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 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 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 . 23 7.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 42 14.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 95 32.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 2.4 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 1 0 0 0 0 1 0 1 3 2 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 0 3 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 PARALLEL BRIDGES PER LADDER . 2 0 0 1 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 E 0 0 139 0, 0.0 18,-0.1 0, 0.0 20,-0.0 0.000 360.0 360.0 360.0-175.7 -0.5 -11.9 23.1 2 5 A a - 0 0 13 16,-0.4 2,-0.3 18,-0.0 17,-0.3 0.833 360.0-137.0 87.2 99.3 2.9 -10.6 22.9 3 6 A I E -A 18 0A 73 15,-2.2 15,-2.1 1,-0.0 2,-0.5 -0.597 20.6-159.4 -71.9 134.4 5.5 -12.0 25.2 4 7 A E E +A 17 0A 114 -2,-0.3 2,-0.2 13,-0.2 13,-0.2 -0.985 25.6 142.9-123.0 125.3 7.7 -9.1 26.4 5 8 A N E -A 16 0A 87 11,-1.6 11,-1.4 -2,-0.5 2,-0.5 -0.794 49.2-104.3-146.2-171.8 11.1 -9.9 27.8 6 9 A Y E -A 15 0A 114 -2,-0.2 2,-0.4 9,-0.2 9,-0.2 -0.873 30.9-165.9-128.3 96.2 14.8 -8.7 28.1 7 10 A A E -A 14 0A 0 7,-2.4 7,-3.7 -2,-0.5 2,-1.0 -0.676 19.9-132.6 -85.9 132.5 17.2 -10.6 25.9 8 11 A K E +A 13 0A 120 -2,-0.4 2,-0.5 5,-0.2 5,-0.2 -0.743 34.7 177.3 -86.2 104.9 20.9 -10.1 26.7 9 12 A V E > -A 12 0A 4 3,-2.4 3,-2.3 -2,-1.0 73,-0.1 -0.942 63.2 -15.3-114.9 130.0 22.4 -9.4 23.3 10 13 A N T 3 S- 0 0 71 -2,-0.5 -1,-0.2 1,-0.3 3,-0.1 0.838 129.9 -51.3 49.6 36.5 26.0 -8.6 22.7 11 14 A G T 3 S+ 0 0 53 1,-0.2 2,-0.3 -3,-0.1 -1,-0.3 0.333 121.6 89.4 89.6 -10.1 26.4 -7.9 26.4 12 15 A I E < S-A 9 0A 16 -3,-2.3 -3,-2.4 55,-0.1 2,-0.7 -0.819 82.2-100.1-120.6 162.3 23.5 -5.5 26.8 13 16 A Y E -A 8 0A 104 -2,-0.3 54,-1.9 -5,-0.2 2,-0.5 -0.711 37.0-168.9 -85.5 116.6 19.8 -5.8 27.6 14 17 A I E -A 7 0A 0 -7,-3.7 -7,-2.4 -2,-0.7 2,-0.3 -0.921 13.0-140.3-110.0 123.8 17.6 -5.7 24.5 15 18 A Y E +A 6 0A 16 -2,-0.5 44,-2.3 44,-0.3 2,-0.3 -0.616 27.3 172.9 -82.0 137.3 13.8 -5.4 24.8 16 19 A Y E -AB 5 58A 21 -11,-1.4 -11,-1.6 -2,-0.3 2,-0.4 -0.984 24.7-153.0-145.1 155.3 11.7 -7.4 22.5 17 20 A K E -AB 4 57A 25 40,-2.9 40,-3.6 -2,-0.3 2,-0.6 -0.967 12.1-169.3-131.9 113.9 8.0 -8.2 21.9 18 21 A L E -AB 3 56A 17 -15,-2.1 -15,-2.2 -2,-0.4 2,-0.8 -0.910 2.3-166.8-109.0 115.1 7.1 -11.5 20.2 19 22 A a E - B 0 55A 1 36,-2.7 36,-2.0 -2,-0.6 2,-0.1 -0.863 15.5-149.4-104.3 107.0 3.5 -11.9 19.1 20 23 A K - 0 0 105 -2,-0.8 33,-0.1 34,-0.2 3,-0.1 -0.411 3.2-138.4 -76.7 148.7 2.9 -15.5 18.2 21 24 A A > - 0 0 6 1,-0.2 3,-1.1 5,-0.1 33,-0.1 -0.835 19.8-119.5-105.4 143.4 0.3 -16.6 15.6 22 25 A P T 3 S+ 0 0 125 0, 0.0 2,-1.8 0, 0.0 -1,-0.2 0.926 108.0 19.1 -42.6 -87.2 -2.0 -19.6 16.1 23 26 A E T 3 S- 0 0 151 -3,-0.1 -3,-0.0 30,-0.0 0, 0.0 -0.476 96.6-155.3 -87.8 66.7 -1.1 -21.9 13.2 24 27 A E < + 0 0 63 -2,-1.8 29,-0.2 -3,-1.1 3,-0.1 -0.111 27.5 170.6 -47.0 131.3 2.2 -20.1 12.7 25 28 A K + 0 0 74 27,-3.0 2,-0.3 1,-0.4 28,-0.2 0.503 66.9 3.4-117.6 -17.4 3.5 -20.5 9.1 26 29 A A E -c 53 0A 4 26,-1.0 28,-2.3 264,-0.1 2,-0.5 -0.988 61.4-126.3-165.6 157.9 6.4 -18.0 9.4 27 30 A K E -c 54 0A 29 68,-0.3 70,-2.6 -2,-0.3 2,-0.5 -0.949 20.8-160.8-113.7 128.2 8.3 -15.7 11.7 28 31 A L E -cd 55 97A 1 26,-3.5 28,-3.7 -2,-0.5 2,-0.4 -0.943 2.6-158.9-112.0 122.3 8.7 -12.0 10.7 29 32 A M E -cd 56 98A 3 68,-3.4 70,-3.2 -2,-0.5 2,-0.4 -0.805 13.9-152.8 -96.9 139.6 11.4 -10.0 12.4 30 33 A T E - d 0 99A 2 26,-2.1 2,-0.5 -2,-0.4 70,-0.2 -0.923 11.2-157.2-120.9 146.1 10.9 -6.3 12.3 31 34 A M E - d 