==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 04-JAN-06 2CBI . COMPND 2 MOLECULE: HYALURONIDASE; . SOURCE 2 ORGANISM_SCIENTIFIC: CLOSTRIDIUM PERFRINGENS; . AUTHOR F.V.RAO,H.C.DORFMUELLER,F.VILLA,M.ALLWOOD,I.M.EGGLESTON, . 1168 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 46634.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 826 70.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 108 9.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 60 5.1 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 0.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 6 0.5 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 . 56 4.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 107 9.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 439 37.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 26 2.2 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 4 0 0 2 2 3 1 2 0 7 6 0 3 0 0 3 1 0 0 0 2 0 0 0 0 0 2 RESIDUES PER ALPHA HELIX . 3 6 4 8 2 2 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 . 2 4 0 2 0 2 2 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 . 4 0 0 0 0 0 2 2 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 41 A V 0 0 117 0, 0.0 129,-0.3 0, 0.0 16,-0.1 0.000 360.0 360.0 360.0 -67.3 42.7 6.1 104.6 2 42 A L - 0 0 152 127,-0.1 16,-0.0 1,-0.1 0, 0.0 -0.375 360.0-117.7 -90.6 151.4 42.7 6.7 100.8 3 43 A V - 0 0 46 -2,-0.1 3,-0.1 125,-0.1 -1,-0.1 -0.708 33.9-136.9 -83.0 118.8 44.1 4.6 97.9 4 44 A P - 0 0 41 0, 0.0 2,-0.1 0, 0.0 -1,-0.1 0.011 42.0 -66.6 -60.7 174.6 46.8 6.6 96.0 5 45 A N - 0 0 76 417,-0.1 2,-0.4 116,-0.1 4,-0.0 -0.457 58.5-157.9 -59.8 139.5 47.0 6.7 92.2 6 46 A L - 0 0 14 -2,-0.1 112,-0.1 -3,-0.1 3,-0.1 -0.952 4.6-135.5-126.1 141.4 47.9 3.2 90.9 7 47 A N S S+ 0 0 0 -2,-0.4 2,-0.2 1,-0.2 114,-0.1 -0.923 90.2 23.8-148.6 127.1 49.4 2.2 87.6 8 48 A P S S- 0 0 1 0, 0.0 -1,-0.2 0, 0.0 398,-0.1 0.634 101.9-114.4 -64.8 166.2 48.4 -0.0 86.0 9 49 A T - 0 0 30 -2,-0.2 404,-0.1 401,-0.1 -2,-0.1 -0.636 36.2-119.0 -68.5 117.3 44.8 -0.0 87.4 10 50 A P - 0 0 9 0, 0.0 3,-0.2 0, 0.0 125,-0.1 -0.194 12.3-127.3 -58.0 152.0 44.4 -3.3 89.2 11 51 A E S S+ 0 0 51 1,-0.3 2,-0.4 123,-0.1 124,-0.2 0.956 93.8 18.2 -67.9 -51.6 41.7 -5.6 88.0 12 52 A N E +A 134 0A 69 122,-2.1 122,-1.4 2,-0.0 2,-0.4 -0.984 68.8 163.3-127.5 122.9 40.0 -6.1 91.3 13 53 A L E -A 133 0A 63 -2,-0.4 2,-0.4 120,-0.2 120,-0.2 -0.965 8.7-177.9-141.6 123.4 40.4 -3.8 94.3 14 54 A E E -A 132 0A 122 118,-2.7 118,-2.5 -2,-0.4 2,-0.6 -0.982 23.1-138.4-122.3 127.4 38.2 -3.6 97.3 15 55 A V E +A 131 0A 82 -2,-0.4 116,-0.3 116,-0.2 3,-0.1 -0.791 28.8 169.9 -78.6 120.5 38.7 -1.1 100.2 16 56 A V E + 0 0 55 114,-3.7 2,-0.3 -2,-0.6 115,-0.2 0.235 56.5 13.0-120.9 9.7 37.9 -3.2 103.4 17 57 A G E S-A 130 0A 22 113,-0.8 113,-0.5 -16,-0.1 3,-0.1 -0.968 81.3 -93.2-167.8-179.5 39.0 -0.9 106.2 18 58 A D E S- 0 0 139 -2,-0.3 2,-0.1 1,-0.3 -1,-0.0 0.618 71.2-116.9 -85.8 -9.3 40.1 2.6 107.1 19 59 A G E - 0 0 22 110,-0.1 2,-0.3 78,-0.1 -1,-0.3 -0.312 26.0-129.0 102.1 173.2 43.8 1.8 106.6 20 60 A F E -A 128 0A 36 108,-2.4 108,-2.9 -2,-0.1 2,-0.5 -0.948 17.5-102.8-151.6 171.6 46.8 1.8 109.0 21 61 A K E -A 127 0A 132 -2,-0.3 2,-0.3 106,-0.2 106,-0.3 -0.892 33.2-127.3-100.7 132.5 50.3 3.1 109.4 22 62 A I - 0 0 5 104,-3.5 4,-0.1 -2,-0.5 39,-0.0 -0.603 34.5-111.2 -71.9 134.0 53.2 0.7 108.8 23 63 A T - 0 0 51 -2,-0.3 -1,-0.1 2,-0.1 38,-0.1 -0.107 26.5-102.0 -68.4 169.1 55.6 0.6 111.7 24 64 A S S S+ 0 0 100 27,-0.1 28,-1.9 1,-0.1 2,-0.3 0.692 111.1 21.2 -70.4 -21.5 59.2 2.0 111.6 25 65 A S E S-b 52 0A 23 26,-0.2 37,-0.5 28,-0.0 2,-0.3 -0.972 82.4-150.0-136.9 157.9 60.4 -1.6 111.3 26 66 A I E -bc 53 62A 5 26,-2.8 28,-2.9 -2,-0.3 2,-0.6 -0.819 19.8-116.4-125.7 161.7 58.6 -4.7 110.1 27 67 A N E - c 0 63A 5 35,-3.3 37,-3.8 -2,-0.3 2,-0.5 -0.889 33.2-158.7 -89.5 120.2 58.3 -8.5 110.4 28 68 A L E - c 0 64A 16 -2,-0.6 2,-0.4 26,-0.3 37,-0.2 -0.923 11.9-178.1-107.5 126.8 59.2 -10.0 107.0 29 69 A V E + c 0 65A 26 35,-2.9 37,-3.0 -2,-0.5 44,-0.0 -0.979 59.2 27.9-133.0 131.9 57.9 -13.6 106.3 30 70 A G S > S+ 0 0 9 -2,-0.4 4,-2.4 35,-0.2 3,-0.3 0.447 71.4 127.6 98.1 5.8 58.4 -15.8 103.2 31 71 A E T 4 + 0 0 73 1,-0.2 8,-0.1 2,-0.2 -2,-0.1 0.785 68.5 59.1 -63.3 -35.8 61.8 -14.4 102.1 32 72 A E T 4 S+ 0 0 196 1,-0.2 -1,-0.2 3,-0.0 4,-0.1 0.928 121.2 25.9 -55.1 -43.9 63.5 -17.8 102.0 33 73 A E T 4 S+ 0 0 97 -3,-0.3 -2,-0.2 33,-0.2 -1,-0.2 0.712 98.8 99.2 -98.9 -24.3 61.0 -19.0 99.4 34 74 A A S < S- 0 0 8 -4,-2.4 5,-0.1 32,-0.3 33,-0.1 -0.287 89.8 -75.5 -74.2 148.4 59.7 -15.9 97.6 35 75 A D > - 0 0 29 1,-0.1 4,-2.2 3,-0.1 5,-0.2 -0.124 40.6-139.3 -40.7 126.2 60.9 -14.7 94.1 36 76 A E H > S+ 0 0 140 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.866 100.0 51.9 -59.9 -42.0 64.4 -13.1 94.6 37 77 A N H > S+ 0 0 39 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.905 111.6 48.0 -63.7 -41.6 63.8 -10.3 92.2 38 78 A A H > S+ 0 0 0 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.882 110.0 51.3 -65.2 -40.8 60.6 -9.4 94.0 39 79 A V H X S+ 0 0 7 -4,-2.2 4,-3.4 1,-0.2 -2,-0.2 0.901 110.2 50.7 -65.8 -37.9 62.3 -9.5 97.5 40 80 A N H X S+ 0 0 74 -4,-2.3 