==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 11-JUN-07 2V32 . COMPND 2 MOLECULE: PEROXIREDOXIN 6; . SOURCE 2 ORGANISM_SCIENTIFIC: ARENICOLA MARINA; . AUTHOR A.SMEETS,J.P.DECLERCQ . 877 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 34813.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 570 65.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 52 5.9 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 142 16.2 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 . 8 0.9 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 . 2 0.2 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 . 60 6.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 86 9.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 204 23.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 12 1.4 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 0 9 3 4 0 0 0 0 4 0 2 4 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 0 4 0 0 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 PARALLEL BRIDGES PER LADDER . 6 22 2 4 0 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 ANTIPARALLEL BRIDGES PER LADDER . 8 0 4 0 0 0 0 0 0 0 2 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 2 A G 0 0 74 0, 0.0 2,-0.4 0, 0.0 109,-0.2 0.000 360.0 360.0 360.0 172.7 -2.5 52.0 -19.9 2 3 A I - 0 0 16 107,-0.5 2,-0.2 108,-0.0 3,-0.1 -0.988 360.0-155.5-130.5 132.0 -1.2 49.2 -17.7 3 4 A T > - 0 0 46 -2,-0.4 3,-1.7 1,-0.1 135,-0.3 -0.666 39.8 -72.6-105.7 164.7 0.9 46.3 -19.0 4 5 A L T 3 S+ 0 0 9 327,-0.4 135,-0.2 329,-0.3 -1,-0.1 -0.216 117.0 20.4 -57.3 140.4 1.2 42.9 -17.5 5 6 A G T 3 S+ 0 0 27 133,-3.5 -1,-0.2 1,-0.3 2,-0.2 0.372 87.6 133.8 79.2 -3.2 3.3 42.7 -14.3 6 7 A E < - 0 0 81 -3,-1.7 132,-2.9 132,-0.2 2,-0.3 -0.539 69.6-106.2 -69.6 145.9 2.9 46.4 -13.4 7 8 A V B -A 137 0A 84 130,-0.2 130,-0.3 -2,-0.2 129,-0.1 -0.581 43.0-119.3 -71.0 127.6 2.0 47.1 -9.8 8 9 A F - 0 0 1 128,-3.2 -1,-0.1 -2,-0.3 15,-0.1 -0.577 40.2 -86.0 -71.3 140.8 -1.7 48.1 -10.1 9 10 A P - 0 0 18 0, 0.0 2,-1.8 0, 0.0 -1,-0.1 -0.108 23.4-136.5 -51.4 131.5 -2.5 51.6 -8.9 10 11 A N + 0 0 61 12,-0.1 2,-0.0 -3,-0.1 -2,-0.0 -0.445 47.3 173.9 -83.4 64.8 -3.2 52.2 -5.3 11 12 A F - 0 0 16 -2,-1.8 11,-3.2 10,-0.1 2,-0.4 -0.268 30.1-136.5 -72.8 149.7 -6.0 54.5 -6.2 12 13 A E E +B 21 0B 132 9,-0.2 2,-0.3 10,-0.1 9,-0.2 -0.938 35.3 157.8-106.8 142.5 -8.6 56.2 -4.0 13 14 A A E -B 20 0B 14 7,-2.2 7,-3.2 -2,-0.4 2,-0.2 -0.989 40.2-114.5-159.2 147.2 -12.2 56.2 -5.1 