==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=20-NOV-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 19-OCT-11 3U9O . COMPND 2 MOLECULE: THERMONUCLEASE; . SOURCE 2 ORGANISM_SCIENTIFIC: STAPHYLOCOCCUS AUREUS; . AUTHOR J.L.SCHLESSMAN,B.M.DOCTROW,B.GARCIA-MORENO E. . 124 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 7015.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 83 66.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 4 3.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 33 26.6 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 1.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 2.4 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 . 6 4.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 11 8.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 28 22.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 2 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 0 1 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 PARALLEL BRIDGES PER LADDER . 1 2 1 0 2 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 ANTIPARALLEL BRIDGES PER LADDER . 1 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 7 A L 0 0 99 0, 0.0 2,-0.4 0, 0.0 60,-0.1 0.000 360.0 360.0 360.0 158.2 -1.4 -37.6 7.6 2 8 A H - 0 0 121 58,-0.3 58,-0.5 59,-0.1 2,-0.3 -0.989 360.0-121.8-135.7 151.4 -4.5 -38.7 6.0 3 9 A K - 0 0 90 -2,-0.4 56,-0.2 56,-0.2 73,-0.0 -0.655 26.1-165.2 -84.6 137.8 -7.1 -37.4 3.6 4 10 A E E -A 58 0A 23 54,-2.6 54,-2.9 -2,-0.3 2,-0.0 -0.959 25.6-106.1-123.3 145.7 -10.7 -37.2 4.7 5 11 A P E +A 57 0A 108 0, 0.0 17,-0.5 0, 0.0 2,-0.3 -0.313 42.6 168.1 -65.5 147.6 -13.7 -36.7 2.4 6 12 A A E -A 56 0A 15 50,-2.2 50,-0.7 15,-0.1 2,-0.4 -0.947 26.1-132.4-150.6 166.9 -15.5 -33.3 2.4 7 13 A T E -B 20 0A 80 13,-2.0 13,-3.0 -2,-0.3 2,-0.2 -0.982 26.1-115.6-123.8 132.1 -18.1 -31.6 0.2 8 14 A L E +B 19 0A 49 -2,-0.4 11,-0.2 11,-0.2 3,-0.1 -0.498 36.1 166.5 -63.6 135.3 -17.8 -28.1 -1.1 9 15 A I E - 0 0 74 9,-2.5 2,-0.3 1,-0.3 10,-0.2 0.706 67.4 -12.5-106.3 -53.8 -20.4 -25.8 0.3 10 16 A K E -B 18 0A 121 8,-2.3 8,-3.7 40,-0.0 2,-0.4 -0.966 52.5-132.9-154.6 134.0 -19.0 -22.4 -0.7 11 17 A A E +B 17 0A 15 -2,-0.3 6,-0.2 6,-0.2 