0 100A 0 68,-2.4 70,-2.6 -2,-0.4 73,-0.1 -0.942 15.3-149.0-121.1 108.1 13.4 -3.4 12.4 32 35 A H - 0 0 1 -2,-0.5 7,-0.1 26,-0.5 4,-0.1 -0.204 19.2-126.5 -66.8 167.3 12.1 0.0 13.5 33 36 A G >> + 0 0 0 5,-0.3 4,-1.5 70,-0.2 3,-0.6 0.163 62.3 80.5 -97.6-148.2 13.6 3.2 12.1 34 37 A G T 34 S- 0 0 0 1,-0.3 2,-0.2 2,-0.2 -1,-0.1 -0.890 87.0-109.0 126.8-100.8 15.1 6.4 13.3 35 38 A P T 34 S+ 0 0 1 0, 0.0 171,-0.3 0, 0.0 -1,-0.3 0.557 116.5 26.8 -69.2 149.9 17.8 5.6 14.0 36 39 A G T <4 S+ 0 0 0 -3,-0.6 28,-0.4 -2,-0.2 166,-0.3 0.516 94.2 105.9 109.8 5.1 16.8 6.0 17.6 37 40 A M < - 0 0 3 -4,-1.5 27,-0.7 26,-0.1 2,-0.3 0.468 63.2-114.6 -85.4-129.2 13.0 5.5 17.5 38 41 A S > - 0 0 0 25,-0.1 3,-0.7 26,-0.1 -5,-0.3 -0.976 22.5 -99.2-168.2 163.9 11.3 2.3 18.8 39 42 A H G > S+ 0 0 1 -2,-0.3 3,-2.9 1,-0.2 4,-0.3 0.783 98.5 91.2 -61.2 -29.5 9.3 -0.7 17.7 40 43 A D G > S+ 0 0 10 1,-0.3 3,-2.2 2,-0.2 -1,-0.2 0.785 78.1 54.6 -35.8 -54.5 6.1 1.0 18.9 41 44 A Y G < S+ 0 0 2 -3,-0.7 -1,-0.3 1,-0.3 3,-0.2 0.521 104.8 58.1 -67.0 -1.1 5.1 2.7 15.6 42 45 A L G X S+ 0 0 0 -3,-2.9 3,-2.1 1,-0.1 -1,-0.3 0.376 71.9 103.6-105.4 1.5 5.3 -0.7 13.9 43 46 A L G X + 0 0 27 -3,-2.2 3,-1.6 1,-0.3 -1,-0.1 0.656 63.0 76.4 -59.1 -16.9 2.7 -2.3 16.2 44 47 A S G > S+ 0 0 0 1,-0.3 3,-1.3 -3,-0.2 -1,-0.3 0.738 82.3 68.6 -67.0 -21.0 0.1 -2.1 13.4 45 48 A L G X S+ 0 0 0 -3,-2.1 3,-2.4 1,-0.3 -1,-0.3 0.650 72.5 90.9 -71.1 -13.8 1.8 -5.0 11.7 46 49 A R G X + 0 0 99 -3,-1.6 3,-1.4 1,-0.3 -1,-0.3 0.685 68.9 77.0 -55.6 -17.4 0.5 -7.1 14.6 47 50 A D G X S+ 0 0 48 -3,-1.3 3,-2.1 1,-0.3 -1,-0.3 0.796 76.9 72.7 -64.4 -29.4 -2.5 -7.8 12.5 48 51 A M G X >S+ 0 0 1 -3,-2.4 3,-1.7 1,-0.3 5,-1.5 0.614 77.1 76.9 -63.3 -12.5 -0.6 -10.3 10.4 49 52 A T G X 5S+ 0 0 21 -3,-1.4 3,-1.0 1,-0.3 -1,-0.3 0.723 87.3 60.6 -70.7 -17.6 -0.7 -12.8 13.3 50 53 A K G < 5S+ 0 0 171 -3,-2.1 -1,-0.3 1,-0.2 -2,-0.2 0.430 100.4 57.2 -84.3 -0.9 -4.3 -13.4 12.2 51 54 A E G < 5S- 0 0 88 -3,-1.7 -1,-0.2 2,-0.2 -2,-0.2 0.161 129.6 -96.3-111.0 9.2 -2.7 -14.5 8.9 52 55 A G T < 5S+ 0 0 8 -3,-1.0 -27,-3.0 1,-0.2 -26,-1.0 0.765 86.0 130.4 79.9 27.0 -0.5 -17.1 10.6 53 56 A I E < - c 0 26A 0 -5,-1.5 2,-0.3 -29,-0.2 -1,-0.2 -0.930 48.4-150.2-120.3 110.4 2.5 -14.8 10.8 54 57 A T E - c 0 27A 1 -28,-2.3 -26,-3.5 -2,-0.6 2,-0.5 -0.600 18.0-152.2 -76.1 132.1 4.3 -14.5 14.1 55 58 A V E -Bc 19 28A 0 -36,-2.0 -36,-2.7 -2,-0.3 2,-0.6 -0.925 6.0-154.2-114.3 130.8 5.9 -11.0 14.4 56 59 A L E -Bc 18 29A 2 -28,-3.7 -26,-2.1 -2,-0.5 2,-0.3 -0.899 15.1-178.5-104.9 118.9 9.0 -10.2 16.4 57 60 A F E +B 17 0A 0 -40,-3.6 -40,-2.9 -2,-0.6 2,-0.3 -0.789 8.7 162.2-109.9 157.4 9.3 -6.6 17.6 58 61 A Y E -B 16 0A 1 -42,-0.3 2,-0.5 -2,-0.3 -26,-0.5 -0.904 39.1-113.9-173.7 145.6 12.3 -5.2 19.5 59 62 A D - 0 0 0 -44,-2.3 -44,-0.3 -2,-0.3 3,-0.1 -0.740 37.5-132.8 -86.8 124.8 14.0 -2.0 20.5 60 63 A Q > - 0 0 3 -2,-0.5 3,-2.7 1,-0.2 6,-0.3 -0.220 49.0 -54.6 -70.9 167.7 17.4 -1.6 19.0 61 64 A F T 3 S+ 0 0 2 1,-0.3 7,-0.2 12,-0.1 -1,-0.2 -0.061 127.4 3.3 -44.6 137.8 20.5 -0.6 21.0 62 65 A G T 3 S+ 0 0 0 5,-2.4 139,-0.5 1,-0.2 138,-0.4 0.492 109.1 117.2 62.2 4.7 19.9 2.6 22.9 63 66 A C S X S- 0 0 1 -3,-2.7 3,-2.4 4,-0.3 -1,-0.2 -0.802 78.0 -37.6-109.5 148.0 16.3 2.8 21.6 64 67 A G T 3 S- 0 0 7 -27,-0.7 -26,-0.1 -28,-0.4 -2,-0.0 -0.203 127.7 -8.7 50.0-116.4 13.1 2.7 23.5 65 68 A R T 3 S+ 0 0 64 -50,-0.1 -1,-0.3 2,-0.1 2,-0.2 0.504 113.0 98.3 -90.9 -7.9 13.3 0.4 26.5 66 69 A S S < S- 0 0 1 -3,-2.4 -52,-0.2 -6,-0.3 2,-0.1 -0.515 77.4-109.5 -83.6 150.7 16.7 -1.1 25.5 67 70 A E - 0 0 80 -54,-1.9 -5,-2.4 -2,-0.2 -4,-0.3 -0.382 29.1-113.6 -79.0 157.9 19.9 