==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=4-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER IMMUNE SYSTEM 17-OCT-07 2RKQ . COMPND 2 MOLECULE: PEPTIDOGLYCAN-RECOGNITION PROTEIN-SD; . SOURCE 2 ORGANISM_SCIENTIFIC: DROSOPHILA MELANOGASTER; . AUTHOR A.ROUSSEL,J.ROYET,P.LEONE,C.KELLENBERGER . 169 1 1 1 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 8034.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 109 64.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 23 13.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 6 3.6 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 . 1 0.6 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 . 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 . 11 6.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 16 9.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 36 21.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 3 1.8 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 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 1 0 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 . 1 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 ANTIPARALLEL BRIDGES PER LADDER . 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 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 11 A E 0 0 158 0, 0.0 121,-0.1 0, 0.0 120,-0.1 0.000 360.0 360.0 360.0 159.5 30.5 46.9 17.4 2 12 A V - 0 0 14 119,-0.1 74,-0.0 120,-0.1 116,-0.0 -0.988 360.0-113.9-146.3 134.2 32.8 44.0 18.3 3 13 A P - 0 0 113 0, 0.0 74,-0.6 0, 0.0 2,-0.5 -0.357 28.2-144.4 -66.8 153.1 35.2 42.1 16.0 4 14 A I E -a 77 0A 40 72,-0.1 2,-1.1 74,-0.0 74,-0.2 -0.980 9.6-136.9-119.2 128.4 34.3 38.5 15.4 5 15 A V E -a 78 0A 19 72,-3.4 74,-3.0 -2,-0.5 5,-0.1 -0.784 37.3-141.2 -79.1 104.0 36.9 35.7 15.0 6 16 A T > - 0 0 51 -2,-1.1 4,-1.3 72,-0.2 3,-0.4 -0.153 21.2-101.2 -68.2 163.2 35.3 34.0 12.1 7 17 A R T >4>S+ 0 0 44 1,-0.3 5,-2.5 2,-0.2 3,-0.7 0.895 124.8 51.1 -50.5 -45.0 35.3 30.2 11.7 8 18 A A G >45S+ 0 0 89 1,-0.2 3,-1.3 3,-0.2 -1,-0.3 0.888 104.2 58.5 -61.8 -37.5 38.1 30.4 9.2 9 19 A E G 345S+ 0 0 129 -3,-0.4 -1,-0.2 1,-0.3 -2,-0.2 0.733 112.0 39.5 -68.5 -23.2 40.2 32.5 11.7 10 20 A W G <<5S- 0 0 0 -4,-1.3 -1,-0.3 -3,-0.7 -2,-0.2 0.286 114.6-117.2-104.1 11.9 40.0 29.8 14.3 11 21 A N T < 5 - 0 0 119 -3,-1.3 -3,-0.2 -4,-0.3 -2,-0.1 0.892 46.8-174.4 57.3 44.7 40.5 27.0 11.7 12 22 A A < - 0 0 21 -5,-2.5 -1,-0.1 -6,-0.1 38,-0.1 -0.276 24.5-121.6 -59.6 151.0 37.1 25.5 12.4 13 23 A K - 0 0 124 37,-0.1 3,-0.1 1,-0.1 -1,-0.1 -0.641 35.6-108.4 -80.0 152.4 36.0 22.3 10.8 14 24 A P - 0 0 98 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 -0.424 47.4 -80.7 -73.0 161.8 32.8 22.6 8.8 15 25 A P - 0 0 51 0, 0.0 2,-0.5 0, 0.0 49,-0.2 -0.279 35.2-153.8 -57.0 149.2 29.6 21.1 10.2 16 26 A N + 0 0 103 47,-2.5 2,-0.1 46,-0.1 -3,-0.0 -0.881 69.6 30.1-127.2 92.0 29.2 17.3 9.6 17 26AA G S S- 0 0 47 -2,-0.5 2,-0.0 2,-0.1 45,-0.0 -0.327 96.1 -75.2 133.2 148.2 25.6 16.8 9.7 18 27 A A - 0 0 96 -2,-0.1 2,-0.4 -3,-0.1 45,-0.2 -0.312 39.6-154.8 -65.8 148.8 22.5 18.8 8.8 19 28 A I - 0 0 32 44,-0.1 68,-0.1 -4,-0.1 -2,-0.1 -1.000 19.7-117.8-127.0 132.7 21.4 21.5 11.0 20 29 A D - 0 0 100 -2,-0.4 66,-3.0 67,-0.1 2,-0.1 -0.298 33.8-114.7 -63.5 149.7 17.8 22.7 11.2 21 30 A S B -G 85 0B 97 64,-0.2 2,-0.3 65,-0.0 64,-0.3 -0.456 23.1-156.8 -84.5 157.7 17.2 26.4 10.2 22 31 A M - 0 0 15 62,-2.0 2,-0.5 -2,-0.1 4,-0.1 -0.974 21.8-116.2-130.1 152.3 15.9 29.2 12.4 23 32 A V - 0 0 130 -2,-0.3 62,-0.0 2,-0.1 61,-0.0 -0.755 45.1-115.2 -88.2 121.9 14.1 32.4 11.5 24 33 A T S S+ 0 0 53 -2,-0.5 107,-0.1 2,-0.1 2,-0.1 -0.763 91.6 59.6 -98.4 153.3 16.1 35.5 12.3 25 34 A P S S- 0 0 60 0, 0.0 107,-0.3 0, 0.0 106,-0.2 0.471 87.5-141.0 -70.8 144.7 15.9 37.9 14.1 26 35 A L E -b 132 0A 0 105,-2.7 107,-2.9 -2,-0.1 71,-0.1 -0.556 6.3-141.6 -81.6 139.1 15.8 35.5 17.0 27 36 A P E S+ 0 0 67 0, 0.0 110,-2.0 0, 0.0 2,-0.3 0.673 78.8 41.1 -71.5 -16.7 13.5 36.2 19.9 28 37 A R E -bc 137 97A 42 68,-1.7 70,-2.9 108,-0.2 2,-0.4 -0.952 56.1-157.1-136.7 149.1 16.0 35.0 22.7 29 38 A A E -bc 138 98A 0 108,-2.7 110,-2.9 -2,-0.3 2,-0.5 -0.989 16.5-159.9-121.1 136.0 19.6 35.0 23.7 30 39 A V E -bc 139 99A 0 68,-3.1 70,-2.8 -2,-0.4 2,-0.5 -0.973 5.5-148.8-121.5 125.6 20.9 32.3 26.0 31 40 A I E +bc 140 100A 0 108,-2.8 110,-2.8 -2,-0.5 111,-0.3 -0.853 25.9 165.3-100.3 124.1 24.1 32.7 28.0 32 41 A A E - c 0 101A 0 68,-2.8 70,-2.8 -2,-0.5 2,-0.3 -0.729 28.3-138.3-121.7 166.4 26.1 29.5 28.7 33 42 A H E - c 0 102A 12 68,-0.3 70,-0.2 -2,-0.2 72,-0.1 -0.913 18.9-133.2-117.1 160.7 29.5 28.6 30.0 34 43 A T - 0 0 36 68,-2.0 71,-0.2 70,-0.6 69,-0.1 0.697 31.8-141.9 -81.8 -19.9 31.6 25.8 28.5 35 44 A A + 0 0 50 69,-2.4 70,-0.2 67,-0.4 3,-0.1 0.328 66.8 94.5 77.7 -1.4 32.3 24.5 32.0 36 45 A G S S- 0 0 41 68,-0.4 -1,-0.2 1,-0.3 -2,-0.1 0.072 84.3 -33.1 -98.5-152.3 35.9 23.6 31.1 37 46 A G - 0 0 48 67,-0.2 -1,-0.3 -3,-0.1 2,-0.1 -0.280 59.5-120.0 -67.7 151.8 39.2 25.3 31.3 38 47 A A - 0 0 71 66,-0.1 2,-0.4 -3,-0.1 66,-0.2 -0.447 20.6-146.6 -81.9 163.6 39.6 29.0 30.9 39 48 A a + 0 0 5 64,-0.4 34,-0.6 -2,-0.1 64,-0.1 -0.991 17.4 178.7-134.0 144.6 41.7 30.6 28.2 40 49 A A + 0 0 79 -2,-0.4 2,-0.3 33,-0.2 -1,-0.1 0.250 61.3 43.5-133.2 12.7 43.7 33.8 28.5 41 50 A D S > S- 0 0 78 1,-0.1 4,-2.7 34,-0.0 5,-0.3 -0.959 85.1-101.9-151.2 170.5 45.5 34.4 25.2 42 51 A D H > S+ 0 0 79 -2,-0.3 4,-1.4 1,-0.2 5,-0.1 0.797 117.4 51.9 -68.0 -27.2 44.8 34.1 21.5 43 52 A V H > S+ 0 0 112 2,-0.2 4,-2.3 3,-0.1 -1,-0.2 0.972 114.8 39.0 -72.8 -52.0 46.6 30.8 21.2 44 53 A T H > S+ 0 0 50 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.891 115.0 52.2 -70.5 -36.9 44.8 29.0 24.0 45 54 A a H X S+ 0 0 0 -4,-2.7 4,-2.0 2,-0.2 -1,-0.2 0.919 111.4 47.4 -63.5 -39.5 41.4 30.5 23.2 46 55 A S H X S+ 0 0 21 -4,-1.4 4,-2.0 -5,-0.3 -1,-0.2 0.914 113.9 47.9 -66.0 -39.3 41.7 29.4 19.6 47 56 A Q H X S+ 0 0 75 -4,-2.3 4,-2.8 1,-0.2 -2,-0.2 0.906 109.0 52.8 -69.7 -38.7 42.8 25.9 20.6 48 57 A H H X S+ 0 0 56 -4,-3.0 4,-2.7 1,-0.2 -1,-0.2 0.884 106.7 55.2 -61.8 -36.5 40.0 25.7 23.2 49 58 A M H X S+ 0 0 1 -4,-2.0 4,-2.6 -5,-0.2 -2,-0.2 0.948 111.0 42.6 -60.2 -49.5 37.6 26.5 20.3 50 59 A R H X S+ 0 0 50 -4,-2.0 4,-2.9 2,-0.2 -2,-0.2 0.908 114.2 51.7 -64.7 -39.2 38.8 23.7 18.2 51 60 A N H X S+ 0 0 82 -4,-2.8 4,-2.6 2,-0.2 -2,-0.2 0.906 111.4 47.1 -65.8 -39.9 38.9 21.3 21.1 52 61 A L H X S+ 0 0 33 -4,-2.7 4,-2.9 2,-0.2 5,-0.3 0.934 113.1 48.0 -66.0 -47.4 35.3 22.2 22.0 53 62 A Q H X S+ 0 0 0 -4,-2.6 4,-2.6 -5,-0.2 5,-0.3 0.943 114.3 47.1 -56.1 -48.1 34.1 21.8 18.5 54 63 A N H X S+ 0 0 57 -4,-2.9 4,-2.8 1,-0.2 5,-0.4 0.885 113.5 48.2 -63.7 -40.8 35.9 