4,-2.7 2,-0.2 -1,-0.2 0.861 108.6 50.0 -66.3 -40.1 65.0 -7.2 96.2 41 81 A A H X S+ 0 0 9 -4,-1.8 4,-2.1 2,-0.2 -1,-0.2 0.922 113.4 47.9 -62.7 -43.1 62.5 -4.7 94.9 42 82 A L H X S+ 0 0 0 -4,-2.2 4,-2.7 2,-0.2 -2,-0.2 0.955 111.4 48.9 -62.7 -49.7 60.8 -4.9 98.3 43 83 A R H X S+ 0 0 105 -4,-3.4 4,-2.9 1,-0.2 -2,-0.2 0.927 110.6 51.8 -51.5 -53.1 64.1 -4.5 100.2 44 84 A E H X S+ 0 0 134 -4,-2.7 4,-2.7 1,-0.2 -1,-0.2 0.894 112.1 45.3 -49.0 -53.0 65.1 -1.4 98.0 45 85 A F H X S+ 0 0 27 -4,-2.1 4,-1.5 2,-0.2 -1,-0.2 0.942 111.0 52.9 -58.9 -49.7 61.8 0.3 98.7 46 86 A L H ><>S+ 0 0 3 -4,-2.7 5,-2.0 1,-0.2 3,-0.9 0.956 112.7 45.2 -53.7 -54.8 61.9 -0.5 102.4 47 87 A T H ><5S+ 0 0 105 -4,-2.9 3,-2.5 1,-0.2 -1,-0.2 0.938 108.7 54.8 -49.9 -56.2 65.4 1.1 102.6 48 88 A A H 3<5S+ 0 0 74 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.751 114.6 42.9 -54.6 -22.5 64.5 4.1 100.5 49 89 A N T <<5S- 0 0 77 -4,-1.5 -1,-0.3 -3,-0.9 -2,-0.2 0.160 114.1-112.6-114.4 17.5 61.6 4.8 103.0 50 90 A N T < 5 + 0 0 137 -3,-2.5 2,-0.6 1,-0.2 -3,-0.2 0.863 66.1 143.6 54.4 44.4 63.5 4.1 106.3 51 91 A I < - 0 0 6 -5,-2.0 -26,-0.2 -6,-0.1 -1,-0.2 -0.979 37.3-151.4-111.9 119.6 61.6 0.9 107.2 52 92 A E E -b 25 0A 140 -28,-1.9 -26,-2.8 -2,-0.6 2,-0.6 -0.530 10.9-122.3 -93.1 155.6 63.9 -1.6 108.8 53 93 A I E -b 26 0A 48 -28,-0.2 -26,-0.2 -2,-0.2 -28,-0.0 -0.897 28.9-120.9-102.4 122.3 63.6 -5.4 108.8 54 94 A N - 0 0 35 -28,-2.9 -26,-0.3 -2,-0.6 3,-0.1 -0.288 5.6-149.8 -56.9 135.3 63.4 -7.1 112.1 55 95 A S S S+ 0 0 119 1,-0.2 2,-0.3 -28,-0.1 -1,-0.1 0.840 89.7 16.1 -63.4 -40.1 66.0 -9.7 113.0 56 96 A E S S- 0 0 157 1,-0.0 -1,-0.2 -29,-0.0 2,-0.0 -0.894 101.7 -72.1-136.0 161.7 63.3 -11.4 115.1 57 97 A N S S- 0 0 113 -2,-0.3 -2,-0.1 1,-0.2 6,-0.1 -0.263 78.7 -11.1 -65.4 132.8 59.5 -11.2 115.3 58 98 A D + 0 0 67 4,-0.1 -1,-0.2 1,-0.1 5,-0.0 0.833 19.7 170.4 71.6 68.0 57.3 -8.5 116.6 59 99 A P S S- 0 0 102 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.067 98.1 -82.3 -63.5 24.6 57.9 -5.5 118.7 60 100 A N S S+ 0 0 131 1,-0.2 2,-0.2 2,-0.0 3,-0.1 0.894 88.8 161.4 49.8 54.2 54.4 -5.6 117.3 61 101 A S - 0 0 8 1,-0.2 -35,-0.2 -38,-0.1 -1,-0.2 -0.527 50.0 -78.3 -84.9 160.8 55.6 -4.3 114.1 62 102 A T E -c 26 0A 6 -37,-0.5 -35,-3.3 -2,-0.2 2,-0.5 -0.269 47.3-133.3 -48.6 146.0 53.7 -4.6 110.9 63 103 A T E -cd 27 101A 17 37,-2.3 39,-2.6 -37,-0.2 2,-0.5 -0.959 17.8-168.8-112.6 125.9 54.0 -8.0 109.3 64 104 A L E -cd 28 102A 2 -37,-3.8 -35,-2.9 -2,-0.5 2,-0.5 -0.963 3.8-168.6-111.5 119.9 54.7 -8.4 105.6 65 105 A I E -cd 29 103A 2 37,-3.0 39,-2.9 -2,-0.5 