3,-0.1 -0.684 27.4 175.9 -78.4 131.0 -15.8 -20.9 -2.1 12 18 A I E - 0 0 79 4,-1.5 2,-0.2 1,-0.4 5,-0.2 0.840 51.8 -39.3-104.4 -63.2 -15.0 -17.8 -0.1 13 19 A D E > S-B 16 0A 63 3,-2.0 3,-0.9 29,-0.1 -1,-0.4 -0.793 79.2 -59.0-148.8-160.5 -11.7 -16.4 -1.2 14 20 A G T 3 S+ 0 0 2 25,-0.3 73,-0.1 1,-0.2 78,-0.0 0.817 132.7 15.6 -61.6 -37.8 -8.1 -17.4 -2.4 15 21 A N T 3 S+ 0 0 12 20,-0.1 15,-2.2 1,-0.0 2,-0.3 0.212 115.2 75.5-125.7 26.3 -7.3 -19.3 0.9 16 22 A T E < +BC 13 29A 8 -3,-0.9 -3,-2.0 13,-0.2 -4,-1.5 -0.999 49.3 167.5-141.4 132.9 -10.7 -19.8 2.6 17 23 A V E -BC 11 28A 0 11,-2.1 11,-3.4 -2,-0.3 2,-0.6 -0.990 30.5-130.7-146.8 141.7 -13.5 -22.3 1.7 18 24 A K E +BC 10 27A 75 -8,-3.7 -9,-2.5 -2,-0.3 -8,-2.3 -0.899 35.1 177.3 -97.2 127.9 -16.6 -23.4 3.4 19 25 A L E -BC 8 26A 0 7,-3.1 7,-2.3 -2,-0.6 2,-0.6 -0.894 36.8-123.0-125.6 152.7 -16.9 -27.2 3.4 20 26 A M E -BC 7 25A 67 -13,-3.0 -13,-2.0 -2,-0.3 2,-0.4 -0.886 41.1-178.7 -87.5 122.8 -19.3 -29.8 4.8 21 27 A Y E > - C 0 24A 26 3,-3.6 3,-1.8 -2,-0.6 -15,-0.1 -0.993 64.1 -15.6-134.9 122.7 -16.9 -31.9 6.9 22 28 A K T 3 S- 0 0 163 -17,-0.5 -1,-0.2 -2,-0.4 -16,-0.1 0.919 130.0 -53.8 43.4 54.2 -18.2 -34.9 8.9 23 29 A G T 3 S+ 0 0 57 1,-0.1 -1,-0.3 -3,-0.1 -3,-0.1 0.561 121.0 101.7 63.8 12.3 -21.7 -33.7 8.3 24 30 A Q E < S-C 21 0A 134 -3,-1.8 -3,-3.6 2,-0.0 2,-0.2 -0.978 75.1-118.1-125.1 137.1 -21.1 -30.2 9.8 25 31 A P E +C 20 0A 69 0, 0.0 2,-0.3 0, 0.0 -5,-0.2 -0.537 42.9 172.2 -66.4 140.9 -20.5 -26.9 7.8 26 32 A M E -C 19 0A 45 -7,-2.3 -7,-3.1 -2,-0.2 2,-0.4 -0.959 32.6-128.8-156.2 132.0 -17.0 -25.6 8.6 27 33 A V E -C 18 0A 39 -2,-0.3 45,-2.6 -9,-0.2 2,-0.4 -0.742 29.1-157.7 -82.3 129.7 -14.8 -22.7 7.2 28 34 A F E -Cd 17 72A 0 -11,-3.4 -11,-2.1 -2,-0.4 2,-0.5 -0.919 10.6-155.4-110.6 137.5 -11.3 -23.9 6.3 29 35 A R E -Cd 16 73A 59 43,-3.3 45,-1.4 -2,-0.4 -13,-0.2 -0.967 30.7-117.2-108.4 121.7 -8.1 -21.8 6.0 30 36 A L E > - d 0 74A 4 -15,-2.2 3,-1.0 -2,-0.5 45,-0.2 -0.486 34.9-114.3 -62.7 131.3 -5.5 -23.4 3.7 31 37 A L T 3 S+ 0 0 10 43,-1.9 45,-0.1 1,-0.2 -1,-0.1 -0.375 88.9 3.8 -68.4 137.7 -2.3 -24.2 5.6 32 38 A L T 3 S+ 0 0 11 65,-0.2 64,-1.9 1,-0.2 2,-0.5 0.558 97.9 121.8 74.0 13.2 0.8 -22.3 4.8 33 39 A V