18.5 18.2 55 64 A F H X>S+ 0 0 108 -4,-2.6 4,-2.7 -5,-0.2 5,-1.6 0.945 114.6 44.8 -63.1 -49.1 34.6 17.2 21.5 56 65 A Q H <5S+ 0 0 10 -4,-2.9 6,-2.7 3,-0.2 5,-0.2 0.891 119.5 41.4 -65.5 -38.4 31.0 18.2 20.7 57 66 A M H <5S+ 0 0 17 -4,-2.6 -2,-0.2 -5,-0.3 -1,-0.2 0.919 126.1 33.3 -75.0 -42.9 31.1 16.8 17.2 58 67 A S H <5S+ 0 0 81 -4,-2.8 -3,-0.2 -5,-0.3 -2,-0.2 0.925 132.8 22.9 -81.2 -45.8 33.0 13.6 18.1 59 68 A K T <5S+ 0 0 149 -4,-2.7 -3,-0.2 -5,-0.4 -2,-0.1 0.895 133.2 34.9 -90.1 -46.8 31.8 12.7 21.6 60 69 A Q S - 0 0 0 4,-2.6 3,-2.0 -2,-0.5 -32,-0.1 -0.391 29.6-113.0 -80.7 161.3 37.3 33.7 25.4 73 82 A G T 3 S+ 0 0 13 -34,-0.6 42,-0.2 1,-0.3 41,-0.2 0.621 117.0 69.8 -66.6 -12.5 39.0 35.0 28.5 74 83 A N T 3 S- 0 0 33 -33,-0.2 -1,-0.3 2,-0.1 -34,-0.1 0.384 119.8-111.4 -77.9 -0.3 41.1 37.1 26.1 75 84 A G S < S+ 0 0 16 -3,-2.0 2,-0.3 1,-0.3 -2,-0.1 0.503 73.6 135.8 83.9 4.8 37.9 39.1 25.4 76 85 A K - 0 0 86 -74,-0.0 -4,-2.6 -72,-0.0 2,-0.5 -0.629 49.7-137.6 -91.4 147.3 37.5 37.8 21.9 77 86 A V E -aD 4 71A 1 -74,-0.6 -72,-3.4 -2,-0.3 2,-0.4 -0.903 18.4-158.0-105.4 123.1 34.2 36.6 20.3 78 87 A Y E -aD 5 70A 5 -8,-3.4 -8,-2.2 -2,-0.5 2,-0.3 -0.873 17.1-121.0-105.3 135.0 34.5 33.5 18.2 79 88 A E E + D 0 69A 59 -74,-3.0 -10,-0.2 -2,-0.4 3,-0.1 -0.569 37.2 163.8 -76.1 130.7 32.0 32.6 15.6 80 89 A G - 0 0 1 -12,-3.1 -12,-0.3 1,-0.5 -73,-0.2 0.164 55.0 -6.5-109.7-129.6 30.1 29.3 15.9 81 90 A R S S- 0 0 11 -14,-2.6 -1,-0.5 -16,-0.2 6,-0.1 -0.312 82.5 -96.6 -62.7 154.1 26.9 28.3 14.1 82 91 A S > - 0 0 44 1,-0.1 3,-2.5 -3,-0.1 -1,-0.1 -0.441 31.3-117.6 -64.1 144.5 25.1 30.9 11.9 83 92 A P T 3 S+ 0 0 13 0, 0.0 -1,-0.1 0, 0.0 4,-0.1 0.727 116.8 59.7 -57.0 -20.9 22.2 32.6 13.7 84 93 A S T 3 S+ 0 0 53 -63,-0.1 -62,-2.0 2,-0.1 2,-0.5 0.275 93.4 80.3 -89.5 10.0 20.0 31.0 11.1 85 94 A Q B < S-G 21 0B 60 -3,-2.5 -64,-0.2 -64,-0.3 -65,-0.1 -0.979 91.2-113.1-113.3 128.8 21.1 27.6 12.1 86 95 A R - 0 0 73 -66,-3.0 9,-0.1 -2,-0.5 -4,-0.1 -0.235 34.2-128.8 -54.8 139.6 19.5 26.0 15.2 87 96 A G - 0 0 3 7,-0.5 2,-0.3 10,-0.3 -20,-0.2 -0.234 3.3-132.8 -80.2 177.9 21.9 25.6 18.1 88 97 A A S S+ 0 0 16 -22,-2.4 -22,-0.1 1,-0.1 -26,-0.1 -0.728 75.6 90.0-135.0 81.5 22.6 22.5 20.1 89 98 A F S