2,-0.4 -0.945 8.6-176.1-112.2 126.6 54.3 -11.9 104.1 66 106 A I E + d 0 104A 0 -37,-3.0 2,-0.3 -2,-0.5 -32,-0.3 -0.968 19.3 105.0-125.6 135.6 55.6 -12.6 100.6 67 107 A G E - d 0 105A 0 37,-2.1 39,-2.6 -2,-0.4 2,-0.3 -0.993 54.2 -93.9 179.5-179.5 55.5 -15.6 98.2 68 108 A E E > - d 0 106A 20 -2,-0.3 3,-1.0 37,-0.3 39,-0.2 -0.700 54.0 -91.1-101.4 162.5 54.1 -17.5 95.2 69 109 A V T 3 S+ 0 0 9 37,-2.2 2,-0.4 -2,-0.3 -1,-0.2 -0.279 116.5 32.8 -57.1 162.5 51.3 -20.0 95.4 70 110 A D T 3 S+ 0 0 144 1,-0.2 -1,-0.2 -3,-0.1 2,-0.1 0.231 90.0 122.5 71.8 -22.2 52.6 -23.5 96.0 71 111 A D S < S- 0 0 42 -3,-1.0 2,-1.4 -2,-0.4 -1,-0.2 -0.400 77.3-108.3 -58.9 152.3 55.5 -22.0 98.1 72 112 A D S S+ 0 0 124 -3,-0.1 -1,-0.1 -2,-0.1 -39,-0.1 -0.644 73.1 127.4 -88.8 77.4 55.7 -23.5 101.6 73 113 A I >> - 0 0 13 -2,-1.4 3,-1.4 -5,-0.1 4,-0.9 -0.804 31.6-178.9-133.9 89.7 54.6 -20.4 103.6 74 114 A P H 3> S+ 0 0 80 0, 0.0 4,-1.2 0, 0.0 -1,-0.1 0.774 81.1 62.5 -62.1 -26.5 51.6 -21.4 105.9 75 115 A E H 3> S+ 0 0 98 1,-0.2 4,-1.8 2,-0.2 5,-0.1 0.679 94.6 61.8 -69.8 -24.0 51.4 -17.7 107.2 76 116 A L H <> S+ 0 0 3 -3,-1.4 4,-2.6 2,-0.2 5,-0.2 0.949 103.1 46.5 -70.2 -50.8 50.6 -16.4 103.7 77 117 A D H X S+ 0 0 103 -4,-0.9 4,-1.3 1,-0.2 5,-0.3 0.872 112.2 52.8 -56.4 -42.4 47.3 -18.3 103.3 78 118 A E H < S+ 0 0 153 -4,-1.2 -1,-0.2 1,-0.2 3,-0.2 0.926 113.5 42.5 -57.5 -49.0 46.3 -17.3 106.8 79 119 A A H < S+ 0 0 15 -4,-1.8 -2,-0.2 1,-0.2 -1,-0.2 0.836 112.5 52.2 -70.2 -36.4 46.9 -13.6 106.1 80 120 A L H >< S- 0 0 1 -4,-2.6 3,-2.0 -5,-0.1 -1,-0.2 0.740 86.6-171.6 -71.5 -22.9 45.3 -13.8 102.6 81 121 A N T 3< S- 0 0 113 -4,-1.3 -3,-0.1 1,-0.3 3,-0.1 0.811 70.6 -16.2 20.0 85.1 42.1 -15.3 104.2 82 122 A G T 3 S+ 0 0 76 -5,-0.3 -1,-0.3 1,-0.3 2,-0.2 -0.191 114.8 101.7 97.0 -40.3 40.0 -16.4 101.2 83 123 A T < + 0 0 31 -3,-2.0 2,-0.3 -6,-0.1 -1,-0.3 -0.554 49.9 166.8 -82.0 144.9 41.8 -14.2 98.6 84 124 A T - 0 0 40 -2,-0.2 3,-0.2 -3,-0.1 9,-0.1 -0.996 45.6-145.0-159.2 151.0 44.3 -16.1 96.4 85 125 A A S > S+ 0 0 0 -2,-0.3 3,-1.5 21,-0.2 7,-0.1 0.412 78.3 97.8 -98.4 2.9 46.4 -16.0 93.3 86 126 A E T 3 S+ 0 0 93 1,-0.3 -1,-0.1 20,-0.0 6,-0.0 0.794 84.3 43.6 -67.1 -37.0 45.8 -19.7 92.4 87 127 A N T 3 S+ 0 0 135 -3,-0.2 -1,-0.3 2,-0.0 2,-0.2 0.221 97.7 103.4 -90.6 11.6 43.0 -19.2 89.9 88 128 A L S < S- 0 0 20 -3,-1.5 3,-0.1 1,-0.1 4,-0.1 -0.582 74.7-105.3 -96.5 155.9 44.7 -16.3 88.2 89 129 A K > - 0 0 98 -2,-0.2 3,-2.0 1,-0.2 18,-0.2 -0.134 57.4 -62.9 -66.4 169.8 46.7 -16.2 84.9 90 130 A E T 3 S+ 0 0 152 1,-0.2 -1,-0.2 17,-0.1 3,-0.1 -0.219 127.2 25.6 -47.0 144.3 