0.0 27.1 68 71 A E - 0 0 68 -7,-0.2 3,-0.1 -6,-0.2 -1,-0.1 -0.779 25.5-151.5 -94.6 127.6 22.5 2.0 25.3 69 72 A P - 0 0 7 0, 0.0 -1,-0.1 0, 0.0 -58,-0.0 -0.086 49.5 -51.2 -81.5-170.3 26.0 0.5 24.6 70 73 A D > - 0 0 101 1,-0.1 3,-2.2 2,-0.1 0, 0.0 -0.345 53.7-119.1 -62.7 146.5 29.2 2.5 24.3 71 74 A Q G > S+ 0 0 113 1,-0.3 3,-2.2 2,-0.2 -1,-0.1 0.810 112.2 69.5 -57.4 -31.6 28.9 5.3 21.8 72 75 A S G 3 S+ 0 0 90 1,-0.3 -1,-0.3 2,-0.0 -2,-0.1 0.734 93.9 59.3 -60.3 -19.9 31.6 3.7 19.7 73 76 A K G < S+ 0 0 71 -3,-2.2 2,-1.8 1,-0.1 -1,-0.3 0.221 70.1 113.4 -93.9 14.4 29.0 1.0 18.9 74 77 A F < + 0 0 7 -3,-2.2 2,-0.3 4,-0.1 -1,-0.1 -0.575 52.9 114.9 -85.6 77.1 26.5 3.4 17.4 75 78 A T S > S- 0 0 55 -2,-1.8 4,-1.4 1,-0.1 5,-0.1 -0.914 75.3-120.7-141.4 165.0 26.8 2.0 13.9 76 79 A I H > S+ 0 0 14 -2,-0.3 4,-2.2 2,-0.2 5,-0.1 0.937 113.5 55.1 -71.6 -48.1 24.7 0.2 11.3 77 80 A D H > S+ 0 0 111 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.858 106.4 51.3 -52.8 -40.4 27.1 -2.8 11.3 78 81 A Y H > S+ 0 0 29 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.912 108.0 52.0 -64.8 -41.9 26.7 -3.2 15.1 79 82 A G H X S+ 0 0 1 -4,-1.4 4,-2.5 1,-0.2 -2,-0.2 0.866 105.4 57.3 -60.6 -35.3 23.0 -3.2 14.7 80 83 A V H X S+ 0 0 5 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.929 107.8 45.0 -60.9 -47.2 23.4 -5.9 12.1 81 84 A E H X S+ 0 0 61 -4,-1.7 4,-2.5 1,-0.2 -1,-0.2 0.823 110.9 55.3 -67.8 -30.6 25.2 -8.2 14.5 82 85 A E H X S+ 0 0 0 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.936 107.9 48.3 -66.9 -46.5 22.6 -7.4 17.2 83 86 A A H X S+ 0 0 0 -4,-2.5 4,-2.8 2,-0.2 5,-0.2 0.939 114.3 45.6 -59.0 -49.6 19.8 -8.5 15.0 84 87 A E H X S+ 0 0 23 -4,-2.3 4,-2.5 1,-0.2 5,-0.2 0.912 112.4 50.7 -62.3 -42.1 21.5 -11.7 14.0 85 88 A A H X S+ 0 0 31 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.856 113.5 46.5 -64.6 -35.0 22.4 -12.5 17.6 86 89 A L H X S+ 0 0 0 -4,-2.2 4,-2.0 2,-0.2 5,-0.3 0.907 111.2 49.6 -73.9 -43.1 18.8 -11.9 18.7 87 90 A R H X>S+ 0 0 4 -4,-2.8 4,-3.3 1,-0.2 5,-0.6 0.943 115.4 45.5 -60.5 -46.8 17.3 -14.0 15.9 88 91 A S H X5S+ 0 0 54 -4,-2.5 4,-2.4 -5,-0.2 -2,-0.2 0.939 111.4 51.2 -60.7 -51.1 19.7 -16.8 16.8 89 92 A K H <5S+ 0 0 109 -4,-2.3 -1,-0.2 -5,-0.2 -2,-0.2 0.822 122.5 31.9 -58.3 -32.1 19.1 -16.5 20.6 90 93 A L H <5S+ 0 0 43 -4,-2.0 -2,-0.2 2,-0.1 -1,-0.2 0.784 136.9 18.4 -97.7 -30.5 15.3 -16.6 20.1 91 94 A F H ><5S- 0 0 26 -4,-3.3 3,-1.4 -5,-0.3 2,-0.4 0.506 81.2-157.9-121.3 -8.0 14.9 -18.9 17.1 92 95 A G T 3< - e 0 125A 0 -70,-2.6 3,-2.9 -2,-0.4 25,-0.2 -0.942 61.4 -42.8-115.9 133.1 11.1 0.6 8.1 102 105 A S T >> S+ 0 0 1 23,-2.3 4,-1.5 -2,-0.4 3,-0.9 -0.328 141.7 5.9 55.4-118.8 13.0 3.8 7.1 103 106 A Y H 3> S+ 0 0 5 1,-0.3 4,-2.5 2,-0.2 -1,-0.3 0.882 132.4 61.6 -58.4 -36.5 16.3 3.4 8.8 104 107 A G H <> S+ 0 0 0 -3,-2.9 4,-2.0 1,-0.2 -1,-0.3 0.835 100.4 54.7 -58.3 -31.8 15.2 -0.1 9.7 105 108 A G H <> S+ 0 0 0 -3,-0.9 4,-2.1 20,-0.2 -1,-0.2 0.951 107.6 46.8 -66.3 -48.4 15.0 -0.7 6.0 106 109 A A H X S+ 0 0 3 -4,-1.5 4,-1.8 1,-0.2 -2,-0.2 0.869 113.3 50.8 -59.5 -37.4 18.6 0.3 5.5 107 110 A L H X S+ 0 0 0 -4,-2.5 4,-1.7 1,-0.2 -1,-0.2 0.843 107.7 53.2 -68.9 -35.7 19.5 -1.9 8.4 108 111 A A H X S+ 0 0 0 -4,-2.0 4,-2.8 -5,-0.2 -2,-0.2 0.879 107.6 50.8 -66.6 -38.8 17.6 -4.8 6.9 109 112 A L H X S+ 0 0 0 -4,-2.1 4,-2.5 2,-0.2 -2,-0.2 0.929 110.6 47.5 -65.7 -45.1 19.5 -4.5 3.6 110 113 A A H X S+ 0 0 11 -4,-1.8 4,-1.0 2,-0.2 -1,-0.2 0.837 112.1 52.5 -65.5 -32.4 22.9 -4.5 5.3 111 114 A Y H >X S+ 0 0 2 -4,-1.7 4,-4.3 2,-0.2 3,-1.0 0.974 110.0 46.6 -64.3 -54.6 21.7 -7.5 7.3 112 115 A A H 3X S+ 0 0 0 -4,-2.8 4,-1.6 