S+ 0 0 16 -2,-0.3 -1,-0.1 2,-0.1 55,-0.1 0.399 89.1 33.0-146.6 -9.6 22.6 23.5 23.8 90 99 A A S > S- 0 0 6 1,-0.3 3,-2.7 -3,-0.1 4,-0.1 0.196 77.8-146.0-144.7 17.2 19.0 23.2 25.0 91 100 A G G > S+ 0 0 46 1,-0.3 3,-2.3 2,-0.2 4,-0.3 -0.212 89.9 11.6 52.3-122.9 17.2 20.3 23.3 92 101 A P G 3 S+ 0 0 119 0, 0.0 3,-0.5 0, 0.0 -1,-0.3 0.726 131.7 57.4 -58.5 -18.9 13.5 21.2 22.9 93 102 A N G < S+ 0 0 38 -3,-2.7 -2,-0.2 51,-0.3 52,-0.0 0.247 74.8 96.2 -97.6 12.4 14.4 24.8 23.9 94 103 A N X + 0 0 17 -3,-2.3 3,-1.3 -4,-0.1 -7,-0.5 0.813 60.1 109.2 -64.9 -29.9 17.0 25.3 21.1 95 104 A D T 3 S- 0 0 84 -3,-0.5 3,-0.1 -4,-0.3 -73,-0.1 -0.153 87.4 -1.9 -57.3 139.1 14.3 27.0 19.0 96 105 A G T 3 S+ 0 0 18 1,-0.2 -68,-1.7 -69,-0.1 2,-0.5 0.701 101.5 128.2 63.8 26.0 14.6 30.8 18.4 97 106 A S E < -c 28 0A 0 -3,-1.3 2,-0.7 -70,-0.2 -10,-0.3 -0.953 53.4-148.8-129.2 126.6 17.6 31.2 20.6 98 107 A L E -c 29 0A 0 -70,-2.9 -68,-3.1 -2,-0.5 2,-0.6 -0.803 25.9-149.8 -85.4 116.0 21.0 32.7 20.0 99 108 A G E +c 30 0A 0 -2,-0.7 -31,-2.0 -70,-0.2 -30,-1.9 -0.805 17.8 179.6 -97.2 122.6 23.5 30.7 22.1 100 109 A I E -ce 31 69A 0 -70,-2.8 -68,-2.8 -2,-0.6 2,-0.5 -0.986 7.3-167.9-122.4 119.7 26.5 32.6 23.5 101 110 A A E -ce 32 70A 0 -32,-2.5 -30,-2.4 -2,-0.5 2,-0.5 -0.936 15.6-141.8-114.3 129.3 28.9 30.6 25.6 102 111 A F E -ce 33 71A 1 -70,-2.8 -68,-2.0 -2,-0.5 2,-0.5 -0.748 28.8-120.6 -81.0 132.0 31.7 32.0 27.7 103 112 A I S S+ 0 0 6 -32,-2.9 -64,-0.4 -2,-0.5 2,-0.2 -0.642 78.2 33.0 -76.6 123.2 34.7 29.8 27.5 104 113 A G S S- 0 0 0 -2,-0.5 -69,-2.4 -66,-0.2 -70,-0.6 -0.781 95.4 -66.4 127.9-171.4 35.6 28.6 31.1 105 114 A N + 0 0 72 -2,-0.2 4,-0.3 -70,-0.2 3,-0.3 -0.970 39.0 176.5-124.8 115.9 33.8 27.7 34.3 106 115 A F + 0 0 16 -2,-0.5 48,-1.5 44,-0.3 47,-1.1 -0.090 44.7 112.5-117.1 34.8 32.0 30.5 36.0 107 116 A E S S+ 0 0 47 44,-0.3 46,-0.6 45,-0.2 -1,-0.2 0.909 96.6 16.3 -65.6 -42.6 30.4 28.7 38.9 108 117 A E S S+ 0 0 184 -3,-0.3 2,-0.3 1,-0.2 -2,-0.1 0.659 129.5 33.2-115.8 -18.2 32.6 30.5 41.4 109 118 A R S S- 0 0 181 -4,-0.3 45,-0.3 0, 0.0 -1,-0.2 -0.974 79.4-112.6-135.3 152.6 34.2 33.4 39.7 110 119 A A - 0 0 37 -2,-0.3 3,-0.1 43,-0.2 -5,-0.1 -0.386 39.2 -96.1 -73.6 155.3 32.9 35.8 37.0 111 