50.5 -16.1 84.6 91 131 A E T 3 S+ 0 0 12 1,-0.2 -1,-0.2 45,-0.1 23,-0.1 0.384 96.6 134.6 71.1 -2.5 51.9 -12.8 86.1 92 132 A G < + 0 0 0 -3,-2.0 15,-3.3 -7,-0.1 16,-0.6 -0.304 29.4 176.3 -68.8 157.6 48.9 -12.6 88.4 93 133 A Y E -EF 106 135A 0 42,-2.6 42,-2.4 13,-0.3 2,-0.4 -0.977 23.3-139.1-150.1 167.7 49.0 -11.8 92.1 94 134 A A E -EF 105 134A 0 11,-2.8 11,-2.8 -2,-0.3 2,-0.4 -0.959 16.9-169.8-123.4 145.1 46.8 -11.2 95.1 95 135 A L E -EF 104 133A 0 38,-2.2 38,-2.4 -2,-0.4 2,-0.4 -0.989 4.5-179.1-138.4 128.3 47.5 -8.5 97.7 96 136 A V E -EF 103 132A 3 7,-2.2 7,-3.4 -2,-0.4 2,-0.5 -0.991 5.2-177.7-131.6 119.7 45.7 -8.1 101.1 97 137 A S E +E 102 0A 0 34,-2.0 2,-0.3 -2,-0.4 34,-0.2 -0.990 23.1 150.0-112.0 121.7 46.4 -5.4 103.6 98 138 A N E > -E 101 0A 68 3,-2.4 3,-1.2 -2,-0.5 32,-0.0 -0.911 58.4 -22.3-156.4 125.2 44.4 -5.7 106.8 99 139 A D T 3 S- 0 0 132 -2,-0.3 3,-0.1 1,-0.3 -79,-0.0 0.859 128.2 -31.2 49.3 57.2 44.9 -4.9 110.4 100 140 A G T 3 S+ 0 0 26 1,-0.2 -37,-2.3 -38,-0.1 2,-0.3 0.463 120.5 96.3 86.1 3.1 48.7 -4.7 110.8 101 141 A K E < -dE 63 98A 106 -3,-1.2 -3,-2.4 -39,-0.2 2,-0.4 -0.943 48.8-167.7-127.1 146.1 49.4 -7.3 108.1 102 142 A I E -dE 64 97A 1 -39,-2.6 -37,-3.0 -2,-0.3 2,-0.4 -0.964 9.1-169.9-134.1 117.2 50.3 -7.2 104.4 103 143 A A E -dE 65 96A 0 -7,-3.4 -7,-2.2 -2,-0.4 2,-0.4 -0.898 3.7-174.7-110.5 130.6 50.2 -10.4 102.3 104 144 A I E +dE 66 95A 0 -39,-2.9 -37,-2.1 -2,-0.4 2,-0.5 -0.983 7.3 175.1-125.0 119.8 51.6 -10.5 98.7 105 145 A E E -dE 67 94A 5 -11,-2.8 -11,-2.8 -2,-0.4 -37,-0.3 -0.964 11.9-159.5-130.1 115.5 51.1 -13.7 96.8 106 146 A G E -dE 68 93A 0 -39,-2.6 -37,-2.2 -2,-0.5 -13,-0.3 -0.567 23.8-137.7 -84.7 150.5 52.1 -14.2 93.1 107 147 A K S S- 0 0 58 -15,-3.3 2,-0.3 -2,-0.2 -14,-0.1 0.856 98.2 -5.3 -68.1 -35.5 50.7 -16.8 90.8 108 148 A D S > S- 0 0 41 -16,-0.6 4,-1.7 -40,-0.1 3,-0.2 -0.846 95.2 -83.2-142.0 173.7 54.3 -17.1 89.7 109 149 A G H > S+ 0 0 18 -2,-0.3 4,-2.2 1,-0.2 5,-0.2 0.862 128.9 56.7 -50.4 -42.1 57.5 -15.2 90.6 110 150 A D H > S+ 0 0 58 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.936 106.5 50.6 -52.6 -51.1 56.6 -12.5 88.0 111 151 A G H > S+ 0 0 0 -3,-0.2 4,-2.4 1,-0.2 -1,-0.2 0.850 108.2 52.1 -52.3 -41.4 53.2 -12.0 89.8 112 152 A T H X S+ 0 0 0 -4,-1.7 4,-1.8 2,-0.2 -1,-0.2 0.907 107.6 51.6 -66.2 -42.8 55.0 -11.6 93.1 113 153 A F H X S+ 0 0 2 -4,-2.2 4,-1.9 2,-0.2 -2,-0.2 0.930 110.8 48.4 -60.3 -46.1 57.3 -8.9 91.6 114 154 A Y H X S+ 0 0 0 -4,-2.4 4,-2.5 1,-0.2 -2,-0.2 0.875 107.0 55.7 -64.6 -37.4 54.2 -7.0 90.3 115 155 A G H X S+ 0 0 0 