1,-0.3 -2,-0.2 0.870 103.8 63.0 -56.1 -39.3 20.7 -9.4 4.2 113 116 A V H 3< S+ 0 0 47 -4,-2.5 -1,-0.3 1,-0.2 -2,-0.2 0.851 122.1 21.0 -56.0 -35.2 24.0 -8.5 2.5 114 117 A K H << S+ 0 0 124 -4,-1.0 -2,-0.2 -3,-1.0 -1,-0.2 0.768 138.6 27.4-104.1 -34.5 25.7 -10.5 5.2 115 118 A Y H >< + 0 0 43 -4,-4.3 3,-2.2 -5,-0.2 -3,-0.2 -0.025 69.6 125.8-121.8 33.5 23.1 -12.9 6.6 116 119 A Q G >< + 0 0 45 -4,-1.6 3,-1.7 1,-0.3 -1,-0.1 0.723 66.8 74.9 -63.7 -17.8 20.6 -13.4 3.8 117 120 A D G 3 S+ 0 0 130 1,-0.3 -1,-0.3 -3,-0.2 -2,-0.1 0.653 92.4 53.8 -67.7 -14.3 21.2 -17.1 4.4 118 121 A H G < S+ 0 0 45 -3,-2.2 -22,-2.3 -23,-0.1 2,-0.3 0.298 101.5 82.1-100.8 7.8 19.1 -16.8 7.5 119 122 A L E < -e 96 0A 8 -3,-1.7 -22,-0.2 -24,-0.2 3,-0.1 -0.802 50.7-169.7-119.1 157.6 16.2 -15.3 5.6 120 123 A K E S- 0 0 59 -24,-1.3 2,-0.3 1,-0.5 -23,-0.2 0.670 82.8 -5.5-106.8 -33.1 13.2 -16.4 3.5 121 124 A G E -e 97 0A 0 -25,-0.5 -23,-2.1 110,-0.1 -1,-0.5 -0.985 60.4-136.2-160.2 157.6 12.3 -13.0 2.3 122 125 A L E -ef 98 233A 0 110,-2.6 112,-3.1 -2,-0.3 2,-0.4 -0.945 14.0-169.3-122.1 142.0 13.1 -9.3 2.7 123 126 A I E -ef 99 234A 0 -25,-2.2 -23,-2.4 -2,-0.4 2,-0.5 -0.992 2.3-174.8-134.5 125.0 10.7 -6.4 3.1 124 127 A V E -ef 100 235A 0 110,-2.9 112,-3.1 -2,-0.4 2,-0.5 -0.972 1.7-175.5-125.3 122.4 11.7 -2.7 2.9 125 128 A S E S-ef 101 236A 2 -25,-2.2 -23,-2.3 -2,-0.5 -20,-0.2 -0.949 80.1 -19.0-120.1 113.6 9.2 0.1 3.5 126 129 A G S S+ 0 0 2 110,-2.4 -1,-0.2 -2,-0.5 -21,-0.1 0.806 104.0 147.4 61.3 25.3 10.4 3.6 3.0 127 130 A G - 0 0 4 109,-0.4 2,-0.3 -27,-0.2 -24,-0.2 -0.115 32.6-152.2 -80.9-172.2 13.9 2.1 3.4 128 131 A L - 0 0 1 -26,-0.5 -19,-0.2 -25,-0.1 3,-0.1 -0.988 26.9-162.4-162.5 149.4 17.1 3.2 1.7 129 132 A S S S+ 0 0 0 -2,-0.3 93,-2.4 1,-0.3 94,-0.5 0.465 91.1 44.5-108.4 -8.9 20.5 1.9 0.5 130 133 A S B > -H 221 0B 5 91,-0.2 4,-1.5 92,-0.2 -1,-0.3 -0.946 54.6-171.1-142.8 118.0 22.0 5.4 0.4 131 134 A V H > S+ 0 0 2 89,-2.3 4,-2.9 -2,-0.4 5,-0.2 0.934 92.8 56.5 -69.5 -46.8 21.6 8.2 2.9 132 135 A P H > S+ 0 0 55 0, 0.0 4,-2.8 0, 0.0 -1,-0.2 0.907 109.2 46.3 -51.7 -42.8 23.2 10.7 0.6 133 136 A L H > S+ 0 0 32 1,-0.2 4,-2.7 2,-0.2 -2,-0.2 0.892 111.4 52.6 -66.6 -37.7 20.6 10.0 -2.0 134 137 A T H X S+ 0 0 0 -4,-1.5 4,-2.3 2,-0.2 -1,-0.2 0.865 111.2 46.8 -64.6 -38.2 17.9 10.2 0.7 135 138 A V H X S+ 0 0 38 -4,-2.9 4,-2.5 2,-0.2 -2,-0.2 0.943 111.2 50.5 -68.2 -49.3 19.2 13.6 1.7 136 139 A K H X S+ 0 0 137 -4,-2.8 4,-1.5 -5,-0.2 -2,-0.2 0.934 113.9 45.9 -53.8 -48.9 19.4 14.8 -1.9 137 140 A E H X S+ 0 0 12 -4,-2.7 4,-1.7 1,-0.2 -1,-0.2 0.914 111.2 50.9 -63.5 -44.4 15.8 13.7 -2.5 138 141 A M H X S+ 0 0 0 -4,-2.3 4,-1.7 1,-0.2 -1,-0.2 0.860 104.0 58.9 -63.3 -33.9 14.5 15.2 0.8 139 142 A N H X S+ 0 0 76 -4,-2.5 4,-2.1 1,-0.2 3,-0.3 0.931 103.3 52.8 -58.7 -44.5 16.1 18.5 -0.1 140 143 A R H X S+ 0 0 98 -4,-1.5 4,-1.5 1,-0.3 -1,-0.2 0.916 105.6 53.4 -56.4 -44.9 14.0 18.5 -3.2 141 144 A L H < S+ 0 0 7 -4,-1.7 -1,-0.3 1,-0.2 -2,-0.2 0.842 107.2 53.2 -59.2 -32.8 10.9 18.0 -1.1 142 145 A I H >< S+ 0 0 11 -4,-1.7 3,-1.6 -3,-0.3 -1,-0.2 0.902 105.8 51.9 -69.2 -41.2 12.0 21.0 0.9 143 146 A D H 3< S+ 0 0 87 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.771 104.9 56.9 -66.2 -25.7 12.2 23.2 -2.2 144 147 A E T 3< S+ 0 0 130 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.445 90.2 100.9 -84.5 1.1 8.7 22.1 -3.1 145 148 A L S < S- 0 0 10 -3,-1.6 5,-0.1 -5,-0.2 -3,-0.0 -0.452 90.8 -82.2 -82.4 156.7 7.6 23.4 0.3 146 149 A P > - 0 0 54 0, 0.0 4,-2.3 0, 0.0 5,-0.3 -0.316 48.2-102.6 -61.8 142.9 5.9 26.8 0.6 147 150 A A H > S+ 0 0 58 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.786 