==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-JUL-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE, LYASE 12-AUG-01 1JR7 . COMPND 2 MOLECULE: HYPOTHETICAL 37.4 KDA PROTEIN IN ILEY-GABD INTERG . SOURCE 2 ORGANISM_SCIENTIFIC: ESCHERICHIA COLI; . AUTHOR C.D.LIMA,S.K.BURLEY,NEW YORK SGX RESEARCH CENTER FOR STRUCTU . 306 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15380.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 202 66.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 7 2.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 69 22.5 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 . 1 0.3 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 . 19 6.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 34 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 64 20.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), 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 . 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 1 1 0 0 0 1 1 0 1 0 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 PARALLEL BRIDGES PER LADDER . 3 2 4 1 4 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 ANTIPARALLEL BRIDGES PER LADDER . 1 1 1 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 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 15 A G 0 0 75 0, 0.0 8,-0.2 0, 0.0 9,-0.2 0.000 360.0 360.0 360.0 138.9 43.6 9.5 20.2 2 16 A Q - 0 0 119 6,-0.1 7,-1.9 1,-0.1 2,-0.5 0.303 360.0-133.9 -39.9 144.5 46.8 8.8 18.2 3 17 A D B +A 8 0A 129 5,-0.2 2,-0.2 3,-0.0 5,-0.2 -0.902 28.5 177.5-104.5 118.9 50.0 7.7 19.8 4 18 A Y - 0 0 39 3,-2.0 2,-0.8 -2,-0.5 3,-0.5 -0.641 44.5 -77.0-113.4 177.7 53.1 9.5 18.7 5 19 A S S S- 0 0 48 56,-0.3 59,-0.2 1,-0.2 60,-0.1 -0.696 116.0 -2.3 -81.2 109.4 56.8 9.2 19.8 6 20 A G S S+ 0 0 14 -2,-0.8 18,-2.2 1,-0.1 2,-0.3 0.296 129.5 42.6 98.0 -8.2 57.0 11.0 23.1 7 21 A F E - B 0 23A 0 -3,-0.5 -3,-2.0 16,-0.3 2,-0.3 -0.978 65.2-132.1-157.3 168.9 53.5 12.3 23.4 8 22 A T E -AB 3 22A 51 14,-2.2 14,-2.4 -2,-0.3 2,-0.4 -0.912 15.3-157.4-124.8 156.5 49.8 11.5 23.0 9 23 A L E + B 0 21A 12 -7,-1.9 12,-0.2 -2,-0.3 10,-0.0 -0.978 18.0 162.2-139.2 119.8 47.1 13.5 21.2 10 24 A T E - B 0 20A 53 10,-2.0 10,-3.5 -2,-0.4 -2,-0.0 -0.984 42.0 -96.6-138.1 151.4 43.3 13.3 21.8 11 25 A P E - B 0 19A 80 0, 0.0 8,-0.2 0, 0.0 6,-0.1 -0.321 45.1-114.9 -63.9 143.8 40.3 15.5 21.0 12 26 A S - 0 0 12 6,-2.8 6,-0.1 3,-0.9 5,-0.0 -0.252 16.2-117.7 -72.0 170.6 39.2 17.7 23.9 13 27 A A S S+ 0 0 100 1,-0.2 -1,-0.1 