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.856 106.9 51.0 -58.6 -37.2 52.5 -7.3 93.7 116 156 A V H X S+ 0 0 0 -4,-1.8 4,-2.8 2,-0.2 -2,-0.2 0.916 107.8 52.6 -62.9 -43.3 55.6 -5.6 95.2 117 157 A Q H X S+ 0 0 4 -4,-1.9 4,-1.4 1,-0.2 -2,-0.2 0.901 110.9 47.4 -62.1 -42.3 55.2 -2.9 92.5 118 158 A T H X S+ 0 0 0 -4,-2.5 4,-1.7 2,-0.2 3,-0.3 0.952 109.6 52.6 -58.2 -55.4 51.6 -2.4 93.6 119 159 A F H X S+ 0 0 3 -4,-2.6 4,-1.2 1,-0.2 3,-0.3 0.893 106.4 54.5 -44.5 -53.2 52.5 -2.3 97.3 120 160 A K H < S+ 0 0 28 -4,-2.8 3,-0.5 1,-0.2 -1,-0.2 0.888 110.6 44.8 -50.0 -45.6 55.1 0.4 96.6 121 161 A Q H < S+ 0 0 37 -4,-1.4 -1,-0.2 -3,-0.3 -2,-0.2 0.783 109.6 57.7 -75.1 -22.7 52.5 2.6 95.0 122 162 A L H < S+ 0 0 0 -4,-1.7 2,-0.5 -3,-0.3 -1,-0.2 0.704 89.8 83.8 -78.8 -22.4 50.0 1.9 97.8 123 163 A V < + 0 0 18 -4,-1.2 2,-0.5 -3,-0.5 5,-0.2 -0.746 51.9 177.5 -93.7 122.5 52.1 3.2 100.6 124 164 A K B > S-G 127 0A 131 3,-2.9 3,-2.1 -2,-0.5 -3,-0.0 -0.964 75.6 -24.1-126.1 113.9 52.2 6.9 101.3 125 165 A E T 3 S- 0 0 149 -2,-0.5 -1,-0.1 1,-0.3 3,-0.1 0.914 125.5 -53.0 48.5 51.5 54.3 8.1 104.3 126 166 A S T 3 S+ 0 0 32 1,-0.2 -104,-3.5 -105,-0.1 2,-0.4 0.258 114.4 122.5 69.6 -7.3 54.0 4.7 105.8 127 167 A N E < -AG 21 124A 62 -3,-2.1 -3,-2.9 -106,-0.3 -106,-0.2 -0.705 37.8-179.1 -87.6 133.2 50.2 4.8 105.5 128 168 A I E -A 20 0A 1 -108,-2.9 -108,-2.4 -2,-0.4 -5,-0.1 -0.986 23.9-124.7-131.2 137.2 48.5 2.1 103.6 129 169 A P E - 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0 0 89 1,-0.1 -1,-0.1 -13,-0.1 -14,-0.1 -0.255 49.8 -96.9 -53.8 146.1 43.9 16.3 69.5 457 497 A D S S- 0 0 6 1,-0.2 -16,-0.2 -16,-0.1 5,-0.2 -0.442 90.3 -19.1 -67.6 144.0 45.8 19.1 71.3 458 498 A A S > S- 0 0 0 -18,-3.2 4,-2.7 1,-0.1 -1,-0.2 0.740 72.9-175.7 27.3 64.0 44.0 20.9 74.1 459 499 A P H > S+ 0 0 43 0, 0.0 4,-2.0 0, 0.0 -1,-0.1 0.872 78.5 49.7 -58.8 -38.9 40.4 19.9 73.0 460 500 A E H > S+ 0 0 118 2,-0.2 4,-2.1 1,-0.2 5,-0.1 0.869 112.2 47.4 -68.6 -42.1 38.6 22.0 75.6 461 501 A L H > S+ 0 0 1 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.929 110.5 52.4 -64.9 -45.4 40.6 25.1 74.7 462 502 A R H X S+ 0 0 37 -4,-2.7 4,-2.5 -5,-0.2 -2,-0.2 0.888 109.2 50.6 -57.8 -36.0 40.0 24.5 71.0 463 503 A A H X S+ 0 0 54 -4,-2.0 4,-2.6 2,-0.2 -2,-0.2 0.922 109.7 49.7 -70.2 -40.4 36.2 24.2 71.7 464 504 A K H X S+ 0 0 67 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.906 110.5 50.5 -60.8 -43.9 36.2 27.5 73.7 465 505 A M H X S+ 0 0 0 -4,-2.5 4,-2.0 2,-0.2 -2,-0.2 0.935 109.8 50.1 -58.3 -51.1 38.0 29.2 70.8 466 506 A D H X S+ 0 0 78 -4,-2.5 4,-2.3 1,-0.2 -2,-0.2 0.916 109.8 51.7 -50.5 -48.6 35.4 27.8 68.3 467 507 A E H X S+ 0 0 84 -4,-2.6 4,-3.0 1,-0.2 5,-0.2 0.904 106.0 55.2 -58.7 -41.1 32.7 29.2 70.6 468 508 A L H X S+ 0 0 0 -4,-2.3 4,-3.1 1,-0.2 5,-0.2 0.949 108.4 47.3 -54.3 -54.1 34.3 32.6 70.6 469 509 A W H X S+ 0 0 10 -4,-2.0 4,-2.1 2,-0.2 -1,-0.2 0.895 113.7 47.5 -59.4 -41.7 34.3 32.8 66.8 470 510 A N H < S+ 0 0 60 -4,-2.3 4,-0.3 2,-0.2 -2,-0.2 0.924 113.4 47.5 -75.9 -30.8 30.7 31.8 66.6 471 511 A K H ><>S+ 0 0 54 -4,-3.0 5,-2.5 -5,-0.2 3,-1.2 0.949 114.5 46.6 -61.2 -47.9 29.6 34.2 69.3 472 512 A L H ><5S+ 0 0 8 -4,-3.1 3,-0.5 1,-0.3 -2,-0.2 0.826 115.9 45.3 -68.7 -31.2 31.5 37.0 67.7 473 513 A S T 3<5S+ 0 0 29 -4,-2.1 -1,-0.3 -5,-0.2 -2,-0.2 0.388 113.4 51.0 -92.0 3.4 30.2 36.2 64.2 474 514 A S T < 5S- 0 0 62 -3,-1.2 -1,-0.2 -4,-0.3 -2,-0.2 0.215 112.5-112.2-115.8 11.7 26.6 35.8 65.6 475 515 A K T < 5 + 0 0 116 -3,-0.5 2,-0.4 1,-0.2 -3,-0.2 0.884 69.5 143.9 55.0 38.4 26.4 39.1 67.4 476 516 A E < - 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0 0 76 0, 0.0 4,-3.0 0, 0.0 3,-1.0 -0.357 31.5-111.3 -59.8 151.5 45.4 44.9 30.6 1090 545 B E H 3> S+ 0 0 148 1,-0.3 4,-3.5 2,-0.2 5,-0.3 0.872 116.1 64.3 -52.7 -44.6 45.9 47.4 33.5 1091 546 B V H 34 S+ 0 0 55 1,-0.2 -1,-0.3 2,-0.2 -111,-0.3 0.850 114.9 31.5 -53.4 -38.0 42.2 47.1 34.5 1092 547 B A H X> S+ 0 0 1 -3,-1.0 3,-1.4 2,-0.1 4,-0.8 0.915 119.8 52.6 -80.4 -48.4 42.9 43.3 35.3 1093 548 B L H >X S+ 0 0 44 -4,-3.0 4,-1.7 1,-0.3 3,-0.9 0.857 99.4 60.0 -65.2 -39.2 46.5 43.7 36.4 1094 549 B E H 3< S+ 0 0 123 -4,-3.5 -1,-0.3 1,-0.2 4,-0.1 0.763 107.8 49.1 -59.7 -21.2 46.0 46.5 39.0 1095 550 B E H <4 S+ 0 0 19 -3,-1.4 -1,-0.2 -5,-0.3 -2,-0.2 0.727 124.3 24.1 -88.5 -21.5 43.6 44.1 40.9 1096 551 B C H S+ 0 0 127 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.875 111.0 48.7 -70.3 -36.7 50.3 41.0 44.3 1099 554 B Q H > S+ 0 0 0 -3,-0.4 4,-2.5 2,-0.2 -2,-0.2 0.849 108.1 55.0 -73.2 -36.3 48.6 37.6 43.9 1100 555 B L H X S+ 0 0 0 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.947 109.3 47.5 -56.5 -52.6 50.5 37.0 40.7 1101 556 B D H X S+ 0 0 79 -4,-2.1 4,-2.3 -5,-0.2 -2,-0.2 0.897 111.5 52.4 -53.7 -45.2 53.8 37.7 42.5 1102 557 B E H X S+ 0 0 6 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.876 107.2 49.3 -61.1 -43.3 52.7 35.3 45.3 1103 558 B L H X S+ 0 0 0 -4,-2.5 4,-2.8 2,-0.2 -1,-0.2 0.896 110.2 52.3 -65.8 -37.3 51.9 32.4 43.0 1104 559 B I H X S+ 0 0 14 -4,-2.1 4,-2.4 2,-0.2 -2,-0.2 0.939 109.3 50.2 -58.4 -46.1 55.3 32.9 41.4 1105 560 B T H X S+ 0 0 24 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.926 112.7 