116.3 50.0 -26.4 -67.2 8.2 29.9 0.7 148 151 A K H > S+ 0 0 115 1,-0.2 4,-3.0 2,-0.2 3,-0.3 0.928 115.4 40.7 -43.0 -66.6 8.0 30.5 4.4 149 152 A Y H > S+ 0 0 46 1,-0.2 4,-2.0 -3,-0.2 -1,-0.2 0.834 114.4 54.1 -54.8 -37.9 8.7 27.0 5.6 150 153 A R H X S+ 0 0 82 -4,-2.3 4,-1.6 2,-0.2 -1,-0.2 0.903 113.1 41.9 -65.3 -42.7 11.4 26.5 2.9 151 154 A D H X S+ 0 0 69 -4,-2.8 4,-3.8 -5,-0.3 5,-0.3 0.884 110.9 57.1 -71.4 -38.9 13.3 29.6 4.0 152 155 A A H X>S+ 0 0 5 -4,-3.0 4,-1.4 -5,-0.3 5,-0.8 0.898 107.4 48.5 -58.5 -42.4 12.7 28.7 7.7 153 156 A I H X5S+ 0 0 18 -4,-2.0 4,-0.9 -5,-0.2 5,-0.3 0.919 117.1 41.9 -65.0 -43.3 14.5 25.4 7.1 154 157 A K H X5S+ 0 0 94 -4,-1.6 4,-2.0 3,-0.2 -2,-0.2 0.945 121.4 38.3 -69.7 -50.4 17.4 27.0 5.3 155 158 A K H X5S+ 0 0 130 -4,-3.8 4,-1.1 2,-0.2 -3,-0.2 0.997 127.1 32.0 -65.3 -65.7 17.8 30.1 7.6 156 159 A Y H X>S+ 0 0 32 -4,-1.4 5,-2.7 -5,-0.3 4,-1.6 0.842 120.2 54.0 -62.3 -35.7 17.2 28.5 11.0 157 160 A G H < < + 0 0 37 -5,-2.7 3,-2.1 1,-0.2 6,-0.3 -0.396 8.8 149.3 -95.3 56.6 17.9 27.1 15.7 162 165 A Y T 3 S+ 0 0 76 -2,-0.9 -1,-0.2 1,-0.3 -5,-0.1 0.674 71.6 60.3 -61.8 -16.9 15.9 23.8 15.4 163 166 A E T 3 S+ 0 0 129 -3,-0.3 -1,-0.3 -7,-0.1 -2,-0.1 0.602 77.4 121.1 -85.7 -14.5 14.0 25.1 18.5 164 167 A N <> - 0 0 30 -3,-2.1 4,-2.1 1,-0.1 5,-0.2 -0.142 70.0-128.3 -49.8 143.3 12.8 28.2 16.7 165 168 A P H > S+ 0 0 97 0, 0.0 4,-1.2 0, 0.0 -1,-0.1 0.792 108.1 46.1 -66.5 -28.4 9.0 28.5 16.6 166 169 A E H > S+ 0 0 75 2,-0.2 4,-1.9 3,-0.1 5,-0.2 0.931 109.7 51.4 -79.3 -49.3 9.0 29.0 12.8 167 170 A Y H > S+ 0 0 3 -6,-0.3 4,-2.7 1,-0.2 3,-0.4 0.928 110.2 51.3 -52.1 -49.4 11.4 26.2 11.9 168 171 A Q H X S+ 0 0 74 -4,-2.1 4,-2.6 1,-0.3 -1,-0.2 0.915 106.1 54.7 -53.8 -46.7 9.3 23.8 14.0 169 172 A E H X S+ 0 0 86 -4,-1.2 4,-1.8 1,-0.2 -1,-0.3 0.855 109.5 47.8 -57.5 -36.4 6.2 25.0 12.1 170 173 A A H X S+ 0 0 0 -4,-1.9 4,-2.7 -3,-0.4 -1,-0.2 0.931 109.0 53.1 -70.7 -45.3 8.0 24.1 8.9 171 174 A V H X S+ 0 0 2 -4,-2.7 4,-2.6 1,-0.2 -2,-0.2 0.876 108.3 51.9 -56.5 -39.4 9.0 20.7 10.3 172 175 A N H X S+ 0 0 65 -4,-2.6 4,-2.8 2,-0.2 -1,-0.2 0.930 109.1 48.1 -64.3 -47.2 5.4 20.0 11.1 173 176 A Y H < S+ 0 0 95 -4,-1.8 4,-0.5 2,-0.2 -2,-0.2 0.972 112.5 49.3 -57.0 -55.4 4.1 20.8 7.6 174 177 A F H >X S+ 0 0 0 -4,-2.7 4,-2.3 1,-0.2 3,-1.6 0.934 112.1 49.1 -48.2 -53.7 6.8 18.6 6.1 175 178 A Y H 3X>S+ 0 0 0 -4,-2.6 4,-2.8 1,-0.3 5,-1.8 0.928 108.5 50.4 -53.3 -53.6 5.9 15.8 8.4 176 179 A H H 3<5S+ 0 0 82 -4,-2.8 -1,-0.3 1,-0.2 -2,-0.2 0.509 118.6 44.1 -66.2 -0.0 2.1 15.9 7.8 177 180 A Q H <45S+ 0 0 58 -3,-1.6 -2,-0.2 -4,-0.5 -1,-0.2 0.681 133.1 9.9-113.6 -29.5 3.2 15.8 4.1 178 181 A H H <5S+ 0 0 11 -4,-2.3 64,-2.0 -3,-0.2 90,-0.8 0.502 128.1 45.5-131.4 -9.7 5.8 13.1 4.0 179 182 A L T <5S- 0 0 1 -4,-2.8 90,-2.7 -5,-0.4 2,-0.4 0.863 128.5 -7.4 -98.9 -64.4 5.9 11.3 7.3 180 183 A L < - 0 0 0 -5,-1.8 -1,-0.3 88,-0.2 -2,-0.2 -0.967 56.2-174.9-139.3 118.6 2.2 10.7 8.1 181 184 A R + 0 0 81 -2,-0.4 2,-0.1 -4,-0.1 -5,-0.1 0.536 56.3 90.2 -91.7 -8.5 -0.6 12.1 6.0 182 185 A S S S- 0 0 43 1,-0.1 2,-0.1 2,-0.0 3,-0.1 -0.431 77.0-107.3 -91.0 164.7 -3.6 11.1 8.0 183 186 A E S S+ 0 0 178 1,-0.2 -1,-0.1 -2,-0.1 -2,-0.1 -0.427 91.3 33.2 -82.6 160.6 -5.4 12.8 10.9 184 187 A D S S- 0 0 123 1,-0.1 -1,-0.2 -2,-0.1 -2,-0.0 0.987 80.7-135.4 56.0 78.1 -5.2 11.6 14.5 185 188 A W - 0 0 24 -3,-0.1 -1,-0.1 1,-0.1 5,-0.1 -0.481 28.4-114.7 -63.7 118.6 -1.6 10.3 14.8 186 189 A P >> - 0 0 18 0, 0.0 4,-1.8 0, 0.0 3,-1.4 -0.164 18.2-115.3 -56.4 147.6 -1.9 7.0 16.7 187 190 A P H 3> S+ 0 0 96 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.807 