==== 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 SIGNALING PROTEIN 07-JUL-06 2DSW . COMPND 2 MOLECULE: CHITINASE-3-LIKE PROTEIN 1; . SOURCE 2 ORGANISM_SCIENTIFIC: OVIS ARIES; . AUTHOR D.B.SRIVASTAVA,A.S.ETHAYATHULLA,J.KUMAR,N.SINGH,S.SHARMA,P.K . 361 1 2 2 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 15802.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 249 69.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 46 12.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 31 8.6 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 0.6 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 . 20 5.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 41 11.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 94 26.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.1 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 2 2 1 0 2 0 1 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 0 1 2 4 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 3 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 0 ANTIPARALLEL BRIDGES PER LADDER . 1 0 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 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 1 A Y 0 0 131 0, 0.0 2,-0.3 0, 0.0 325,-0.2 0.000 360.0 360.0 360.0 138.5 14.8 18.3 -3.9 2 2 A K E -a 326 0A 71 323,-2.2 325,-2.0 29,-0.0 2,-0.4 -0.736 360.0-162.5-101.2 147.9 15.3 21.8 -2.5 3 3 A L E -a 327 0A 6 -2,-0.3 29,-2.0 323,-0.2 28,-1.8 -0.903 10.4-166.4-131.0 100.9 15.9 22.7 1.2 4 4 A I E -ab 328 32A 0 323,-2.7 325,-3.8 -2,-0.4 2,-0.5 -0.800 6.8-172.0 -93.4 120.5 15.2 26.3 1.9 5 5 A a E -ab 329 33A 0 27,-2.9 29,-3.2 -2,-0.6 2,-0.3 -0.950 11.9-147.1-119.9 127.0 16.5 27.5 5.3 6 6 A Y E - b 0 34A 4 323,-2.4 326,-2.4 -2,-0.5 325,-0.5 -0.690 8.6-165.3 -89.4 139.0 15.8 30.9 6.8 7 7 A Y E - b 0 35A 0 27,-3.1 29,-2.6 -2,-0.3 2,-0.5 -0.994 16.1-139.1-122.7 129.2 18.4 32.6 9.0 8 8 A T E > - b 0 36A 2 -2,-0.5 3,-1.5 27,-0.2 29,-0.2 -0.790 5.9-143.4-101.4 133.4 17.3 35.5 11.1 9 9 A S G > S+ 0 0 1 27,-3.0 3,-1.1 -2,-0.5 28,-0.1 0.872 96.6 54.1 -48.3 -53.7 19.2 38.8 11.7 10 10 A W G > S+ 0 0 82 1,-0.3 3,-0.9 26,-0.2 -1,-0.3 0.402 81.2 87.0 -70.6 -0.3 18.3 39.3 15.3 11 11 A S G X S+ 0 0 0 -3,-1.5 9,-1.8 1,-0.2 3,-0.7 0.572 75.4 74.2 -76.8 -4.7 19.4 35.9 16.6 12 12 A Q G < S+ 0 0 16 -3,-1.1 -1,-0.2 7,-0.2 -2,-0.1 0.808 90.5 56.2 -74.5 -28.7 22.8 37.4 17.0 13 13 A Y G < S+ 0 0 107 -3,-0.9 -1,-0.2 -4,-0.1 2,-0.2 0.438 76.4 115.3 -84.1 -1.6 21.6 39.3 20.1 14 14 A R S < S- 0 0 29 -3,-0.7 5,-0.2 4,-0.3 252,-0.1 -0.522 71.9-112.8 -70.3 135.4 20.4 36.2 22.0 15 15 A E > - 0 0 120 250,-0.3 3,-1.7 -2,-0.2 -1,-0.1 -0.296 68.2 -16.2 -74.6 154.9 22.5 35.8 25.1 16 16 A G G > S- 0 0 61 1,-0.3 3,-1.7 2,-0.2 -2,-0.0 -0.307 133.6 -6.6 60.6-137.5 24.9 33.1 25.8 17 17 A D G 3 S+ 0 0 79 1,-0.3 -1,-0.3 3,-0.0 321,-0.1 0.688 122.4 77.3 -62.8 -23.4 24.6 30.0 23.6 18 18 A G G < S+ 0 0 0 -3,-1.7 2,-0.3 -5,-0.1 -4,-0.3 0.701 70.5 106.8 -63.1 -16.4 21.4 31.4 22.1 19 19 A S < - 0 0 24 -3,-1.7 2,-0.4 -5,-0.2 -7,-0.2 -0.486 50.9-175.6 -69.2 125.7 23.7 33.7 20.0 20 20 A C - 0 0 2 -9,-1.8 -6,-0.1 -2,-0.3 -9,-0.1 -0.978 7.4-178.7-130.8 121.5 23.8 32.6 16.4 21 21 A F > - 0 0 75 -2,-0.4 3,-3.1 -9,-0.1 4,-0.2 -0.840 44.3-100.3-114.5 154.0 25.9 34.0 13.6 22 22 A P G > S+ 0 0 0 0, 0.0 3,-1.7 0, 0.0 -1,-0.0 0.744 117.4 65.1 -41.7 -34.9 26.1 33.0 9.9 23 23 A D G 3 S+ 0 0 111 1,-0.3 36,-0.0 3,-0.0 -3,-0.0 0.606 85.7 71.4 -71.3 -7.3 29.2 31.0 10.4 24 24 A A G < S+ 0 0 38 -3,-3.1 2,-0.3 2,-0.1 -1,-0.3 0.502 81.0 103.7 -82.1 -3.0 27.4 28.6 12.7 25 25 A I S < S- 0 0 5 -3,-1.7 -18,-0.0 -4,-0.2 308,-0.0 -0.644 76.3-128.5 -86.3 134.2 25.7 27.3 9.5 26 26 A D >> - 0 0 61 -2,-0.3 3,-1.5 1,-0.1 4,-0.6 -0.701 15.5-147.7 -78.3 117.9 26.7 24.1 7.9 27 27 A P T 34 S+ 0 0 5 0, 0.0 -1,-0.1 0, 0.0 42,-0.1 0.624 95.2 48.1 -65.0 -10.9 27.3 25.0 4.2 28 28 A F T 34 S+ 0 0 104 1,-0.1 -2,-0.0 41,-0.0 -3,-0.0 0.400 91.3 81.5-109.5 2.5 26.2 21.6 3.1 29 29 A L T <4 S+ 0 0 5 -3,-1.5 2,-0.1 2,-0.0 -1,-0.1 0.997 95.1 27.4 -68.4 -68.3 22.9 21.4 5.0 30 30 A a < - 0 0 6 -4,-0.6 -26,-0.2 1,-0.1 3,-0.1 -0.456 62.1-141.1 -94.8 166.3 20.5 23.4 2.9 31 31 A T S S+ 0 0 50 -28,-1.8 39,-1.9 1,-0.3 2,-0.4 0.736 94.3 24.3 -94.2 -29.4 20.4 24.1 -0.8 32 32 A H E -bc 4 70A 21 -29,-2.0 -27,-2.9 37,-0.2 2,-0.5 -1.000 66.6-162.0-138.0 133.2 19.3 27.7 -0.3 33 33 A V E -bc 5 71A 4 37,-1.9 39,-2.1 -2,-0.4 2,-0.5 -0.969 10.9-157.1-116.2 130.0 19.8 29.9 2.8 34 34 A I E -bc 6 72A 0 -29,-3.2 -27,-3.1 -2,-0.5 2,-0.4 -0.928 7.3-143.6-113.2 124.6 17.6 33.0 3.1 35 35 A Y E -bc 7 73A 0 37,-2.7 39,-2.7 -2,-0.5 2,-0.4 -0.718 27.7-121.1 -86.3 127.1 18.6 36.0 5.2 36 36 A S E +bc 8 74A 0 -29,-2.6 -27,-3.0 -2,-0.4 -26,-0.2 -0.971 