E < -H 95 0B 5 -3,-1.0 2,-0.4 62,-0.3 62,-0.2 -0.966 38.6-171.5-117.6 126.7 -0.7 -20.0 2.2 34 40 A D E -H 94 0B 81 60,-3.1 60,-2.5 -2,-0.5 -3,-0.0 -0.948 10.6-156.3-111.2 132.6 -0.7 -16.3 2.4 35 41 A I 0 0 38 -2,-0.4 58,-0.1 58,-0.2 -20,-0.1 -0.927 360.0 360.0-108.6 117.1 -2.6 -13.9 0.1 36 42 A P 0 0 112 0, 0.0 -1,-0.2 0, 0.0 57,-0.0 0.958 360.0 360.0 -66.5 360.0 -1.0 -10.4 -0.0 37 ! 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 38 54 A Y > 0 0 116 0, 0.0 4,-3.2 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 -3.5 -4.0 -10.6 -7.2 39 55 A G H > + 0 0 36 2,-0.2 4,-2.4 1,-0.2 -25,-0.3 0.950 360.0 41.1 -51.3 -52.4 -6.4 -11.1 -4.3 40 56 A P H > S+ 0 0 96 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.885 114.5 52.9 -69.2 -35.9 -9.4 -11.4 -6.7 41 57 A E H > S+ 0 0 99 2,-0.2 4,-2.4 1,-0.2 -2,-0.2 0.926 109.4 48.9 -60.2 -45.0 -7.4 -13.5 -9.1 42 58 A A H X S+ 0 0 0 -4,-3.2 4,-2.6 1,-0.2 5,-0.2 0.956 112.2 50.3 -61.8 -38.7 -6.5 -15.8 -6.2 43 59 A A H X S+ 0 0 28 -4,-2.4 4,-2.8 1,-0.2 -2,-0.2 0.891 110.9 47.7 -62.9 -45.7 -10.2 -16.0 -5.3 44 60 A A H X S+ 0 0 59 -4,-2.6 4,-2.4 1,-0.2 -1,-0.2 0.888 112.3 49.5 -65.3 -42.3 -11.2 -16.8 -8.8 45 61 A F H X S+ 0 0 58 -4,-2.4 4,-2.5 2,-0.2 -2,-0.2 0.945 113.3 44.5 -65.1 -51.5 -8.6 -19.5 -9.2 46 62 A T H X S+ 0 0 0 -4,-2.6 4,-2.3 -5,-0.2 5,-0.3 0.955 112.2 54.1 -58.4 -46.6 -9.5 -21.2 -5.9 47 63 A K H X S+ 0 0 99 -4,-2.8 4,-2.9 -5,-0.2 5,-0.3 0.923 110.6 44.9 -51.2 -52.0 -13.2 -21.0 -6.7 48 64 A K H X S+ 0 0 139 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.930 112.4 52.7 -63.5 -43.1 -12.9 -22.7 -10.1 49 65 A M H X S+ 0 0 37 -4,-2.5 4,-0.6 -5,-0.2 -1,-0.2 0.897 116.8 36.1 -57.4 -48.7 -10.6 -25.4 -8.7 50 66 A V H < S+ 0 0 3 -4,-2.3 3,-0.4 1,-0.2 -1,-0.2 0.874 116.5 52.7 -79.4 -33.3 -13.0 -26.4 -5.9 51 67 A E H < S+ 0 0 94 -4,-2.9 -2,-0.2 -5,-0.3 -1,-0.2 0.819 113.6 44.6 -70.0 -28.5 -16.2 -25.9 -7.9 52 68 A N H < S+ 0 0 114 -4,-2.0 -1,-0.2 -5,-0.3 -2,-0.2 0.588 90.4 104.5 -92.1 -9.4 -15.0 -28.1 -10.8 53 69 A A < - 0 0 19 -4,-0.6 3,-0.1 -3,-0.4 -3,-0.0 -0.374 56.5-156.1 -73.2 146.0 -13.6 -30.9 -8.7 54 70 A K S S+ 0 0 187 1,-0.2 2,-0.4 -2,-0.1 -1,-0.1 0.667 86.0 35.6 -90.0 -11.0 -15.4 -34.2 -8.4 