14 15 A D + 0 0 73 85,-0.4 85,-2.3 -2,-0.3 2,-0.3 -0.606 43.3 158.7 -82.0 156.1 -15.8 56.4 -3.9 15 16 A S B > -C 98 0C 1 83,-0.3 3,-1.7 -2,-0.2 83,-0.2 -0.879 59.0 -73.4-162.0-179.9 -18.0 53.4 -4.3 16 17 A T T 3 S+ 0 0 27 81,-1.0 3,-0.1 1,-0.3 82,-0.1 0.498 133.0 46.0 -68.8 -8.2 -21.2 51.8 -3.0 17 18 A I T 3 S- 0 0 105 1,-0.5 -1,-0.3 80,-0.1 2,-0.1 0.155 123.3-103.5-116.5 13.1 -19.3 50.9 0.3 18 19 A G < - 0 0 25 -3,-1.7 -1,-0.5 2,-0.1 2,-0.1 -0.436 67.4 -14.9 92.3-171.5 -17.7 54.4 0.6 19 20 A K - 0 0 185 -5,-0.2 2,-0.3 -2,-0.1 -5,-0.3 -0.434 67.9-177.2 -71.1 138.0 -14.3 55.7 -0.2 20 21 A L E -B 13 0B 17 -7,-3.2 -7,-2.2 -2,-0.1 2,-0.5 -0.977 29.4-138.3-136.5 154.9 -11.6 53.0 -0.6 21 22 A K E >> -B 12 0B 64 -2,-0.3 4,-3.0 -9,-0.2 3,-0.5 -0.960 27.9-135.3-109.1 123.4 -7.9 52.8 -1.2 22 23 A F H 3> S+ 0 0 2 -11,-3.2 4,-2.7 -2,-0.5 5,-0.2 0.850 100.0 44.3 -56.9 -46.1 -7.3 50.0 -3.7 23 24 A H H 3> S+ 0 0 39 2,-0.2 4,-1.8 1,-0.2 -1,-0.2 0.821 117.3 49.4 -69.6 -26.9 -4.3 48.1 -2.1 24 25 A D H <4 S+ 0 0 124 -3,-0.5 -2,-0.2 2,-0.2 -1,-0.2 0.947 112.6 45.6 -71.1 -56.3 -6.1 48.4 1.3 25 26 A W H < S+ 0 0 49 -4,-3.0 -2,-0.2 1,-0.2 -3,-0.2 0.920 118.0 42.8 -50.9 -51.8 -9.4 47.1 -0.1 26 27 A L H < S+ 0 0 0 -4,-2.7 -2,-0.2 -5,-0.2 -1,-0.2 0.895 84.5 170.3 -65.7 -42.7 -7.7 44.2 -2.0 27 28 A G < - 0 0 24 -4,-1.8 2,-1.8 -5,-0.2 109,-0.1 -0.245 63.1 -20.1 59.7-153.3 -5.3 43.1 0.7 28 29 A N S S+ 0 0 153 107,-0.1 2,-0.3 108,-0.0 -1,-0.2 -0.431 114.1 101.1 -81.8 56.3 -3.3 39.9 0.4 29 30 A S S S- 0 0 20 -2,-1.8 107,-0.3 104,-0.2 2,-0.2 -0.951 77.1-102.4-141.0 154.6 -5.7 38.4 -2.2 30 31 A W E -d 63 0C 36 32,-0.9 34,-2.5 -2,-0.3 2,-0.3 -0.502 47.7-173.2 -63.0 151.5 -6.4 37.7 -5.8 31 32 A G E -dE 64 132C 1 101,-2.4 101,-2.8 32,-0.2 2,-0.4 -0.996 24.5-151.8-148.8 153.8 -8.8 40.3 -7.2 32 33 A V E -dE 65 131C 1 32,-3.0 34,-2.3 -2,-0.3 2,-0.5 -0.993 10.3-172.4-126.4 121.4 -10.8 41.0 -10.3 33 34 A L E +dE 66 130C 1 97,-2.3 97,-3.1 -2,-0.4 2,-0.4 -0.968 14.1 175.8-105.1 129.5 -11.7 44.6 -11.2 34 35 A F E -dE 67 129C 0 32,-2.6 34,-0.9 -2,-0.5 2,-0.3 -0.988 12.7-152.6-136.4 148.1 -14.1 44.9 -14.2 35 36 A S E -d 68 0C 1 93,-1.8 34,-0.2 -2,-0.4 32,-0.0 -0.749 6.9-168.2-117.5 161.2 -15.8 47.9 -15.8 36 37 A H - 0 0 0 32,-2.1 89,-0.4 -2,-0.3 34,-0.3 -0.957 29.9-117.8-139.9 157.4 -19.0 48.6 -17.8 37 38 A P S S- 0 0 6 0, 0.0 33,-0.5 0, 0.0 88,-0.4 0.908 82.2 -6.7 -66.4 -41.0 -20.0 51.7 -19.8 38 39 A R - 0 0 92 31,-0.1 3,-0.4 86,-0.1 6,-0.2 -0.978 