64.8 6.5-118.4 130.7 15.7 37.7 7.0 37 37 A F E - 0 0 25 37,-0.5 12,-0.2 -2,-0.4 38,-0.2 0.688 43.9-179.6-135.6 164.9 14.9 40.5 6.7 38 38 A A E - c 0 75A 0 36,-2.8 38,-1.2 -3,-0.2 9,-0.2 -0.620 26.1-136.5-100.0 163.6 15.8 43.5 4.5 39 39 A N E -I 46 0B 34 7,-3.0 7,-1.6 -2,-0.2 2,-0.4 -0.406 7.0-130.0-107.6-174.7 14.1 47.0 4.8 40 40 A I E +I 45 0B 5 5,-0.2 2,-0.4 -2,-0.1 5,-0.2 -0.965 25.0 176.8-142.7 122.2 12.8 49.5 2.3 41 41 A S E > S-I 44 0B 40 3,-3.0 3,-1.1 -2,-0.4 -2,-0.0 -0.995 71.0 -5.0-132.0 133.7 13.7 53.2 2.3 42 42 A N T 3 S- 0 0 142 -2,-0.4 -1,-0.2 1,-0.3 3,-0.1 0.942 131.6 -58.7 51.0 44.7 12.8 55.9 -0.1 43 43 A N T 3 S+ 0 0 63 1,-0.2 2,-0.3 -3,-0.1 -1,-0.3 0.790 118.0 112.7 54.7 34.1 11.2 53.0 -2.0 44 44 A E E < S-I 41 0B 95 -3,-1.1 -3,-3.0 57,-0.1 -1,-0.2 -0.966 75.6-103.5-132.7 148.8 14.5 51.2 -2.3 45 45 A I E +I 40 0B 7 53,-0.4 2,-0.3 -2,-0.3 -5,-0.2 -0.367 52.4 164.0 -66.8 154.0 15.7 48.0 -0.8 46 46 A D E -I 39 0B 66 -7,-1.6 -7,-3.0 -6,-0.0 56,-0.0 -0.981 36.7 -82.2-163.9 166.2 18.1 48.6 2.1 47 47 A T - 0 0 40 -2,-0.3 -9,-0.1 -9,-0.2 3,-0.1 -0.091 25.1-163.7 -71.0 174.9 19.7 47.0 5.2 48 48 A W + 0 0 101 1,-0.2 -1,-0.1 -11,-0.1 2,-0.1 0.657 67.1 52.5-124.4 -59.1 18.0 46.5 8.6 49 49 A E S > S- 0 0 33 -12,-0.2 3,-1.2 1,-0.1 4,-0.2 -0.438 84.6-117.1 -80.3 159.4 20.6 45.8 11.3 50 50 A W T 3 S+ 0 0 213 1,-0.2 3,-0.2 -2,-0.1 -1,-0.1 0.802 114.6 40.9 -68.3 -27.2 23.6 48.0 11.8 51 51 A N T 3> S+ 0 0 17 1,-0.2 4,-2.5 2,-0.1 3,-0.4 0.027 76.0 118.2-110.4 28.5 26.0 45.1 10.9 52 52 A D H <> S+ 0 0 1 -3,-1.2 4,-3.8 1,-0.2 5,-0.3 0.935 72.7 56.6 -60.9 -45.7 24.1 43.6 8.0 53 53 A V H > S+ 0 0 77 -4,-0.2 4,-1.5 -3,-0.2 -1,-0.2 0.851 111.1 46.4 -56.5 -30.0 26.8 44.2 5.4 54 54 A T H > S+ 0 0 81 -3,-0.4 4,-2.6 2,-0.2 -2,-0.2 0.957 115.9 41.8 -75.3 -50.3 29.1 42.2 7.7 55 55 A L H X S+ 0 0 5 -4,-2.5 4,-2.8 2,-0.2 5,-0.2 0.873 112.1 56.9 -63.2 -35.2 26.8 39.3 8.4 56 56 A Y H X S+ 0 0 0 -4,-3.8 4,-2.8 -5,-0.2 -1,-0.2 0.943 109.8 45.9 -55.3 -50.8 25.8 39.4 4.7 57 57 A D H X S+ 0 0 103 -4,-1.5 4,-0.8 -5,-0.3 -2,-0.2 0.912 112.0 50.7 -58.2 -47.4 29.5 38.9 3.9 58 58 A T H < S+ 0 0 35 -4,-2.6 4,-0.4 1,-0.2 3,-0.3 0.878 112.7 46.5 -60.1 -43.3 29.8 36.2 6.5 59 59 A L H >< S+ 0 0 0 -4,-2.8 3,-1.9 1,-0.2 4,-0.3 0.954 110.7 50.7 -65.4 -52.2 26.9 34.3 5.1 60 60 A N H >< S+ 0 0 19 -4,-2.8 3,-0.6 1,-0.3 -1,-0.2 0.587 96.6 