113.7 64.8 -53.5 -31.4 -0.3 6.8 20.2 188 191 A E H 3> S+ 0 0 62 1,-0.2 4,-1.2 2,-0.2 -147,-0.2 0.857 105.1 43.8 -63.2 -35.0 2.1 4.2 18.9 189 192 A V H <> S+ 0 0 0 -3,-1.4 4,-2.5 2,-0.2 3,-0.3 0.942 111.8 51.7 -74.9 -48.6 3.7 6.7 16.6 190 193 A L H X S+ 0 0 79 -4,-1.8 4,-2.6 1,-0.2 -2,-0.2 0.884 108.2 53.1 -55.0 -41.1 3.8 9.5 19.1 191 194 A K H X S+ 0 0 75 -4,-2.6 4,-2.6 2,-0.2 -1,-0.2 0.891 108.8 49.0 -63.8 -38.6 5.5 7.2 21.6 192 195 A S H X S+ 0 0 0 -4,-1.2 4,-1.5 -3,-0.3 -2,-0.2 0.892 112.9 47.3 -67.1 -40.1 8.2 6.3 19.0 193 196 A L H X S+ 0 0 2 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.893 113.3 48.5 -66.2 -39.8 8.8 10.0 18.2 194 197 A E H X S+ 0 0 66 -4,-2.6 4,-0.9 -5,-0.2 -2,-0.2 0.902 108.3 55.0 -66.3 -41.3 8.9 10.7 21.9 195 198 A Y H X S+ 0 0 37 -4,-2.6 4,-2.2 1,-0.2 -1,-0.2 0.844 107.3 50.7 -60.5 -33.9 11.4 7.9 22.4 196 199 A A H < S+ 0 0 3 -4,-1.5 6,-0.3 1,-0.2 7,-0.3 0.949 107.3 50.9 -69.1 -49.8 13.6 9.4 19.7 197 200 A E H < S+ 0 0 104 -4,-2.0 -1,-0.2 1,-0.2 -2,-0.2 0.621 116.1 45.3 -64.4 -14.4 13.7 12.9 21.3 198 201 A R H < S+ 0 0 167 -4,-0.9 -2,-0.2 -3,-0.2 -1,-0.2 0.883 102.4 59.3 -97.1 -50.0 14.7 11.3 24.6 199 202 A R S < S- 0 0 54 -4,-2.2 4,-0.2 -163,-0.3 -136,-0.1 0.064 81.4-121.8 -68.0-171.0 17.4 8.7 24.0 200 203 A N S > S+ 0 0 55 -138,-0.4 4,-1.8 2,-0.1 5,-0.2 0.589 91.3 81.9-111.1 -14.0 20.7 9.6 22.4 201 204 A V H >>S+ 0 0 2 -139,-0.5 4,-3.2 1,-0.2 5,-0.7 0.917 91.2 50.2 -58.6 -48.2 20.8 7.4 19.4 202 205 A Y H >>S+ 0 0 6 -6,-0.3 5,-2.5 -166,-0.3 4,-1.0 0.903 112.6 46.5 -58.4 -45.7 18.7 9.6 17.2 203 206 A R H 45S+ 0 0 141 -7,-0.3 -1,-0.2 -4,-0.2 -2,-0.2 0.815 120.7 38.2 -68.4 -31.9 20.7 12.7 17.9 204 207 A I H <5S+ 0 0 39 -4,-1.8 12,-1.4 11,-0.1 -2,-0.2 0.906 128.3 27.0 -87.8 -45.0 24.1 11.0 17.4 205 208 A M H <5S+ 0 0 0 -4,-3.2 12,-1.8 10,-0.3 -3,-0.2 0.890 134.5 22.9 -86.1 -43.5 23.4 8.7 14.4 206 209 A N T < S-I 212 0C 6 3,-0.6 3,-1.1 -3,-0.1 84,-0.0 -0.835 80.1 -65.7-149.8-171.8 15.1 15.6 12.6 210 213 A Q T 3 S+ 0 0 1 1,-0.3 3,-0.1 -2,-0.2 -176,-0.0 0.845 128.9 35.6 -51.6 -45.5 13.7 13.4 9.8 211 214 A F T 3 S+ 0 0 10 1,-0.2 2,-0.6 -73,-0.1 -1,-0.3 0.416 106.4 75.6 -93.9 3.1 14.9 15.5 6.9 212 215 A T B < +I 209 0C 22 -3,-1.1 2,-1.0 85,-0.3 -3,-0.6 -0.799 54.5 173.1-118.8 91.3 18.2 16.6 8.5 213 216 A I + 0 0 13 -2,-0.6 -6,-0.2 1,-0.2 -78,-0.1 -0.711 25.7 135.1-100.4 83.0 20.7 13.7 8.5 214 217 A T + 0 0 85 -2,-1.0 -7,-0.2 -8,-0.4 -1,-0.2 0.271 44.9 105.1-109.3 7.9 23.9 15.2 9.8 215 218 A G S > S- 0 0 10 -9,-3.1 3,-1.1 -3,-0.1 -10,-0.3 0.248 93.9 -72.6 -73.2-160.6 24.7 12.3 12.1 216 219 A T T 3 S+ 0 0 89 -12,-1.4 3,-0.4 1,-0.2 -11,-0.2 0.626 127.3 58.9 -73.8 -14.5 27.2 9.5 11.8 217 220 A I T > S+ 0 0 4 -12,-1.8 3,-0.7 1,-0.2 -1,-0.2 0.235 71.0 111.3 -99.2 15.1 25.3 7.7 9.0 218 221 A K T < S+ 0 0 101 -3,-1.1 -1,-0.2 1,-0.2 -83,-0.1 0.753 85.3 34.9 -59.4 -27.4 25.5 10.7 6.8 219 222 A D T 3 S+ 0 0 120 -3,-0.4 -1,-0.2 -88,-0.1 -2,-0.1 0.462 86.3 128.8-106.2 -4.3 27.9 9.0 4.3 220 223 A W < + 0 0 38 -3,-0.7 -89,-2.3 -90,-0.1 2,-0.2 -0.276 23.8 153.5 -57.1 131.9 26.5 5.5 4.6 221 224 A D B +H 130 0B 69 -91,-0.2 -91,-0.2 -90,-0.1 3,-0.2 -0.755 19.5 165.9-164.9 111.7 25.7 3.9 1.2 222 225 A I >> + 0 0 16 -93,-2.4 4,-2.1 -2,-0.2 3,-0.9 -0.091 38.8 125.1-118.5 31.9 25.6 0.2 0.3 223 226 A T T 34 S+ 0 0 25 -94,-0.5 4,-0.2 1,-0.3 -1,-0.1 0.834 75.9 53.8 -58.1 -32.5 23.9 0.6 -3.0 224 227 A D T 34 S+ 0 0 117 -3,-0.2 -1,-0.3 1,-0.2 3,-0.2 0.730 111.9 43.8 -75.4 -23.9 26.8 -1.3 -4.6 225 228 A K T X4 S+ 0 0 115 -3,-0.9 3,-2.0 1,-0.2 -2,-0.2 0.762 93.0 74.6 -93.6 -30.2 26.4 -4.3 -2.2 226 229 A I G >< S+ 