55 71 A K - 0 0 118 2,-0.0 24,-3.2 -48,-0.0 2,-0.4 -0.992 65.0-170.1-141.1 125.3 -13.7 -35.0 -5.1 56 72 A I E -AE 6 78A 12 -50,-0.7 -50,-2.2 -2,-0.4 2,-0.4 -0.959 12.1-174.4-114.0 131.3 -12.7 -32.5 -2.2 57 73 A E E -AE 5 77A 34 20,-2.1 20,-3.0 -2,-0.4 2,-0.4 -0.975 15.5-148.3-127.1 147.0 -10.5 -33.8 0.6 58 74 A V E -AE 4 76A 0 -54,-2.9 -54,-2.6 -2,-0.4 2,-0.4 -0.912 11.6-171.5-107.0 136.1 -9.3 -32.2 3.9 59 75 A E E - E 0 75A 15 16,-2.4 16,-2.7 -2,-0.4 -56,-0.2 -0.919 10.1-153.6-134.5 104.9 -5.9 -33.2 5.3 60 76 A F E - E 0 74A 24 -58,-0.5 -58,-0.3 -2,-0.4 14,-0.2 -0.481 14.8-133.8 -67.3 150.2 -5.1 -31.9 8.8 61 77 A D - 0 0 0 12,-0.6 41,-0.1 3,-0.2 -1,-0.1 -0.175 31.6 -93.9 -92.6-168.8 -1.4 -31.5 9.7 62 78 A K S S+ 0 0 129 39,-0.4 40,-0.2 -2,-0.1 3,-0.1 0.408 101.9 73.5 -92.7 0.4 0.2 -32.7 13.0 63 79 A G S S- 0 0 14 1,-0.2 38,-0.2 36,-0.1 37,-0.1 -0.113 103.4 -37.1 -96.5-168.1 -0.3 -29.2 14.6 64 80 A Q - 0 0 100 36,-1.2 -1,-0.2 1,-0.1 -3,-0.2 -0.316 52.3-152.1 -55.1 137.8 -3.2 -27.3 16.0 65 81 A R + 0 0 134 -3,-0.1 8,-3.0 1,-0.1 2,-0.3 0.555 70.0 37.5-101.7 -11.8 -6.3 -28.0 13.8 66 82 A T B S-F 72 0A 68 6,-0.3 6,-0.2 -38,-0.1 2,-0.1 -0.986 71.9-133.9-137.2 150.2 -8.3 -24.8 14.3 67 83 A D > - 0 0 22 4,-2.2 3,-2.0 -2,-0.3 -2,-0.0 -0.359 41.7 -89.3 -91.4-175.9 -7.4 -21.2 14.6 68 84 A K T 3 S+ 0 0 169 1,-0.3 -1,-0.1 2,-0.1 -2,-0.0 0.727 126.3 57.5 -67.5 -16.1 -8.7 -18.6 17.1 69 85 A Y T 3 S- 0 0 161 2,-0.1 -1,-0.3 3,-0.0 3,-0.1 0.354 120.3-106.4 -98.5 5.3 -11.6 -17.8 14.7 70 86 A G S < S+ 0 0 46 -3,-2.0 2,-0.3 1,-0.3 -43,-0.2 0.489 71.3 144.4 87.1 -3.2 -12.8 -21.4 14.6 71 87 A R - 0 0 62 -45,-0.1 -4,-2.2 1,-0.1 -1,-0.3 -0.593 54.6-114.3 -76.6 138.7 -11.5 -22.1 11.1 72 88 A G E -dF 28 66A 0 -45,-2.6 -43,-3.3 -2,-0.3 2,-0.7 -0.411 22.7-144.0 -61.0 138.2 -10.2 -25.5 10.3 73 89 A L E +d 29 0A 10 -8,-3.0 -12,-0.6 -45,-0.2 2,-0.3 -0.868 46.8 125.2-111.0 100.7 -6.5 -25.4 9.5 74 90 A A E -dE 30 60A 0 -45,-1.4 -43,-1.9 -2,-0.7 2,-0.4 -0.925 63.4-100.5-148.4 164.4 -5.9 -28.0 6.7 75 91 A Y E - E 0 59A 8 -16,-2.7 -16,-2.4 -2,-0.3 2,-0.5 -0.762 39.9-148.3 -81.7 134.0 -4.5 -28.8 3.3 76 92 A I E - E 0 58A 1 -2,-0.4 7,-2.8 -18,-0.2 8,-0.4 -0.968 9.4-161.8-109.8 128.9 -7.4 -29.0 0.8 77 93 A Y E -GE 82 57A 19 -20,-3.0 -20,-2.1 -2,-0.5 2,-0.5 -0.891 5.1-165.8-108.9 137.5 -7.2 -31.4 -2.2 78 94 A A E > S-GE 81 56A 4 3,-3.0 3,-1.9 -2,-0.4 -22,-0.2 -0.972 82.6 -18.6-119.7 116.9 -9.4 -31.0 -5.2 79 95 A D T 3 S- 0 0 69 -24,-3.2 -1,-0.2 -2,-0.5 -23,-0.1 0.913 131.9 -49.6 52.8 41.3 -9.3 -34.2 -7.4 80 96 A G T 3 S+ 0 0 33 -25,-0.3 2,-0.5 1,-0.2 -1,-0.3 0.431 117.3 111.2 81.4 -2.5 -6.2 -35.2 -5.6 81 97 A K E < S-G 78 0A 140 -3,-1.9 -3,-3.0 4,-0.0 2,-0.2 -0.919 70.7-115.8-112.6 136.4 -4.4 -31.9 -6.1 82 98 A M E > -G 77 0A 20 -2,-0.5 4,-1.8 -5,-0.2 -5,-0.2 -0.416 15.3-156.0 -63.9 127.7 -3.5 -29.4 -3.4 83 99 A V H > S+ 0 0 0 -7,-2.8 4,-2.2 -2,-0.2 5,-0.2 0.927 93.4 51.0 -70.9 -45.7 -5.3 -26.2 -3.7 84 100 A G H > S+ 0 0 8 -8,-0.4 4,-2.8 1,-0.2 5,-0.2 0.936 111.1 47.9 -57.7 -49.7 -2.7 -24.2 -1.7 85 101 A E H > S+ 0 0 59 1,-0.2 4,-3.3 2,-0.2 -1,-0.2 0.904 109.7 52.6 -56.0 -44.3 0.2 -25.6 -3.8 86 102 A A H X S+ 0 0 24 -4,-1.8 4,-1.8 2,-0.2 -1,-0.2 0.894 111.3 47.6 -58.8 -43.8 -1.6 -24.8 -7.1 87 103 A L H <>S+ 0 0 0 -4,-2.2 5,-2.7 2,-0.2 6,-0.5 0.944 113.8 46.0 -64.7 -46.5 -2.1 -21.2 -6.0 88 104 A V H ><5S+ 0 0 0 -4,-2.8 3,-1.8 1,-0.2 -2,-0.2 0.924 112.1 51.5 -63.0 -45.2 1.5 -20.9 -4.9 89 105 A R H 3<5S+ 0 0 89 -4,-3.3 -1,-0.2 1,-0.3 -2,-0.2 0.857 107.8 53.0 -60.8 -33.6 2.8 -22.5 -8.1 90 106 A Q T 3<5S- 0 0 85 -4,-1.8 -1,-0.3 -5,-0.2 -2,-0.2 0.414 116.9-115.1 -77.6 -2.6 0.7 -20.0 -10.2 91 107 A G T < 5S+ 0 0 0 -3,-1.8 32,-2.3 -4,-0.2 -3,-0.2 0.837 84.1 121.1 66.3 32.3 2.2 -17.1 -8.3 92 108 A L S - 0 0 93 3,-0.5 3,-1.9 -2,-0.2 -36,-0.1 -0.927 63.2 -31.7-104.4 119.3 1.8 -21.9 12.4 100 116 A K T 3 S- 0 0 117 -2,-0.6 -36,-1.2 1,-0.3 -1,-0.1 0.714 120.2 -44.4 46.6 46.4 1.9 -24.2 15.5 101 117 A G T 3 S+ 0 0 32 -38,-0.2 2,-1.4 1,-0.2 -39,-0.4 0.493 99.1 129.0 87.8 5.2 3.8 -27.3 14.2 102 118 A N < + 0 0 0 -3,-1.9 -3,-0.5 1,-0.2 -1,-0.2 -0.637 27.2 119.1 -93.8 82.8 1.8 -27.5 10.9 103 119 A N > + 0 0 61 -2,-1.4 3,-1.5 -5,-0.1 4,-0.4 0.207 21.9 119.5-129.1 11.2 4.8 -27.8 8.6 104 120 A T T 3 S+ 0 0 62 1,-0.3 3,-0.3 -3,-0.2 4,-0.2 0.904 89.7 28.9 -54.2 -46.4 4.4 -31.1 6.8 105 121 A H T 3> S+ 0 0 45 1,-0.2 4,-2.4 2,-0.1 -1,-0.3 0.286 89.8 107.4 -98.0 