120 A P - 0 0 7 0, 0.0 -1,-0.1 0, 0.0 -7,-0.1 -0.256 57.2 -78.9 -58.8 162.4 34.4 36.0 33.5 112 121 A N >> - 0 0 66 1,-0.1 4,-2.3 4,-0.0 3,-0.6 -0.255 40.5-112.1 -59.9 150.7 37.0 38.6 32.9 113 122 A K H 3> S+ 0 0 135 1,-0.2 4,-3.2 2,-0.2 5,-0.2 0.883 118.1 57.0 -53.4 -42.2 35.8 42.2 32.3 114 123 A E H 3> S+ 0 0 106 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.866 107.9 47.7 -60.5 -36.6 36.9 42.0 28.7 115 124 A A H <> S+ 0 0 1 -3,-0.6 4,-2.3 2,-0.2 -1,-0.2 0.918 112.5 47.8 -69.9 -43.3 34.8 39.0 28.1 116 125 A L H X S+ 0 0 22 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.917 112.6 49.0 -63.3 -43.4 31.7 40.5 29.8 117 126 A D H X S+ 0 0 46 -4,-3.2 4,-2.6 1,-0.2 5,-0.2 0.925 109.8 52.7 -58.4 -45.7 32.2 43.7 27.7 118 127 A A H X S+ 0 0 2 -4,-2.1 4,-2.7 -5,-0.2 -2,-0.2 0.898 108.1 50.9 -58.4 -42.7 32.5 41.6 24.6 119 128 A A H X S+ 0 0 0 -4,-2.3 4,-2.3 2,-0.2 -1,-0.2 0.920 111.5 46.7 -62.3 -45.0 29.2 39.8 25.4 120 129 A K H X S+ 0 0 98 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.913 114.4 47.5 -65.4 -39.7 27.3 43.1 25.9 121 130 A E H X S+ 0 0 75 -4,-2.6 4,-2.6 1,-0.2 -2,-0.2 0.892 110.6 53.4 -67.4 -37.2 28.8 44.5 22.7 122 131 A L H X S+ 0 0 0 -4,-2.7 4,-3.0 -5,-0.2 -2,-0.2 0.909 106.9 50.4 -63.9 -42.4 27.9 41.3 20.9 123 132 A L H X S+ 0 0 5 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.936 111.7 48.5 -61.0 -45.2 24.3 41.5 22.0 124 133 A E H X S+ 0 0 93 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.922 113.9 47.1 -58.6 -45.0 24.1 45.1 20.8 125 134 A Q H X S+ 0 0 14 -4,-2.6 4,-2.2 1,-0.2 -2,-0.2 0.895 107.7 55.0 -64.9 -41.9 25.6 44.1 17.5 126 135 A A H <>S+ 0 0 0 -4,-3.0 5,-2.9 2,-0.2 6,-1.6 0.882 109.8 48.0 -60.9 -39.2 23.4 41.1 17.1 127 136 A V H ><5S+ 0 0 37 -4,-2.1 3,-1.8 4,-0.2 -2,-0.2 0.955 112.0 48.6 -63.5 -48.4 20.3 43.4 17.4 128 137 A K H 3<5S+ 0 0 134 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.811 112.4 49.4 -62.1 -29.9 21.8 45.9 14.9 129 138 A Q T 3<5S- 0 0 102 -4,-2.2 -1,-0.3 -5,-0.2 -2,-0.2 0.309 114.6-115.6 -92.3 7.4 22.5 43.1 12.5 130 139 A A T < 5S+ 0 0 56 -3,-1.8 -3,-0.2 2,-0.3 -2,-0.1 0.760 86.2 116.0 63.9 26.8 19.0 41.6 12.8 131 140 A Q S - 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