3,-0.1 244,-0.0 0.562 113.3 55.0 -82.5 -14.4 35.8 17.4 25.6 14 28 A Q S S- 0 0 64 1,-0.3 -1,-0.2 4,-0.1 3,-0.1 0.763 124.6 -16.1 -88.9 -28.0 34.8 20.9 24.5 15 29 A S > - 0 0 9 3,-0.3 3,-1.2 1,-0.1 -3,-0.9 -0.910 46.8-125.3-173.2 146.3 35.4 20.3 20.8 16 30 A P T 3 S+ 0 0 101 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.733 109.5 67.0 -68.3 -18.9 37.0 18.1 18.2 17 31 A R T 3 S+ 0 0 50 1,-0.1 63,-0.8 61,-0.1 2,-0.7 0.738 91.5 68.5 -73.0 -23.4 38.7 21.2 16.8 18 32 A L E < S- c 0 80A 0 -3,-1.2 -6,-2.8 61,-0.1 2,-0.4 -0.894 73.1-162.6-101.5 112.7 40.8 21.5 20.0 19 33 A L E -Bc 11 81A 16 61,-2.3 63,-2.4 -2,-0.7 2,-0.6 -0.763 11.5-138.9 -98.7 140.9 43.4 18.7 20.4 20 34 A E E -Bc 10 82A 48 -10,-3.5 -10,-2.0 -2,-0.4 2,-0.5 -0.864 17.2-166.8 -99.8 119.0 45.0 17.9 23.7 21 35 A L E -Bc 9 83A 0 61,-2.7 63,-2.3 -2,-0.6 2,-0.5 -0.936 5.2-175.1-109.4 120.9 48.7 17.1 23.5 22 36 A T E -Bc 8 84A 31 -14,-2.4 -14,-2.2 -2,-0.5 2,-0.3 -0.962 17.5-142.9-120.2 123.6 50.5 15.5 26.5 23 37 A F E -Bc 7 85A 0 61,-2.7 63,-2.6 -2,-0.5 -16,-0.3 -0.649 31.7-113.7 -79.8 135.5 54.2 14.8 26.6 24 38 A T > - 0 0 56 -18,-2.2 4,-2.7 -2,-0.3 5,-0.2 -0.228 23.4-107.7 -66.4 164.2 55.0 11.5 28.4 25 39 A E H > S+ 0 0 138 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.898 119.8 50.6 -56.7 -45.7 56.8 11.4 31.7 26 40 A Q H > S+ 0 0 141 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.942 111.2 48.0 -60.5 -47.7 60.0 10.1 30.1 27 41 A T H > S+ 0 0 4 2,-0.2 4,-2.6 1,-0.2 -2,-0.2 0.939 112.8 48.8 -56.9 -49.2 60.0 12.8 27.5 28 42 A T H X S+ 0 0 8 -4,-2.7 4,-2.7 1,-0.2 5,-0.3 0.960 111.6 48.4 -57.5 -51.2 59.4 15.5 30.1 29 43 A K H X S+ 0 0 127 -4,-2.7 4,-2.1 1,-0.2 -1,-0.2 0.918 113.7 46.5 -56.6 -47.6 62.2 14.2 32.4 30 44 A Q H X S+ 0 0 56 -4,-2.7 4,-2.6 2,-0.2 -1,-0.2 0.890 112.0 51.0 -65.0 -38.4 64.7 14.0 29.5 31 45 A F H X S+ 0 0 3 -4,-2.6 4,-1.3 -5,-0.2 -2,-0.2 0.945 110.7 47.8 -62.6 -48.2 63.8 17.4 28.2 32 46 A L H X S+ 0 0 41 -4,-2.7 4,-0.6 2,-0.2 3,-0.5 0.913 112.5 50.3 -61.0 -40.3 64.2 19.0 31.6 33 47 A E H >< S+ 0 0 105 -4,-2.1 3,-0.8 -5,-0.3 4,-0.3 0.940 111.6 48.5 -57.2 -50.2 67.6 17.2 31.9 34 48 A Q H 3< S+ 0 0 87 -4,-2.6 -1,-0.2 1,-0.2 -2,-0.2 0.652 116.9 39.6 -72.4 -13.4 68.7 18.4 28.5 35 49 A V H >< S+ 0 0 0 -4,-1.3 3,-1.7 -3,-0.5 -1,-0.2 0.306 83.1 102.7-117.4 9.3 67.8 22.1 29.1 36 50 A A T << S+ 0 0 66 -3,-0.8 -2,-0.1 -4,-0.6 -1,-0.1 0.849 70.5 67.0 -61.9 -32.0 68.9 22.4 32.7 37 51 A E T 3 S+ 0 0 140 -4,-0.3 -1,-0.3 1,-0.2 -2,-0.1 0.669 94.8 66.2 -64.7 -16.4 72.1 24.3 31.7 38 52 A W S < S- 0 0 21 -3,-1.7 -1,-0.2 11,-0.0 5,-0.1 -0.882 72.5-155.4-112.5 107.7 70.0 27.2 30.5 39 53 A P >> - 0 0 63 0, 0.0 4,-1.3 0, 0.0 3,-1.1 -0.275 38.0-103.9 -63.1 165.3 68.1 29.2 33.1 40 54 A V H 3> S+ 0 0 0 1,-0.3 4,-2.1 2,-0.2 5,-0.2 0.853 123.0 65.1 -60.9 -31.8 65.1 31.1 31.8 41 55 A Q H 3> S+ 0 0 91 1,-0.2 4,-1.7 2,-0.2 -1,-0.3 0.843 97.7 53.4 -59.4 -35.9 67.2 34.2 32.0 42 56 A A H <> S+ 0 0 21 -3,-1.1 4,-2.9 2,-0.2 -1,-0.2 0.929 108.0 49.6 -67.5 -42.5 69.6 32.8 29.4 43 57 A L H < S+ 0 0 0 -4,-1.3 7,-0.3 1,-0.2 -2,-0.2 0.851 109.6 53.2 -63.6 -34.8 66.6 32.3 27.0 44 58 A E H < S+ 0 0 32 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.881 116.6 37.3 -65.8 -39.5 65.5 35.9 27.7 45 59 A Y H < S+ 0 0 203 -4,-1.7 2,-0.6 1,-0.2 -2,-0.2 0.840 120.1 43.0 -84.2 -37.9 68.9 37.3 26.7 46 60 A K >< - 0 0 105 -4,-2.9 3,-2.0 1,-0.1 4,-0.4 -0.868 65.0-168.1-114.8 98.1 69.9 35.0 23.9 47 61 A S T >> S+ 0 0 47 -2,-0.6 3,-1.3 1,-0.3 4,-0.8 0.760 82.0 68.9 -59.4 -26.3 67.0 34.4 21.5 48 62 A F H 3> S+ 0 0 129 1,-0.3 4,-2.0 2,-0.2 -1,-0.3 0.775 90.1 65.1 -63.2 -23.3 68.7 31.6 19.6 49 63 A L H <> S+ 0 0 2 -3,-2.0 4,-2.8 1,-0.2 -1,-0.3 0.813 91.2 63.4 -68.7 -25.8 68.3 29.5 22.8 50 64 A R H <> S+ 0 0 18 -3,-1.3 4,-1.3 -4,-0.4 56,-0.2 0.923 108.3 41.2 -62.9 -42.1 64.5 29.6 22.4 51 65 A F H X S+ 0 0 84 -4,-0.8 4,-2.4 -3,-0.2 -2,-0.2 0.884 111.5 57.0 -72.1 -38.7 64.9 27.7 19.1 52 66 A R H X S+ 0 0 130 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.942 105.2 49.5 -60.5 -44.3 67.6 25.4 20.6 53 67 A V H X S+ 0 0 0 -4,-2.8 4,-2.2 1,-0.2 -1,-0.2 0.893 110.0 53.5 -63.1 -33.6 65.2 24.2 23.4 54 68 A A H X S+ 0 0 1 -4,-1.3 4,-2.8 -5,-0.2 5,-0.2 0.935 107.5 49.8 -61.4 -48.6 62.6 23.6 20.7 55 69 A K H X S+ 0 0 122 -4,-2.4 4,-2.8 1,-0.2 5,-0.3 0.922 108.9 53.1 -55.3 -48.2 65.1 21.4 18.8 56 70 A I H X S+ 0 0 18 -4,-2.5 4,-1.7 1,-0.2 -2,-0.2 0.951 112.0 44.4 -54.8 -49.8 65.9 19.4 22.0 57 71 A L H X S+ 0 0 2 -4,-2.2 4,-0.8 2,-0.2 -2,-0.2 0.934 114.7 48.0 -62.4 -45.2 62.2 18.7 22.6 58 72 A D H ><>S+ 0 0 8 -4,-2.8 5,-2.5 1,-0.2 3,-1.0 0.914 109.2 53.2 -64.0 -40.0 61.4 17.8 19.0 59 73 A D H ><5S+ 0 0 66 -4,-2.8 3,-1.5 1,-0.3 -1,-0.2 0.902 104.3 57.3 -61.0 -34.7 64.5 15.5 18.8 60 74 A L H 3<5S+ 0 0 31 -4,-1.7 -1,-0.3 1,-0.3 -2,-0.2 0.733 104.7 51.9 -69.0 -21.1 63.2 13.7 21.9 61 75 A C T X<5S- 0 0 0 -3,-1.0 3,-2.3 -4,-0.8 -56,-0.3 -0.084 123.6-105.0-102.9 28.3 59.9 13.0 20.0 62 76 A A T < 5 - 0 0 52 -3,-1.5 -3,-0.2 1,-0.3 -2,-0.1 0.842 70.0 -66.5 52.1 36.6 61.8 11.5 17.1 63 77 A N T 3 + 0 0 79 -3,-2.3 4,-1.1 -6,-0.4 -2,-0.1 0.541 61.8 68.8 -97.7 -10.0 57.4 14.0 15.0 65 79 A L H > S+ 0 0 0 -7,-0.4 4,-2.9 2,-0.2 5,-0.2 0.974 93.4 51.9 -75.2 -52.7 56.5 16.9 17.2 66 80 A Q H > S+ 0 0 76 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.907 112.6 44.6 -50.6 -54.4 57.3 19.8 14.8 67 81 A P H > S+ 0 0 71 0, 0.0 4,-2.7 0, 0.0 -1,-0.2 0.877 114.3 49.7 -60.9 -39.5 55.3 18.5 11.9 68 82 A L H X S+ 0 0 7 -4,-1.1 4,-2.4 2,-0.2 5,-0.2 0.928 110.0 49.8 -67.7 -43.9 52.3 17.6 14.1 69 83 A L H X S+ 0 0 0 -4,-2.9 4,-2.6 2,-0.2 5,-0.2 0.951 115.5 44.7 -56.4 -48.0 52.2 21.0 15.8 70 84 A L H X S+ 0 0 22 -4,-2.3 4,-2.8 -5,-0.2 5,-0.2 0.936 112.1 49.6 -64.2 -48.7 52.3 22.7 12.4 71 85 A K H X S+ 0 0 133 -4,-2.7 4,-0.9 1,-0.2 -1,-0.2 0.901 114.7 46.5 -56.7 -43.7 49.7 20.5 10.7 72 86 A T H < S+ 0 0 1 -4,-2.4 7,-1.9 -5,-0.2 3,-0.4 0.944 114.7 44.5 -66.5 -48.6 47.4 21.1 13.6 73 87 A L H < S+ 0 0 0 -4,-2.6 -2,-0.2 1,-0.2 -1,-0.2 0.846 117.2 44.8 -67.0 -33.3 47.8 24.8 13.8 74 88 A L H < S+ 0 0 72 -4,-2.8 2,-0.7 -5,-0.2 -1,-0.2 0.575 88.3 103.2 -85.6 -11.9 47.5 25.4 10.1 75 89 A N >< - 0 0 62 -4,-0.9 3,-1.6 -3,-0.4 5,-0.1 -0.623 63.7-151.4 -76.1 115.6 44.5 23.0 9.7 76 90 A R T 3 S+ 0 0 11 -2,-0.7 100,-0.2 1,-0.3 -1,-0.2 0.846 95.5 57.0 -53.8 -36.8 41.4 25.2 9.3 77 91 A A T 3 S+ 0 0 50 -3,-0.1 -1,-0.3 2,-0.0 -5,-0.1 0.747 127.6 11.2 -70.3 -20.9 39.3 22.4 10.8 78 92 A E < + 0 0 45 -3,-1.6 -5,-0.1 -6,-0.2 -61,-0.1 0.434 62.1 157.2-117.3-101.4 41.4 22.4 14.0 79 93 A G + 0 0 0 -7,-1.9 189,-2.6 1,-0.1 2,-0.3 0.552 55.2 87.4 84.7 8.0 44.0 25.2 14.7 80 94 A A E -cD 18 267A 0 -63,-0.8 -61,-2.3 187,-0.2 2,-0.3 -0.994 47.7-175.2-146.5 137.5 44.1 24.8 18.4 81 95 A L E -cD 19 266A 0 185,-2.6 185,-2.6 -2,-0.3 2,-0.5 -0.967 17.1-154.9-128.1 149.3 46.0 22.8 21.0 82 96 A L E -cD 20 265A 5 -63,-2.4 -61,-2.7 -2,-0.3 2,-0.4 -0.996 33.2-166.8-117.3 112.6 45.9 22.4 24.8 83 97 A I E +cD 21 264A 0 181,-3.2 181,-1.8 -2,-0.5 2,-0.3 -0.887 18.6 154.9-116.9 143.7 49.4 21.2 25.8 84 98 A N E -c 22 0A 26 -63,-2.3 -61,-2.7 -2,-0.4 2,-0.4 -0.978 29.3-136.7-153.7 165.6 50.9 19.7 28.9 85 99 A A E > -c 23 0A 2 3,-0.5 3,-2.2 177,-0.3 -61,-0.2 -0.998 33.6-111.6-129.5 124.1 53.8 17.6 30.0 86 100 A V T 3 S+ 0 0 63 -63,-2.6 -57,-0.1 -2,-0.4 -58,-0.1 -0.379 105.3 25.5 -55.3 127.0 53.4 14.9 32.7 87 101 A G T 3 S+ 0 0 37 -2,-0.1 2,-0.7 1,-0.1 -1,-0.3 0.237 97.8 95.0 102.9 -15.3 55.2 15.9 35.8 88 102 A V < + 0 0 4 -3,-2.2 -3,-0.5 1,-0.1 -1,-0.1 -0.889 47.1 112.6-108.8 96.8 55.1 19.7 35.2 89 103 A D + 0 0 103 -2,-0.7 2,-0.3 1,-0.1 172,-0.1 0.208 48.4 79.7-156.9 25.3 52.0 20.8 37.1 90 104 A D S > S- 0 0 76 -3,-0.1 3,-2.6 1,-0.1 -1,-0.1 -0.999 76.2-117.9-140.3 146.4 52.8 23.0 40.1 91 105 A V G > S+ 0 0 44 -2,-0.3 3,-1.5 1,-0.3 4,-0.1 0.762 109.5 70.5 -51.9 -29.1 53.6 26.7 40.5 92 106 A K G 3 S+ 0 0 161 1,-0.3 3,-0.3 2,-0.1 -1,-0.3 0.766 95.1 55.5 -62.0 -22.3 57.1 25.8 41.9 93 107 A Q G <> + 0 0 39 -3,-2.6 4,-2.2 1,-0.2 -1,-0.3 -0.050 67.4 127.2-100.7 31.8 58.0 24.6 38.4 94 108 A A H <> S+ 0 0 6 -3,-1.5 4,-2.5 1,-0.2 -1,-0.2 0.911 72.4 53.0 -57.4 -42.2 57.2 28.0 36.7 95 109 A D H > S+ 0 0 64 -3,-0.3 4,-2.3 1,-0.2 -1,-0.2 0.912 109.3 48.6 -60.5 -41.5 60.6 28.1 35.1 96 110 A E H > S+ 0 0 60 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.864 109.3 53.5 -65.5 -34.9 60.1 24.6 33.6 97 111 A M H X S+ 0 0 0 -4,-2.2 4,-2.6 2,-0.2 5,-0.2 0.932 109.1 48.4 -65.0 -45.0 56.7 25.7 32.3 98 112 A V H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.915 111.9 49.4 -60.8 -44.2 58.3 28.7 30.6 99 113 A K H X S+ 0 0 21 -4,-2.3 4,-2.9 1,-0.2 -2,-0.2 0.947 111.9 48.7 -61.6 -45.2 61.0 26.5 29.0 100 114 A L H X S+ 0 0 4 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.936 114.1 44.1 -59.6 -50.1 58.4 24.0 27.8 101 115 A A H X S+ 0 0 0 -4,-2.6 4,-2.6 2,-0.2 -1,-0.2 0.879 113.4 52.4 -63.9 -39.1 56.1 26.6 26.2 102 116 A T H X S+ 0 0 0 -4,-2.5 4,-2.5 -5,-0.2 -2,-0.2 0.937 108.2 50.9 -60.7 -48.5 59.1 28.3 24.7 103 117 A A H X S+ 0 0 0 -4,-2.9 4,-0.6 -5,-0.2 -2,-0.2 0.935 113.5 44.8 -55.2 -49.0 60.3 25.1 23.2 104 118 A V H >X S+ 0 0 0 -4,-2.3 3,-1.1 1,-0.2 4,-0.6 0.939 113.4 48.6 -62.9 -49.3 56.9 24.4 21.6 105 119 A A H >X S+ 0 0 0 -4,-2.6 4,-1.1 1,-0.2 3,-1.1 0.904 108.7 53.8 -59.3 -40.8 56.4 27.9 20.3 106 120 A H H 3< S+ 0 0 8 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.572 97.8 63.7 -79.8 -2.2 59.8 28.1 18.7 107 121 A L H << S+ 0 0 8 -3,-1.1 -1,-0.3 -4,-0.6 -2,-0.2 0.667 116.5 30.5 -82.2 -22.8 59.3 24.9 16.7 108 122 A I H << S- 0 0 0 -3,-1.1 189,-2.0 -4,-0.6 2,-0.3 0.538 133.0 -44.6-113.0 -6.6 56.5 26.6 14.8 109 123 A G E < -E 296 0A 3 -4,-1.1 2,-0.3 187,-0.3 187,-0.2 -0.873 68.8 -66.7 175.8-147.1 57.5 30.3 14.8 110 124 A R E -E 295 0A 66 185,-1.9 185,-1.5 -2,-0.3 2,-0.3 -0.987 34.8-126.6-143.6 134.6 58.9 33.1 17.0 111 125 A S E -E 294 0A 0 -2,-0.3 183,-0.3 183,-0.2 2,-0.1 -0.616 30.4-129.3 -81.9 133.4 57.4 34.8 20.0 112 126 A N - 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