==== 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 BLOOD CLOTTING 25-APR-08 2ZNH . COMPND 2 MOLECULE: ANTITHROMBIN-III; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.YAMASAKI,J.A.HUNTINGTON . 820 6 6 2 4 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 33085.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 596 72.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 2.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 212 25.9 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 4 0.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 2 0.2 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 . 72 8.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 77 9.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 184 22.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 7 0.9 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 2 1 1 2 3 1 1 1 0 0 0 0 2 0 0 0 2 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 2 0 0 0 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 0 PARALLEL BRIDGES PER LADDER . 5 1 2 2 0 6 2 2 0 4 0 1 3 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 2 0 0 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 1 A H 0 0 257 0, 0.0 2,-0.4 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -37.3 25.6 -34.4 -11.0 2 2 A G + 0 0 72 2,-0.0 0, 0.0 0, 0.0 0, 0.0 -0.902 360.0 168.1-132.1 110.2 27.3 -32.6 -8.3 3 3 A S - 0 0 109 -2,-0.4 3,-0.1 3,-0.0 0, 0.0 -0.954 37.1-119.8-121.9 115.3 27.1 -28.8 -7.6 4 4 A P - 0 0 120 0, 0.0 2,-0.8 0, 0.0 -2,-0.0 -0.161 29.6-112.7 -49.0 134.0 28.5 -27.4 -4.3 5 5 A V - 0 0 104 4,-0.0 2,-0.6 1,-0.0 10,-0.0 -0.640 42.4-176.8 -73.7 112.0 25.9 -25.6 -2.2 6 6 A D >> - 0 0 76 -2,-0.8 4,-2.2 1,-0.1 3,-0.9 -0.934 19.8-167.8-119.7 113.2 27.0 -22.0 -2.3 7 7 A I T 34 S+ 0 0 11 -2,-0.6 -1,-0.1 137,-0.3 8,-0.1 0.816 84.0 68.7 -67.0 -32.8 25.1 -19.4 -0.3 8 8 A a T 34 S+ 0 0 60 1,-0.2 -1,-0.2 100,-0.1 105,-0.0 0.831 113.9 33.9 -55.7 -28.6 26.7 -16.4 -2.0 9 9 A T T <4 S+ 0 0 115 -3,-0.9 -2,-0.2 2,-0.1 -1,-0.2 0.910 104.3 87.7 -88.8 -53.9 24.8 -17.5 -5.0 10 10 A A < - 0 0 19 -4,-2.2 -3,-0.0 1,-0.1 -5,-0.0 0.229 67.2-128.2 -49.1 163.9 21.6 -19.0 -3.6 11 11 A K > - 0 0 56 1,-0.0 4,-1.5 0, 0.0 3,-0.2 -0.696 41.1 -90.6-108.8 163.6 18.3 -17.4 -2.6 12 12 A P T 4 S+ 0 0 88 0, 0.0 5,-0.2 0, 0.0 -2,-0.1 0.850 126.4 50.5 -43.1 -43.5 16.5 -17.7 0.8 13 13 A R T 4 S+ 0 0 95 1,-0.2 4,-0.1 3,-0.1 -3,-0.0 0.954 103.6 56.3 -62.8 -53.2 14.6 -20.8 -0.5 14 14 A D T 4 S+ 0 0 67 -3,-0.2 -1,-0.2 1,-0.1 -7,-0.0 0.860 98.0 68.0 -47.6 -45.6 17.6 -22.7 -1.9 15 15 A I S < S- 0 0 6 -4,-1.5 2,-1.0 -8,-0.1 -1,-0.1 -0.706 79.8-146.7 -85.3 106.3 19.4 -22.7 1.4 16 16 A P - 0 0 