69.2 -67.1 -9.2 27.9 34.5 1.5 61 61 A T G >< S+ 0 0 58 -4,-0.8 3,-2.6 -3,-0.3 4,-0.5 0.728 81.1 76.8 -79.2 -19.3 31.4 33.2 2.3 62 62 A L G X> S+ 0 0 6 -3,-1.9 4,-1.6 -4,-0.4 3,-1.5 0.838 82.8 67.9 -56.8 -30.6 29.7 29.9 3.0 63 63 A K G <4 S+ 0 0 43 -3,-0.6 -1,-0.3 -4,-0.3 -2,-0.2 0.626 85.4 68.8 -65.5 -12.0 29.5 29.6 -0.8 64 64 A N G <4 S+ 0 0 141 -3,-2.6 -1,-0.3 1,-0.2 -2,-0.2 0.786 107.3 38.1 -75.4 -26.8 33.4 29.3 -0.9 65 65 A R T <4 S+ 0 0 155 -3,-1.5 -2,-0.2 -4,-0.5 -1,-0.2 0.771 129.5 30.6 -92.5 -31.2 33.1 25.9 0.7 66 66 A N >< - 0 0 17 -4,-1.6 3,-1.1 1,-0.1 -1,-0.3 -0.897 65.7-173.8-130.7 100.1 29.9 24.8 -1.1 67 67 A P T 3 S+ 0 0 98 0, 0.0 -1,-0.1 0, 0.0 -4,-0.1 0.677 84.1 61.9 -65.2 -20.6 29.8 26.3 -4.6 68 68 A K T 3 S+ 0 0 168 2,-0.1 2,-0.1 0, 0.0 -5,-0.1 0.681 78.9 111.1 -79.7 -19.5 26.3 24.9 -5.2 69 69 A L < - 0 0 3 -3,-1.1 2,-0.4 -7,-0.1 -37,-0.2 -0.331 51.2-164.0 -61.1 130.1 24.9 26.9 -2.2 70 70 A K E -c 32 0A 59 -39,-1.9 -37,-1.9 -2,-0.1 2,-0.3 -0.926 3.3-162.9-114.0 140.4 22.5 29.6 -3.3 71 71 A T E -c 33 0A 0 -2,-0.4 41,-3.0 -39,-0.2 42,-0.6 -0.928 4.9-170.4-125.1 151.5 21.6 32.5 -1.0 72 72 A L E -cd 34 113A 0 -39,-2.1 -37,-2.7 -2,-0.3 2,-0.5 -0.931 18.9-131.2-136.0 160.4 18.7 35.0 -1.0 73 73 A L E -cd 35 114A 0 40,-2.1 42,-2.9 -2,-0.3 2,-0.4 -0.951 21.9-145.1-114.3 132.0 17.6 38.1 0.8 74 74 A S E -cd 36 115A 0 -39,-2.7 -36,-2.8 -2,-0.5 -37,-0.5 -0.804 7.5-154.4 -99.9 135.2 14.1 38.4 2.1 75 75 A V E +cd 38 116A 0 40,-2.8 42,-2.8 -2,-0.4 2,-0.5 -0.865 62.4 9.3-106.7 143.3 12.1 41.7 2.1 76 76 A G E + d 0 117A 2 -38,-1.2 42,-0.2 -2,-0.4 3,-0.2 -0.850 62.7 173.0 101.4-126.3 9.3 42.3 4.5 77 77 A G > - 0 0 1 40,-2.7 3,-0.7 -2,-0.5 42,-0.4 -0.439 55.2 -63.6 102.4-179.6 8.6 40.0 7.4 78 78 A W T 3 S+ 0 0 174 1,-0.2 -1,-0.1 -2,-0.1 40,-0.0 0.826 128.9 56.7 -79.1 -30.5 6.2 40.3 10.3 79 79 A N T 3 S+ 0 0 136 -3,-0.2 2,-0.5 2,-0.1 -1,-0.2 0.160 93.9 90.6 -85.0 23.2 7.7 43.4 12.1 80 80 A F S < S- 0 0 4 -3,-0.7 39,-0.2 39,-0.1 -3,-0.1 -0.973 88.5-115.0-118.5 125.3 7.3 45.1 8.7 81 81 A G >> - 0 0 17 -2,-0.5 3,-1.1 1,-0.2 4,-1.0 -0.447 13.1-152.6 -64.1 119.6 4.0 47.0 8.1 82 82 A P H 3> S+ 0 0 42 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.761 98.4 66.3 -62.2 -21.1 2.0 45.4 5.3 83 83 A E H 3> S+ 0 0 128 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.896 96.8 56.0 -63.7 -37.4 0.6 