64.2-115.1-162.3 132.4 -23.1 53.0 -18.0 39 40 A D S S+ 0 0 5 -2,-0.3 37,-0.1 1,-0.2 5,-0.0 -0.181 99.5 36.9 -58.8 164.0 -25.5 52.0 -15.3 40 41 A F S S+ 0 0 29 1,-0.2 -1,-0.2 35,-0.1 36,-0.0 0.848 89.8 124.6 52.5 40.7 -29.1 51.3 -16.3 41 42 A T > - 0 0 23 -3,-0.4 4,-1.9 1,-0.1 -1,-0.2 -0.948 63.1-124.8-128.9 154.7 -28.0 49.7 -19.7 42 43 A P H > S+ 0 0 6 0, 0.0 4,-1.9 0, 0.0 5,-0.2 0.929 101.9 40.9 -75.4 -53.3 -29.0 46.2 -20.9 43 44 A V H > S+ 0 0 4 1,-0.2 4,-1.5 2,-0.2 352,-0.4 0.928 116.0 53.3 -58.8 -42.8 -25.8 44.3 -21.7 44 45 A S H > S+ 0 0 0 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.886 106.7 52.8 -61.2 -39.3 -24.2 45.7 -18.6 45 46 A T H X S+ 0 0 0 -4,-1.9 4,-2.0 1,-0.2 -1,-0.2 0.895 108.0 49.8 -63.1 -42.7 -27.1 44.5 -16.4 46 47 A T H X S+ 0 0 21 -4,-1.9 4,-2.1 2,-0.2 -1,-0.2 0.797 112.6 49.8 -62.6 -28.6 -26.8 40.9 -17.7 47 48 A E H X S+ 0 0 0 -4,-1.5 4,-2.1 2,-0.2 -2,-0.2 0.964 111.8 43.1 -79.3 -50.9 -23.1 41.0 -16.9 48 49 A L H X S+ 0 0 0 -4,-2.6 4,-1.7 1,-0.2 -2,-0.2 0.837 115.3 53.7 -65.5 -29.3 -23.3 42.3 -13.4 49 50 A G H X S+ 0 0 3 -4,-2.0 4,-2.1 -5,-0.2 -1,-0.2 0.908 106.7 50.4 -63.3 -47.2 -26.2 39.8 -13.0 50 51 A R H X S+ 0 0 26 -4,-2.1 4,-1.6 2,-0.2 -2,-0.2 0.849 106.4 55.6 -56.2 -37.3 -24.0 36.9 -14.2 51 52 A V H < S+ 0 0 0 -4,-2.1 3,-0.3 2,-0.2 4,-0.2 0.936 105.0 53.0 -68.2 -44.6 -21.3 37.9 -11.7 52 53 A I H >< S+ 0 0 8 -4,-1.7 3,-1.4 1,-0.2 4,-0.3 0.940 107.4 51.6 -50.1 -47.3 -23.9 37.6 -8.9 53 54 A Q H 3< S+ 0 0 60 -4,-2.1 3,-0.4 1,-0.2 -1,-0.2 0.871 115.5 42.1 -53.4 -38.8 -24.7 34.1 -10.2 54 55 A L T 3X S+ 0 0 6 -4,-1.6 4,-1.9 -3,-0.3 3,-0.4 0.169 80.2 109.3 -95.9 13.4 -20.9 33.2 -10.1 55 56 A E H <> S+ 0 0 69 -3,-1.4 4,-2.6 1,-0.3 -1,-0.2 0.883 76.8 50.9 -72.3 -33.1 -20.1 34.8 -6.8 56 57 A G H > S+ 0 0 31 -3,-0.4 4,-2.5 -4,-0.3 -1,-0.3 0.793 107.5 56.6 -63.5 -32.0 -19.5 31.6 -4.9 57 58 A D H > S+ 0 0 65 -3,-0.4 4,-0.7 2,-0.2 -2,-0.2 0.883 111.2 42.0 -67.2 -41.4 -17.2 30.4 -7.7 58 59 A F H ><>S+ 0 0 0 -4,-1.9 5,-2.3 2,-0.2 3,-0.9 0.943 114.4 51.4 -68.2 -47.4 -15.0 33.5 -7.2 59 60 A K H ><5S+ 0 0 155 -4,-2.6 3,-1.7 1,-0.3 -2,-0.2 0.882 104.5 56.9 -56.1 -42.9 -15.3 33.2 -3.4 60 61 A K H 3<5S+ 0 0 186 -4,-2.5 -1,-0.3 1,-0.3 -2,-0.2 0.761 109.5 47.4 -56.5 -32.1 -14.2 29.5 -3.6 61 62 A R T <<5S- 0 0 64 -3,-0.9 -1,-0.3 -4,-0.7 -2,-0.2 0.358 116.2-113.6 -91.7 3.5 -11.0 30.7 -5.4 62 63 A G T < 5 + 0 0 43 -3,-1.7 -32,-0.9 -4,-0.3 2,-0.7 0.794 66.4 150.1 65.0 33.8 -10.2 33.5 -2.9 63 64 A V E < -d 30 0C 8 -5,-2.3 2,-0.3 -34,-0.1 -32,-0.2 -0.870 37.9-149.0-105.9 108.0 -11.0 36.1 -5.6 64 65 A K E -d 31 0C 89 -34,-2.5 -32,-3.0 -2,-0.7 2,-0.4 -0.555 15.9-145.2 -67.6 134.7 -12.3 39.5 -4.5 65 66 A L E +d 32 0C 15 29,-0.3 2,-0.3 -2,-0.3 -32,-0.2 -0.825 20.7 174.3-106.5 138.1 -14.6 41.2 -7.0 66 67 A I E -d 33 0C 1 -34,-2.3 -32,-2.6 -2,-0.4 2,-0.2 -0.984 12.9-156.6-145.1 129.8 -15.0 44.9 -7.8 67 68 A A E -df 34 97C 0 29,-2.4 31,-2.7 -2,-0.3 2,-0.3 -0.568 12.3-168.5 -97.6 161.6 -17.1 46.6 -10.6 68 69 A L E +df 35 98C 0 -34,-0.9 -32,-2.1 29,-0.2 2,-0.3 -0.965 15.6 153.9-152.1 136.8 -16.5 50.1 -12.0 69 70 A S E - f 0 99C 0 29,-1.8 31,-3.6 -2,-0.3 -31,-0.1 -0.953 51.8-105.8-147.2 176.7 -18.2 52.7 -14.2 70 71 A C S S+ 0 0 4 -33,-0.5 29,-0.1 -34,-0.3 -32,-0.1 0.446 84.8 106.6 -82.1 5.8 -18.1 56.5 -14.7 71 72 A D S S- 0 0 12 27,-0.2 -2,-0.2 1,-0.1 30,-0.2 -0.291 75.3 -98.4 -79.5 160.2 -21.6 56.9 -12.9 72 73 A N > - 0 0 57 1,-0.1 4,-1.7 28,-0.1 3,-0.1 -0.255 31.9-109.8 -75.4 167.3 -22.3 58.3 -9.4 73 74 A V H > S+ 0 0 19 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.811 114.7 59.9 -69.6 -30.6 -22.8 56.2 -6.4 74 75 A A H > S+ 0 0 70 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.932 107.4 46.9 -66.7 -38.1 -26.5 57.0 -6.1 75 76 A D H > S+ 0 0 49 2,-0.2 4,-3.2 1,-0.2 5,-0.4 0.924 108.7 56.1 -66.7 -38.9 -27.1 55.5 -9.6 76 77 A H H X S+ 0 0 0 -4,-1.7 4,-2.2 1,-0.2 -2,-0.2 0.915 110.1 45.7 -57.6 -43.7 -25.0 52.4 -8.6 77 78 A K H X S+ 0 0 122 -4,-2.4 4,-0.7 2,-0.2 -1,-0.2 0.908 115.9 43.2 -67.0 -45.3 -27.3 51.7 -5.6 78 79 A E H >X S+ 0 0 86 -4,-2.1 3,-1.1 1,-0.2 4,-0.6 0.940 117.9 45.9 -67.4 -47.8 -30.6 52.2 -7.5 79 80 A W H >X S+ 0 0 0 -4,-3.2 4,-2.5 1,-0.3 3,-1.0 0.844 98.4 71.8 -63.0 -37.0 -29.3 50.2 -10.5 80 81 A S H 3X S+ 0 0 6 -4,-2.2 4,-2.4 -5,-0.4 -1,-0.3 0.832 91.6 58.2 -44.0 -38.6 -28.0 47.5 -8.3 81 82 A E H S+ 0 0 39 -4,-2.4 4,-1.1 2,-0.2 5,-0.6 0.942 110.0 53.8 -63.7 -47.2 -30.2 41.7 -8.5 85 86 A C H ><5S+ 0 0 45 -4,-1.9 3,-1.1 1,-0.2 -1,-0.2 0.959 111.6 44.0 -51.6 -55.4 -33.5 41.2 -10.1 86 87 A L H 3<5S+ 0 0 16 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.802 107.7 57.7 -66.2 -30.5 -32.0 40.0 -13.3 87 88 A S H 3<5S- 0 0 4 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.733 99.1-138.7 -66.8 -23.1 -29.5 37.7 -11.6 88 89 A G T <<5 + 0 0 40 -4,-1.1 2,-0.4 -3,-1.1 -3,-0.1 0.465 64.6 121.6 72.5 4.7 -32.4 35.9 -9.9 89 90 A V < - 0 0 63 -5,-0.6 2,-0.3 -40,-0.1 -1,-0.2 -0.834 54.4-147.4 -99.9 