0 0 0 -4,-2.1 3,-1.1 1,-0.3 -1,-0.2 0.570 79.3 78.7 -63.0 -6.2 22.7 -4.9 -2.0 227 230 A S G 3 S+ 0 0 49 1,-0.2 29,-0.3 -4,-0.2 -1,-0.3 0.595 80.8 67.7 -77.5 -9.3 22.9 -6.4 -5.5 228 231 A A G < S+ 0 0 54 -3,-2.0 2,-0.6 27,-0.1 -1,-0.2 0.572 72.5 111.1 -83.9 -11.0 24.2 -9.6 -3.9 229 232 A I < + 0 0 0 -3,-1.1 27,-0.3 -4,-0.2 -116,-0.1 -0.522 38.9 173.3 -70.0 112.4 20.8 -10.2 -2.2 230 233 A K + 0 0 137 -2,-0.6 -1,-0.1 25,-0.1 -3,-0.0 -0.176 41.2 100.3-114.3 40.6 19.2 -13.2 -3.9 231 234 A I S S- 0 0 23 1,-0.1 -110,-0.1 25,-0.0 -109,-0.1 -0.883 87.3 -77.4-121.9 156.1 16.1 -13.8 -1.7 232 235 A P - 0 0 42 0, 0.0 -110,-2.6 0, 0.0 2,-0.4 -0.249 57.3-167.2 -51.0 131.2 12.5 -12.8 -2.4 233 236 A T E -f 122 0A 2 24,-0.4 26,-2.9 -112,-0.2 2,-0.5 -0.988 19.5-164.2-135.0 133.8 12.2 -9.1 -1.7 234 237 A L E -fg 123 259A 0 -112,-3.1 -110,-2.9 -2,-0.4 2,-0.5 -0.955 9.8-170.2-114.5 124.5 9.2 -6.8 -1.3 235 238 A I E +fg 124 260A 2 24,-3.7 26,-3.6 -2,-0.5 2,-0.4 -0.973 7.1 178.5-118.2 124.0 9.8 -3.0 -1.5 236 239 A T E +fg 125 261A 0 -112,-3.1 -110,-2.4 -2,-0.5 -109,-0.4 -0.939 4.3 168.5-124.6 147.3 7.1 -0.6 -0.6 237 240 A V E - g 0 262A 0 24,-2.1 26,-1.5 -2,-0.4 31,-0.1 -0.969 32.9-112.1-156.8 140.5 7.1 3.2 -0.5 238 241 A G E > - g 0 263A 0 29,-0.7 3,-0.7 -2,-0.3 29,-0.2 -0.355 24.4-122.1 -72.9 155.1 4.5 5.9 -0.2 239 242 A E T 3 S+ 0 0 76 24,-2.6 28,-0.2 27,-0.3 25,-0.1 0.909 117.6 28.8 -60.3 -43.3 3.6 8.2 -3.0 240 243 A Y T 3 S+ 0 0 78 26,-2.7 -1,-0.2 23,-0.3 28,-0.2 0.154 92.4 153.1-103.7 15.8 4.5 11.2 -0.9 241 244 A D < - 0 0 0 -3,-0.7 3,-0.3 26,-0.4 -62,-0.2 -0.141 52.3-133.1 -50.6 133.4 7.0 9.4 1.2 242 245 A E S S+ 0 0 0 -64,-2.0 2,-0.8 1,-0.3 -1,-0.2 0.767 112.5 55.1 -59.0 -26.4 9.9 11.5 2.7 243 246 A V S S- 0 0 1 -65,-0.3 -1,-0.3 -106,-0.1 5,-0.2 -0.722 106.8-141.8-106.4 74.4 12.1 8.7 1.4 244 247 A T >> - 0 0 5 -2,-0.8 3,-1.7 -3,-0.3 4,-1.3 0.246 20.1-104.6 -36.4 154.6 10.7 9.2 -2.2 245 248 A P H 3> S+ 0 0 46 0, 0.0 4,-2.8 0, 0.0 -1,-0.1 0.685 118.0 73.1 -59.6 -15.4 10.0 6.3 -4.5 246 249 A N H 3> S+ 0 0 58 2,-0.2 4,-1.5 1,-0.2 -2,-0.1 0.879 98.2 45.4 -66.4 -36.3 13.2 7.4 -6.3 247 250 A V H <> S+ 0 0 0 -3,-1.7 4,-1.4 2,-0.2 -118,-0.3 0.885 112.5 51.0 -71.7 -39.0 15.2 6.0 -3.4 248 251 A A H X S+ 0 0 4 -4,-1.3 4,-2.8 -5,-0.2 -2,-0.2 0.898 103.7 60.5 -64.2 -41.0 13.1 2.9 -3.4 249 252 A R H X S+ 0 0 100 -4,-2.8 4,-2.9 1,-0.2 5,-0.2 0.936 100.5 52.9 -51.5 -52.4 13.8 2.5 -7.2 250 253 A V H X S+ 0 0 17 -4,-1.5 4,-1.2 1,-0.2 -1,-0.2 0.912 112.0 45.7 -51.1 -48.4 17.6 2.3 -6.7 251 254 A I H X S+ 0 0 0 -4,-1.4 4,-1.8 1,-0.2 3,-0.5 0.920 112.6 51.7 -60.1 -44.9 17.1 -0.5 -4.2 252 255 A H H < S+ 0 0 58 -4,-2.8 6,-0.4 1,-0.2 -2,-0.2 0.849 105.5 54.9 -61.8 -38.4 14.6 -2.2 -6.6 253 256 A E H < S+ 0 0 113 -4,-2.9 -1,-0.2 1,-0.2 -2,-0.2 0.779 110.3 45.9 -67.4 -29.9 17.0 -2.0 -9.5 254 257 A K H < S+ 0 0 71 -4,-1.2 2,-0.9 -3,-0.5 -2,-0.2 0.829 98.2 72.9 -83.5 -35.4 19.8 -3.8 -7.6 255 258 A I S >< S- 0 0 2 -4,-1.8 3,-1.8 -27,-0.1 -1,-0.1 -0.727 83.9-134.4 -88.2 107.6 17.7 -6.7 -6.1 256 259 A A T 3 S+ 0 0 72 -2,-0.9 -23,-0.1 -27,-0.3 -3,-0.1 -0.340 85.7 8.0 -60.5 129.0 16.9 -9.1 -8.9 257 260 A G T 3 S+ 0 0 77 1,-0.2 -24,-0.4 -2,-0.1 -1,-0.3 0.604 91.8 148.6 75.9 12.4 13.2 -10.2 -8.9 258 261 A S < - 0 0 10 -3,-1.8 2,-0.4 -6,-0.4 -1,-0.2 -0.475 43.2-130.2 -78.8 150.6 12.3 -7.7 -6.2 259 262 A E E -g 234 0A 66 -26,-2.9 -24,-3.7 -2,-0.1 2,-0.5 -0.868 15.0-158.1-104.4 134.7 8.8 -6.2 -6.1 260 263 A L E -g 235 0A 54 -2,-0.4 2,-0.5 -26,-0.2 -24,-0.2 -0.950 9.9-176.2-115.6 118.5 8.3 -2.5 -5.8 261 264 A H E -g 236 0A 67 -26,-3.6 -24,-2.1 -2,-0.5 2,-0.8 -0.961 