48.8 4.8 84 84 A R H <> S+ 0 0 95 -3,-1.1 4,-1.1 2,-0.2 -1,-0.2 0.873 106.9 46.4 -62.6 -39.2 4.1 49.8 3.8 85 85 A F H X S+ 0 0 2 -4,-1.0 4,-2.6 2,-0.2 3,-0.5 0.927 111.5 54.9 -68.1 -41.4 4.2 47.1 1.1 86 86 A S H X S+ 0 0 29 -4,-2.6 4,-2.1 1,-0.2 -2,-0.2 0.933 104.7 50.2 -54.6 -53.5 0.8 48.3 0.0 87 87 A A H < S+ 0 0 47 -4,-2.8 4,-0.4 1,-0.2 -1,-0.2 0.770 115.2 45.6 -59.9 -26.1 1.8 51.9 -0.5 88 88 A I H < S+ 0 0 14 -4,-1.1 3,-0.3 -3,-0.5 -1,-0.2 0.864 112.4 47.6 -85.8 -37.9 4.8 50.7 -2.6 89 89 A A H < S+ 0 0 1 -4,-2.6 -2,-0.2 1,-0.2 -3,-0.2 0.821 108.2 53.3 -75.3 -30.9 3.0 48.2 -4.8 90 90 A S S < S+ 0 0 54 -4,-2.1 2,-0.9 -5,-0.2 -1,-0.2 0.646 94.5 71.5 -81.4 -15.5 -0.0 50.3 -5.8 91 91 A K S > S- 0 0 116 -4,-0.4 4,-2.5 -3,-0.3 3,-0.4 -0.864 70.9-155.7-101.5 102.2 1.9 53.3 -7.1 92 92 A T H > S+ 0 0 92 -2,-0.9 4,-2.1 1,-0.2 5,-0.2 0.822 92.7 57.1 -45.2 -33.9 3.5 52.2 -10.4 93 93 A Q H > S+ 0 0 133 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.966 111.1 37.6 -64.8 -54.1 6.1 54.9 -9.9 94 94 A S H > S+ 0 0 11 -3,-0.4 4,-2.0 1,-0.2 -1,-0.2 0.781 113.9 58.8 -69.8 -24.4 7.3 53.8 -6.4 95 95 A R H X S+ 0 0 13 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.923 107.5 45.5 -67.3 -45.2 7.0 50.1 -7.5 96 96 A R H X S+ 0 0 116 -4,-2.1 4,-2.8 -5,-0.3 -2,-0.2 0.866 110.8 54.9 -65.4 -37.5 9.4 50.7 -10.4 97 97 A T H X S+ 0 0 39 -4,-1.8 4,-1.3 2,-0.2 -2,-0.2 0.920 110.9 43.9 -63.1 -44.6 11.7 52.6 -8.1 98 98 A F H X S+ 0 0 0 -4,-2.0 4,-1.1 2,-0.2 3,-0.4 0.944 114.0 50.3 -65.7 -48.8 11.9 49.7 -5.7 99 99 A I H >< S+ 0 0 8 -4,-2.5 3,-0.8 1,-0.2 -2,-0.2 0.918 109.4 50.6 -55.5 -48.4 12.3 47.1 -8.5 100 100 A K H 3< S+ 0 0 131 -4,-2.8 -1,-0.2 1,-0.2 -2,-0.2 0.805 107.7 54.9 -61.5 -29.5 15.1 49.1 -10.1 101 101 A S H 3X S+ 0 0 19 -4,-1.3 4,-1.0 -3,-0.4 -1,-0.2 0.704 95.2 71.9 -77.9 -21.4 17.0 49.3 -6.8 102 102 A V H S+ 0 0 1 0, 0.0 4,-3.5 0, 0.0 5,-0.3 0.951 110.5 48.7 -52.4 -56.7 19.4 43.9 -8.6 104 104 A P H > S+ 0 0 73 0, 0.0 4,-2.6 0, 0.0 5,-0.2 0.880 111.9 52.5 -53.0 -34.6 22.4 46.2 -7.9 105 105 A F H X S+ 0 0 32 -4,-1.0 4,-2.1 2,-0.2 5,-0.2 0.977 113.3 41.0 -63.4 -56.3 21.8 45.7 -4.2 106 106 A L H X>S+ 0 0 0 -4,-2.4 5,-2.2 1,-0.2 4,-1.2 0.931 115.3 53.2 -56.5 -46.9 21.8 41.9 -4.4 107 107 A R H ><5S+ 0 0 76 -4,-3.5 3,-0.5 -5,-0.2 -1,-0.2 0.913 108.0 49.8 -56.4 -46.8 24.7 42.0 -6.9 108 108 A T H 3<5S+ 0 0 110 -4,-2.6 -1,-0.2 -5,-0.3 -2,-0.2 0.944 117.5 38.2 -59.0 -50.5 26.9 44.1 -4.6 109 109 A H H 3<5S- 0 0 48 -4,-2.1 -1,-0.2 -5,-0.2 -2,-0.2 0.476 114.9-110.5 -84.2 -1.0 26.4 42.0 -1.5 110 110 A G T <<5 + 0 0 28 -4,-1.2 2,-0.3 -3,-0.5 -3,-0.2 0.813 60.3 150.9 82.0 31.8 26.5 38.6 -3.3 111 111 A F < - 0 0 4 -5,-2.2 -1,-0.2 -6,-0.1 -39,-0.2 -0.660 39.1-149.1 -94.0 153.2 23.0 37.3 -3.1 112 112 A D S S- 0 0 36 -41,-3.0 40,-2.4 -2,-0.3 2,-0.3 0.490 71.2 -10.3 -99.2 -4.5 21.5 35.0 -5.7 113 113 A G E -de 72 152A 0 -42,-0.6 -40,-2.1 38,-0.3 2,-0.4 -0.995 62.1-103.5-176.3 174.9 18.0 36.2 -5.4 114 114 A L E -de 73 153A 0 38,-2.7 40,-2.2 -2,-0.3 2,-0.5 -0.924 21.2-157.9-117.4 140.4 15.2 38.0 -3.7 115 115 A D E -de 74 154A 0 -42,-2.9 -40,-2.8 -2,-0.4 2,-0.6 -0.980 12.0-144.6-120.2 123.4 12.5 36.5 -1.5 116 116 A L E +de 75 155A 5 38,-2.9 40,-2.4 -2,-0.5 2,-0.3 -0.784 18.1 178.5 -91.9 118.9 9.3 38.5 -1.0 117 117 A A E +d 76 0A 3 -42,-2.8 -40,-2.7 -2,-0.6 2,-0.8 -0.537 11.5 164.3-116.9 64.6 7.7 38.2 2.5 118 118 A W - 0 0 7 -2,-0.3 2,-0.5 38,-0.2 -40,-0.1 -0.739 28.4-147.2 -81.8 111.6 4.6 40.4 2.3 119 119 A L S S- 0 0 24 -2,-0.8 -39,-0.1 -42,-0.4 38,-0.0 -0.842 70.3 -3.6-126.9 97.3 2.5 39.4 5.3 120 120 A Y - 0 0 65 -2,-0.5 -1,-0.3 -38,-0.1 2,-0.3 0.603 55.4-160.8-137.5 163.3 -0.1 39.8 4.3 121 121 A P - 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0 0 9 -11,-1.3 2,-0.4 -2,-0.6 -66,-0.1 -0.757 47.8-103.8-144.8-170.3 6.0 21.6 18.7 307 308 A D - 0 0 3 -2,-0.2 2,-0.1 -13,-0.1 -13,-0.1 -0.989 27.6-173.2-128.1 123.9 7.8 19.4 16.1 308 309 A D > - 0 0 26 -2,-0.4 4,-1.7 1,-0.0 5,-0.2 -0.411 47.3 -86.4-102.8-174.0 10.3 16.6 16.9 309 310 A Q H > S+ 0 0 50 1,-0.2 4,-2.2 2,-0.2 5,-0.2 0.847 126.0 53.5 -61.2 -35.8 12.4 14.6 14.5 310 311 A E H > S+ 0 0 103 2,-0.2 4,-1.9 1,-0.2 -1,-0.2 0.939 109.7 44.8 -65.1 -49.7 9.6 12.1 13.9 311 312 A S H > S+ 0 0 1 1,-0.2 4,-1.6 2,-0.2 -1,-0.2 0.815 115.1 51.1 -66.9 -27.1 6.9 14.7 13.0 312 313 A V H X S+ 0 0 0 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.864 108.9 47.1 -78.6 -37.1 9.5 16.4 10.8 313 314 A K H X S+ 0 0 63 -4,-2.2 4,-2.2 1,-0.2 -2,-0.2 0.852 112.1 55.7 -69.8 -31.0 10.6 13.2 8.9 314 315 A N H X S+ 0 0 33 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.902 106.7 46.2 -65.2 -45.2 6.9 12.6 8.6 315 316 A K H X S+ 0 0 6 -4,-1.6 4,-2.4 1,-0.2 -1,-0.2 0.887 111.2 54.6 -65.7 -38.3 6.2 16.0 6.9 316 317 A A H X S+ 0 0 0 -4,-2.0 4,-1.7 1,-0.2 -2,-0.2 0.895 106.3 49.6 -63.3 -43.0 9.2 15.4 4.6 317 318 A R H X S+ 0 0 98 -4,-2.2 4,-2.7 2,-0.2 -1,-0.2 0.906 109.4 55.7 -62.6 -39.2 7.8 12.0 3.4 318 319 A Y H X S+ 0 0 22 -4,-1.8 4,-1.2 1,-0.2 -2,-0.2 0.969 106.6 45.3 -58.4 -57.7 4.5 13.7 2.8 319 320 A L H <>S+ 0 0 0 -4,-2.4 5,-2.7 1,-0.2 -1,-0.2 0.843 113.1 53.4 -59.1 -29.2 5.8 16.4 0.5 320 321 A K H ><5S+ 0 0 19 -4,-1.7 3,-1.8 1,-0.2 -1,-0.2 0.946 105.8 52.9 -67.0 -47.0 7.8 13.8 -1.3 321 322 A N H 3<5S+ 0 0 137 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.679 111.3 46.0 -61.7 -21.0 4.7 11.7 -1.9 322 323 A R T 3<5S- 0 0 82 -4,-1.2 -1,-0.3 -3,-0.2 -2,-0.2 0.362 114.7-118.8-102.4 5.2 2.9 14.6 -3.4 323 324 A Q T < 5 + 0 0 147 -3,-1.8 -3,-0.2 -5,-0.2 -2,-0.1 0.895 50.5 169.8 60.3 46.1 6.0 15.5 -5.6 324 325 A L < - 0 0 6 -5,-2.7 -94,-0.2 -6,-0.1 -91,-0.2 -0.315 46.6-111.4 -79.3 168.9 6.6 18.9 -4.1 325 326 A A S S- 0 0 12 -93,-2.2 -323,-2.2 -96,-1.0 2,-0.3 0.778 73.3 -76.6 -73.8 -26.8 9.7 20.8 -5.0 326 327 A G E -ah 2 233A 0 -94,-0.9 -92,-2.3 -325,-0.2 2,-0.3 -0.994 53.0 -59.6 161.8-163.2 11.1 20.6 -1.4 327 328 A A E -ah 3 234A 0 -325,-2.0 -323,-2.7 -2,-0.3 2,-0.4 -0.835 28.4-150.1-118.6 154.5 10.9 21.8 2.2 328 329 A M E -ah 4 235A 0 -94,-2.4 -92,-4.0 -2,-0.3 2,-0.5 -0.970 14.2-154.0-122.1 136.7 11.4 25.2 3.8 329 330 A V E -ah 5 236A 1 -325,-3.8 -323,-2.4 -2,-0.4 2,-0.5 -0.961 7.3-139.6-120.4 127.5 12.6 25.5 7.3 330 331 A W E S- h 0 237A 41 -94,-1.8 -92,-1.9 -2,-0.5 -91,-0.4 -0.961 75.1 -0.4-124.0 109.2 12.0 28.4 9.7 331 332 A A >> - 0 0 0 -2,-0.5 3,-2.5 -325,-0.5 4,-0.7 0.644 37.3-168.8-144.9 157.0 14.5 28.8 11.1 332 333 A L G >4 S+ 0 0 1 -326,-2.4 3,-0.7 -3,-0.4 5,-0.2 0.811 99.9 56.4 -50.2 -36.4 18.1 27.6 11.3 333 334 A D G 34 S+ 0 0 0 -327,-0.4 -1,-0.3 1,-0.2 4,-0.1 0.477 104.2 52.5 -77.7 -3.2 18.8 29.6 14.5 334 335 A L G <4 S+ 0 0 10 -3,-2.5 -60,-2.3 -61,-0.1 -59,-0.9 0.505 95.4 80.9-107.7 -9.3 15.9 28.1 16.3 335 336 A D S << S- 0 0 0 -4,-0.7 2,-2.1 -3,-0.7 3,-0.2 -0.322 109.5 -84.8 -83.3 172.7 17.0 24.5 15.6 336 337 A D + 0 0 0 1,-0.2 12,-2.9 -2,-0.1 -3,-0.1 -0.520 60.9 166.5 -82.3 75.9 19.8 23.1 17.9 337 338 A F S S+ 0 0 10 -2,-2.1 -1,-0.2 1,-0.2 -4,-0.1 0.809 77.0 43.8 -62.7 -31.6 22.6 24.7 15.8 338 339 A R S S- 0 0 107 -3,-0.2 -1,-0.2 9,-0.1 -2,-0.1 0.778 100.1-144.4 -81.3 -25.6 25.3 24.1 18.4 339 340 A G + 0 0 4 6,-0.1 7,-0.4 -4,-0.1 -2,-0.1 0.773 68.7 108.5 69.5 28.9 23.8 20.6 18.9 340 341 A T + 0 0 97 5,-0.1 5,-0.1 2,-0.1 7,-0.1 0.346 66.7 57.4-116.8 4.9 24.5 20.6 22.6 341 342 A F S S+ 0 0 45 3,-0.1 3,-0.1 1,-0.1 4,-0.1 0.728 97.6 55.8-104.4 -29.7 21.0 21.0 24.0 342 343 A b S S- 0 0 22 1,-0.2 2,-0.7 4,-0.2 -1,-0.1 0.285 98.0-114.7 -93.8 10.2 19.1 18.0 22.6 343 344 A G S S+ 0 0 51 -4,-0.0 -1,-0.2 1,-0.0 3,-0.2 -0.866 89.4 76.9 99.1-120.6 21.0 14.9 23.5 344 345 A Q S S- 0 0 91 -2,-0.7 2,-2.1 1,-0.2 -2,-0.2 0.049 92.7-114.3 -33.3 115.8 22.5 13.0 20.6 345 346 A N S S+ 0 0 163 -5,-0.1 2,-0.4 -4,-0.1 -1,-0.2 -0.372 70.3 135.4 -61.5 83.9 25.6 15.2 19.7 346 347 A L - 0 0 67 -2,-2.1 2,-0.4 -7,-0.4 -4,-0.2 -0.986 53.2-132.9-140.1 123.7 24.2 16.2 16.4 347 348 A T S S+ 0 0 68 -2,-0.4 -10,-0.2 1,-0.2 -9,-0.1 -0.646 89.4 5.0 -78.7 126.8 24.3 19.8 15.0 348 349 A F S > S- 0 0 2 -12,-2.9 4,-2.0 -2,-0.4 -1,-0.2 0.989 73.2-179.3 64.4 62.7 20.9 20.9 13.6 349 350 A P H > S+ 0 0 1 0, 0.0 4,-2.1 0, 0.0 5,-0.1 0.928 75.6 43.8 -60.7 -46.7 18.8 17.8 14.5 350 351 A L H > S+ 0 0 2 2,-0.2 4,-1.9 1,-0.2 5,-0.2 0.980 116.1 43.4 -64.1 -58.3 15.5 19.0 13.0 351 352 A T H > S+ 0 0 0 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.891 115.3 51.8 -56.3 -39.9 16.8 20.4 9.7 352 353 A S H X S+ 0 0 20 -4,-2.0 4,-2.7 2,-0.2 -1,-0.2 0.913 103.2 56.5 -63.1 -43.9 19.0 17.4 9.3 353 354 A A H X S+ 0 0 3 -4,-2.1 4,-1.7 -5,-0.2 -1,-0.2 0.925 109.7 47.8 -54.1 -43.4 16.2 14.9 9.8 354 355 A V H X S+ 0 0 1 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.949 109.6 51.8 -62.9 -48.1 14.4 16.7 7.0 355 356 A K H X S+ 0 0 78 -4,-2.3 4,-1.3 1,-0.2 -1,-0.2 0.846 106.9 54.8 -57.2 -36.9 17.5 16.5 4.7 356 357 A D H X S+ 0 0 90 -4,-2.7 4,-0.7 2,-0.2 3,-0.3 0.925 108.7 45.9 -63.9 -47.3 17.9 12.8 5.3 357 358 A V H >< S+ 0 0 2 -4,-1.7 3,-0.8 1,-0.2 -1,-0.2 0.895 112.6 51.7 -62.3 -39.8 14.4 12.0 4.2 358 359 A L H 3< S+ 0 0 16 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.756 106.2 55.5 -67.7 -25.0 14.8 14.2 1.2 359 360 A A H 3< S+ 0 0 80 -4,-1.3 -1,-0.2 -3,-0.3 -2,-0.2 0.620 96.5 81.6 -84.3 -13.6 18.0 12.4 0.3 360 361 A E << 0 0 116 -3,-0.8 -3,-0.0 -4,-0.7 0, 0.0 -0.145 360.0 360.0 -80.6-177.5 16.3 9.0 0.3 361 362 A V 0 0 180 -2,-0.0 -1,-0.0 0, 0.0 -4,-0.0 0.960 360.0 360.0 -58.4 360.0 14.4 7.5 -2.6