131.4 -30.3 35.8 -6.7 90 91 A K + 0 0 209 -2,-0.4 2,-0.2 -3,-0.1 -5,-0.0 -0.728 53.7 72.0 -96.3 147.1 -31.8 37.5 -3.6 91 92 A G S S- 0 0 50 -2,-0.3 -2,-0.1 2,-0.0 -7,-0.0 -0.562 85.1 -50.2 131.3 162.0 -29.4 39.1 -1.2 92 93 A D S S- 0 0 147 -2,-0.2 0, 0.0 1,-0.2 0, 0.0 -0.190 74.4 -78.5 -60.6 160.5 -27.1 42.1 -0.8 93 94 A M - 0 0 43 1,-0.2 -1,-0.2 2,-0.0 -12,-0.0 -0.382 34.0-147.1 -61.1 127.9 -24.6 42.9 -3.6 94 95 A P S S+ 0 0 46 0, 0.0 -29,-0.3 0, 0.0 -1,-0.2 0.445 78.5 33.0 -81.4 7.0 -21.6 40.6 -3.2 95 96 A Y S S- 0 0 9 -31,-0.1 -29,-0.2 -29,-0.0 2,-0.1 -0.986 79.9-111.9-154.8 153.7 -19.2 43.3 -4.6 96 97 A P - 0 0 10 0, 0.0 -29,-2.4 0, 0.0 2,-0.5 -0.369 21.8-139.8 -79.5 159.3 -18.7 47.1 -4.5 97 98 A I E - f 0 67C 0 -31,-0.2 -81,-1.0 -2,-0.1 -29,-0.2 -0.984 14.4-142.2-120.9 117.8 -19.1 49.4 -7.6 98 99 A I E -Cf 15 68C 0 -31,-2.7 -29,-1.8 -2,-0.5 2,-0.6 -0.535 7.3-140.7 -71.3 144.4 -16.6 52.2 -8.0 99 100 A A E - f 0 69C 11 -85,-2.3 2,-1.2 -2,-0.2 -85,-0.4 -0.916 14.9-173.0-106.1 105.0 -17.8 55.5 -9.3 100 101 A D > + 0 0 6 -31,-3.6 3,-1.9 -2,-0.6 6,-0.2 -0.396 24.4 153.1 -96.3 57.3 -15.1 56.9 -11.7 101 102 A E T 3 + 0 0 101 -2,-1.2 -1,-0.2 1,-0.3 -31,-0.1 0.780 69.9 50.9 -62.0 -28.6 -16.9 60.2 -12.2 102 103 A T T 3 S- 0 0 111 -3,-0.3 -1,-0.3 1,-0.0 -2,-0.1 0.450 104.7-126.5 -85.0 -2.1 -13.7 62.2 -13.0 103 104 A R S <> S+ 0 0 28 -3,-1.9 4,-2.5 -33,-0.1 5,-0.2 0.522 70.1 132.9 60.0 13.2 -12.6 59.6 -15.6 104 105 A E H > S+ 0 0 123 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.932 76.4 34.5 -51.4 -56.1 -9.2 59.3 -13.7 105 106 A L H > S+ 0 0 4 2,-0.2 4,-3.0 1,-0.2 6,-0.3 0.887 111.8 60.8 -74.0 -42.0 -9.2 55.5 -13.7 106 107 A A H 4>S+ 0 0 0 2,-0.2 5,-2.3 1,-0.2 6,-0.4 0.947 115.6 35.9 -44.7 -50.2 -10.8 55.2 -17.2 107 108 A V H ><5S+ 0 0 94 -4,-2.5 3,-1.6 3,-0.2 -2,-0.2 0.959 116.9 50.2 -75.2 -54.0 -7.8 57.1 -18.5 108 109 A K H 3<5S+ 0 0 123 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.876 114.6 44.5 -50.4 -43.2 -5.1 55.7 -16.3 109 110 A L T 3<5S- 0 0 4 -4,-3.0 -107,-0.5 -5,-0.2 -1,-0.3 0.465 108.9-122.3 -88.6 4.9 -6.1 52.1 -16.9 110 111 A G T < 5S+ 0 0 9 -3,-1.6 115,-0.3 -4,-0.2 -3,-0.2 0.871 72.8 128.2 60.7 37.7 -6.5 52.7 -20.8 111 112 A M < + 0 0 1 -5,-2.3 15,-2.5 -6,-0.3 2,-0.2 0.044 19.6 136.5-115.1 26.7 -10.2 51.5 -20.6 112 113 A V E -N 125 0D 47 -6,-0.4 13,-0.3 13,-0.3 113,-0.3 -0.548 58.9-116.5 -73.1 132.5 -12.1 54.4 -22.4 113 114 A D E - 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