14.0 4.2 -29.6 3.3 106 122 A E H <> S+ 0 0 44 -3,-1.5 4,-1.9 2,-0.2 -1,-0.2 0.844 79.1 47.0 -54.2 -46.4 6.2 -26.5 3.9 107 123 A Q H > S+ 0 0 123 -4,-0.4 4,-1.9 -3,-0.3 -1,-0.2 0.945 112.3 50.0 -66.2 -48.1 9.3 -27.6 1.9 108 124 A H H > S+ 0 0 94 -4,-0.2 4,-1.7 1,-0.2 -2,-0.2 0.876 112.4 48.3 -57.5 -43.8 7.3 -28.7 -1.0 109 125 A L H X S+ 0 0 6 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.847 106.1 55.5 -62.7 -39.2 5.4 -25.4 -1.0 110 126 A R H X S+ 0 0 84 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.876 107.2 51.3 -65.2 -37.9 8.6 -23.3 -0.8 111 127 A K H X S+ 0 0 139 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.921 108.7 50.1 -58.0 -52.1 9.9 -25.0 -3.9 112 128 A A H X S+ 0 0 8 -4,-1.7 4,-2.2 1,-0.2 -2,-0.2 0.942 112.6 49.9 -52.2 -44.6 6.6 -24.3 -5.8 113 129 A E H X S+ 0 0 19 -4,-2.5 4,-2.3 1,-0.2 -1,-0.2 0.861 107.1 51.3 -62.4 -45.6 7.0 -20.7 -4.7 114 130 A A H X S+ 0 0 49 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.894 111.0 50.3 -59.8 -43.4 10.7 -20.3 -5.8 115 131 A Q H X S+ 0 0 67 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.931 109.9 48.3 -64.1 -45.9 9.7 -21.7 -9.3 116 132 A A H <>S+ 0 0 0 -4,-2.2 5,-2.3 1,-0.2 -1,-0.2 0.880 113.2 51.3 -56.6 -39.9 6.8 -19.1 -9.6 117 133 A K H ><5S+ 0 0 115 -4,-2.3 3,-1.6 2,-0.2 -2,-0.2 0.900 108.3 49.2 -61.7 -46.1 9.3 -16.5 -8.5 118 134 A K H 3<5S+ 0 0 150 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.865 110.8 51.5 -65.3 -33.8 11.8 -17.6 -11.1 119 135 A E T 3<5S- 0 0 87 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.416 105.9-130.2 -83.9 3.3 9.1 -17.4 -13.7 120 136 A K T < 5 + 0 0 134 -3,-1.6 2,-0.4 1,-0.2 -3,-0.2 0.823 44.4 178.0 48.0 39.5 8.1 -13.9 -12.6 121 137 A L > < - 0 0 43 -5,-2.3 3,-2.3 4,-0.1 2,-0.3 -0.614 45.2 -56.6 -79.9 125.5 4.5 -15.1 -12.4 122 138 A N G > S+ 0 0 47 -2,-0.4 3,-2.1 1,-0.3 -30,-0.2 -0.199 134.8 25.4 51.8-104.1 1.7 -12.8 -11.3 123 139 A I G 3 S+ 0 0 38 -32,-2.3 -1,-0.3 1,-0.3 -31,-0.1 0.695 125.6 53.0 -65.7 -20.3 2.6 -11.5 -7.8 124 140 A W G < 0 0 54 -3,-2.3 -1,-0.3 -33,-0.2 -2,-0.2 0.254 360.0 360.0 -89.5 5.3 6.3 -12.0 -8.7 125 141 A S < 0 0 110 -3,-2.1 -4,-0.1 -4,-0.2 -5,-0.1 -0.311 360.0 360.0 -52.7 360.0 5.7 -10.0 -11.8