10.0-161.3-119.2 121.1 4.9 -1.2 -4.6 262 265 A V E -g 237 0A 45 -2,-0.5 2,-0.5 -26,-0.2 -24,-0.2 -0.864 15.4-144.1-103.7 104.8 4.1 2.5 -4.4 263 266 A F E > -g 238 0A 22 -26,-1.5 -24,-2.6 -2,-0.8 3,-0.9 -0.543 17.7-134.0 -71.1 117.2 1.2 3.1 -2.1 264 267 A R T 3 S+ 0 0 161 -2,-0.5 3,-0.1 1,-0.2 -1,-0.1 -0.395 83.9 10.9 -71.5 147.7 -0.9 6.0 -3.4 265 268 A D T 3 S+ 0 0 113 1,-0.2 -1,-0.2 -2,-0.1 2,-0.2 0.399 110.5 103.6 66.4 -3.5 -2.0 8.8 -1.1 266 269 A C < - 0 0 7 -3,-0.9 -26,-2.7 1,-0.1 -25,-0.3 -0.535 47.2-175.8-103.1 171.6 0.4 7.4 1.6 267 270 A S - 0 0 0 -27,-0.2 -29,-0.7 -29,-0.2 -26,-0.4 -0.065 56.8 -32.1-131.7-124.5 3.8 8.6 2.7 268 271 A H S S+ 0 0 4 -90,-0.8 2,-2.3 -28,-0.2 3,-0.2 0.989 128.4 47.5 -71.6 -65.0 6.3 7.3 5.2 269 272 A L >> + 0 0 2 -90,-2.7 3,-1.6 1,-0.2 4,-1.2 -0.411 66.4 157.4 -79.7 67.9 4.3 5.4 7.8 270 273 A T H 3> + 0 0 2 -2,-2.3 4,-2.4 -3,-0.4 8,-0.2 0.705 60.9 74.7 -66.2 -20.7 2.1 3.6 5.3 271 274 A M H 34 S+ 0 0 0 -3,-0.2 -1,-0.3 1,-0.2 8,-0.1 0.582 106.7 34.9 -70.4 -6.4 1.3 0.9 7.9 272 275 A W H X4 S+ 0 0 32 -3,-1.6 3,-0.6 2,-0.1 -2,-0.2 0.689 116.3 50.9-112.9 -33.7 -1.0 3.4 9.5 273 276 A E H 3< S+ 0 0 40 -4,-1.2 -2,-0.2 1,-0.2 -3,-0.1 0.874 133.4 14.8 -73.3 -38.6 -2.4 5.3 6.5 274 277 A D T 3X S+ 0 0 55 -4,-2.4 4,-2.9 -5,-0.1 5,-0.3 -0.503 78.7 159.2-134.4 63.0 -3.3 2.1 4.7 275 278 A R H <> S+ 0 0 82 -3,-0.6 4,-2.5 2,-0.2 5,-0.3 0.910 75.0 44.3 -52.1 -52.7 -3.2 -0.4 7.5 276 279 A E H > S+ 0 0 151 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.961 117.9 43.1 -60.2 -54.7 -5.4 -3.0 5.8 277 280 A G H > S+ 0 0 22 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.817 115.6 50.1 -61.6 -33.5 -3.8 -2.7 2.4 278 281 A Y H X S+ 0 0 0 -4,-2.9 4,-2.3 -8,-0.2 5,-0.2 0.980 113.5 42.9 -69.2 -57.5 -0.3 -2.7 3.9 279 282 A N H X S+ 0 0 10 -4,-2.5 4,-2.3 -5,-0.3 5,-0.2 0.830 113.4 53.9 -58.0 -35.4 -0.7 -5.7 6.1 280 283 A K H X S+ 0 0 155 -4,-2.3 4,-2.3 -5,-0.3 -1,-0.2 0.937 109.4 47.4 -65.7 -45.9 -2.5 -7.6 3.3 281 284 A L H X S+ 0 0 28 -4,-1.8 4,-1.8 1,-0.2 -2,-0.2 0.879 114.2 47.0 -62.9 -40.9 0.4 -6.9 0.8 282 285 A L H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 -1,-0.2 0.901 113.8 46.6 -69.6 -41.1 3.0 -8.0 3.4 283 286 A S H X S+ 0 0 6 -4,-2.3 4,-2.5 -5,-0.2 -2,-0.2 0.856 111.4 52.6 -70.0 -34.4 1.1 -11.2 4.4 284 287 A D H X S+ 0 0 72 -4,-2.3 4,-0.9 -5,-0.2 -1,-0.2 0.921 111.5 45.7 -65.5 -45.3 0.5 -12.1 0.7 285 288 A F H X S+ 0 0 5 -4,-1.8 4,-0.7 2,-0.2 3,-0.4 0.925 114.5 48.9 -62.1 -47.1 4.2 -11.8 -0.1 286 289 A I H >< S+ 0 0 0 -4,-2.4 3,-1.7 1,-0.2 -2,-0.2 0.962 111.4 46.8 -58.7 -55.8 5.2 -13.8 3.0 287 290 A L H >< S+ 0 0 62 -4,-2.5 3,-0.6 1,-0.3 -1,-0.2 0.663 105.8 62.3 -62.8 -17.7 2.8 -16.7 2.4 288 291 A K H 3< S+ 0 0 126 -4,-0.9 -1,-0.3 -3,-0.4 -2,-0.2 0.700 109.0 40.7 -79.3 -21.8 3.8 -16.8 -1.2 289 292 A H T << 0 0 62 -3,-1.7 -1,-0.2 -4,-0.7 -2,-0.2 -0.236 360.0 360.0-120.7 43.5 7.4 -17.6 -0.2 290 293 A L < 0 0 112 -3,-0.6 -264,-0.1 -264,-0.0 -3,-0.1 0.004 360.0 360.0 -72.1 360.0 6.8 -20.1 2.6 291 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 292 401 Q P 0 0 13 0, 0.0 2,-0.2 0, 0.0 -98,-0.1 0.000 360.0 360.0 360.0 -44.0 12.0 13.9 16.0 293 402 Q L + 0 0 22 -103,-0.1 2,-0.5 -84,-0.0 -96,-0.1 -0.739 360.0 172.2 179.2-126.4 8.8 15.7 16.7 294 403 Q G 0 0 7 -2,-0.2 -122,-0.1 1,-0.2 -119,-0.1 -0.892 360.0 360.0 104.9-137.6 5.1 16.1 16.1 295 404 Q G 0 0 135 -2,-0.5 -1,-0.2 -123,-0.0 -2,-0.0 -0.073 360.0 360.0-151.0 360.0 4.0 18.6 18.7 296 !* 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 297 301 A P 0 0 2 0, 0.0 -85,-0.3 0, 0.0 -195,-0.0 0.000 360.0 360.0 360.0 360.0 16.5 9.8 8.4