46.4 -54.7 -48.5 56.8 32.7 44.9 1106 561 B L H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -2,-0.2 0.886 110.4 52.0 -63.5 -42.6 54.9 29.6 45.6 1107 562 B A H X S+ 0 0 1 -4,-2.8 4,-2.5 2,-0.2 -1,-0.2 0.897 110.9 48.2 -60.3 -43.2 55.8 27.9 42.3 1108 563 B Q H X S+ 0 0 55 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.887 113.1 48.4 -64.6 -36.8 59.5 28.6 43.0 1109 564 B G H X S+ 0 0 0 -4,-2.1 4,-1.7 2,-0.2 -2,-0.2 0.830 109.9 51.6 -69.1 -36.1 59.0 27.2 46.5 1110 565 B D H X S+ 0 0 0 -4,-2.5 4,-1.6 2,-0.2 -2,-0.2 0.888 108.8 51.0 -68.2 -41.3 57.3 24.1 45.0 1111 566 B K H X S+ 0 0 99 -4,-2.5 4,-2.1 1,-0.2 3,-0.5 0.956 109.9 49.7 -53.5 -53.0 60.2 23.7 42.6 1112 567 B A H X S+ 0 0 2 -4,-2.1 4,-2.0 1,-0.2 -2,-0.2 0.824 105.7 58.5 -60.9 -35.1 62.7 23.8 45.6 1113 568 B S H X S+ 0 0 0 -4,-1.7 4,-1.5 2,-0.2 -1,-0.2 0.858 105.9 47.2 -60.4 -42.9 60.5 21.3 47.4 1114 569 B L H X S+ 0 0 0 -4,-1.6 4,-3.0 -3,-0.5 5,-0.2 0.869 107.8 57.2 -66.7 -35.7 61.0 18.7 44.6 1115 570 B D H X S+ 0 0 42 -4,-2.1 4,-2.4 1,-0.2 -2,-0.2 0.917 104.8 52.1 -58.9 -43.4 64.7 19.5 44.7 1116 571 B M H X S+ 0 0 0 -4,-2.0 4,-1.8 2,-0.2 -1,-0.2 0.910 111.3 46.5 -55.9 -46.7 64.7 18.5 48.4 1117 572 B I H X S+ 0 0 4 -4,-1.5 4,-2.8 2,-0.2 5,-0.2 0.944 113.2 47.6 -63.2 -50.5 63.0 15.2 47.5 1118 573 B V H X S+ 0 0 43 -4,-3.0 4,-2.6 1,-0.2 -1,-0.2 0.885 109.8 54.6 -59.4 -37.4 65.4 14.5 44.6 1119 574 B A H <>S+ 0 0 4 -4,-2.4 5,-3.3 -5,-0.2 4,-0.3 0.888 109.3 47.4 -66.3 -37.9 68.4 15.4 46.9 1120 575 B Q H ><5S+ 0 0 24 -4,-1.8 3,-1.3 3,-0.2 -2,-0.2 0.936 111.1 50.4 -64.4 -48.5 67.2 12.8 49.4 1121 576 B L H 3<5S+ 0 0 83 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.900 115.6 44.2 -52.6 -43.4 66.7 10.2 46.6 1122 577 B N T 3<5S- 0 0 114 -4,-2.6 -1,-0.3 -5,-0.2 -2,-0.2 0.556 108.8-129.1 -77.4 -6.5 70.2 11.1 45.6 1123 578 B E T < 5 + 0 0 177 -3,-1.3 2,-0.7 -4,-0.3 -3,-0.2 0.933 55.8 151.1 51.7 49.1 71.5 11.0 49.3 1124 579 B D >< - 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0 0 2 -3,-1.4 2,-0.5 -4,-0.4 -801,-0.1 -0.671 45.3-176.2 -87.3 132.4 59.1 15.0 54.7 1165 620 B D > - 0 0 50 -2,-0.4 3,-1.4 1,-0.1 4,-0.2 -0.910 11.6-168.6-132.6 105.8 62.0 12.6 55.5 1166 621 B L G > S+ 0 0 36 -2,-0.5 3,-1.5 1,-0.3 -1,-0.1 0.725 81.5 71.4 -64.3 -23.8 62.7 9.8 53.0 1167 622 B T G 3 S+ 0 0 85 1,-0.3 -1,-0.3 2,-0.2 -2,-0.0 0.742 93.2 57.4 -67.3 -19.9 65.2 8.1 55.3 1168 623 B L G < 0 0 23 -3,-1.4 -1,-0.3 1,-0.2 -2,-0.2 0.512 360.0 360.0 -88.6 -8.8 62.3 7.0 57.6 1169 624 B I < 0 0 47 -3,-1.5 -1,-0.2 -4,-0.2 -2,-0.2 0.919 360.0 360.0 -81.6 360.0 60.4 5.1 54.9