91 0, 0.0 2,-0.7 0, 0.0 -3,-0.1 -0.590 23.4-179.3 -73.9 102.5 17.6 -24.8 4.0 17 17 A M + 0 0 23 -2,-1.0 84,-0.1 -5,-0.2 88,-0.1 -0.883 12.3 158.3-113.0 108.9 18.2 -23.1 7.3 18 18 A N - 0 0 108 -2,-0.7 2,-0.1 119,-0.1 123,-0.1 -0.872 14.3-174.0-131.7 99.2 16.7 -24.6 10.4 19 19 A P - 0 0 23 0, 0.0 58,-0.1 0, 0.0 82,-0.1 -0.444 42.1-102.4 -85.2 166.3 18.2 -23.7 13.8 20 20 A M S S+ 0 0 109 56,-0.7 2,-0.3 -2,-0.1 57,-0.1 0.920 101.9 13.6 -51.6 -49.2 17.1 -25.4 17.0 21 21 A b - 0 0 22 57,-0.5 2,-0.3 55,-0.2 57,-0.1 -0.787 66.5-150.9-128.0 169.5 15.0 -22.3 18.0 22 22 A I - 0 0 78 -2,-0.3 2,-0.4 78,-0.1 58,-0.2 -0.942 2.3-154.0-138.3 158.0 13.6 -19.2 16.5 23 23 A Y - 0 0 45 -2,-0.3 77,-1.1 60,-0.1 2,-0.8 -0.993 14.2-140.1-136.8 127.3 12.7 -15.7 17.7 24 24 A R B -A 99 0A 80 -2,-0.4 75,-0.2 75,-0.2 74,-0.1 -0.785 22.0-156.2 -91.1 109.8 10.1 -13.4 16.1 25 25 A S 0 0 13 73,-1.1 72,-0.2 -2,-0.8 -2,-0.0 -0.732 360.0 360.0 -93.0 131.5 11.3 -9.8 16.1 26 26 A P 0 0 123 0, 0.0 412,-0.3 0, 0.0 -1,-0.1 0.461 360.0 360.0 -36.9 360.0 9.0 -6.8 15.9 27 ! 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 28 44 A T > 0 0 152 0, 0.0 3,-1.1 0, 0.0 4,-0.2 0.000 360.0 360.0 360.0 51.7 15.9 -6.5 -2.0 29 45 A N T 3> + 0 0 62 1,-0.3 4,-1.3 2,-0.2 5,-0.0 0.009 360.0 109.8 -81.5 28.1 19.5 -6.3 -0.7 30 46 A R H 3> S+ 0 0 43 2,-0.2 4,-3.8 1,-0.2 -1,-0.3 0.763 70.6 61.9 -72.2 -25.5 18.1 -3.9 1.8 31 47 A R H <> S+ 0 0 54 -3,-1.1 4,-3.3 2,-0.3 5,-0.3 0.984 99.5 47.3 -64.4 -61.7 18.8 -6.8 4.2 32 48 A V H > S+ 0 0 8 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.904 117.8 48.2 -47.1 -39.3 22.5 -7.0 3.8 33 49 A W H X S+ 0 0 120 -4,-1.3 4,-2.1 1,-0.2 -2,-0.3 0.965 109.9 48.7 -65.0 -53.9 22.2 -3.2 4.3 34 50 A E H X S+ 0 0 32 -4,-3.8 4,-2.0 1,-0.2 -2,-0.2 0.817 110.1 54.1 -57.0 -32.3 20.0 -3.5 7.3 35 51 A L H X S+ 0 0 0 -4,-3.3 4,-2.9 2,-0.2 -1,-0.2 0.910 105.6 50.7 -70.8 -41.1 22.4 -6.0 8.8 36 52 A S H X S+ 0 0 1 -4,-1.9 4,-3.2 -5,-0.3 364,-0.3 0.897 108.9 53.1 -63.6 -37.0 25.4 -3.7 8.4 37 53 A K H X S+ 0 0 88 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.959 109.3 48.6 -60.1 -49.4 23.5 -0.9 10.1 38 54 A A H X S+ 0 0 0 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.943 112.3 47.8 -55.6 -51.3 22.7 -3.3 13.0 39 55 A N H >X S+ 0 0 9 -4,-2.9 4,-3.2 1,-0.2 3,-0.6 0.960 111.7 51.2 -55.9 -49.1 26.4 -4.3 13.3 40 56 A S H 3X S+ 0 0 16 -4,-3.2 4,-2.2 1,-0.3 -1,-0.2 0.851 108.1 52.1 -56.7 -35.5 27.4 -0.6 13.1 41 57 A R H 3X S+ 0 0 77 -4,-2.5 4,-1.7 2,-0.2 -1,-0.3 0.828 111.3 46.2 -71.2 -31.1 24.9 0.2 15.9 42 58 A F H < S+ 0 0 3 -4,-2.5 3,-0.9 2,-0.2 -2,-0.2 0.975 112.5 48.3 -65.8 -53.8 34.5 -0.2 26.4 51 67 A A H >< S+ 0 0 4 -4,-3.6 3,-1.4 1,-0.3 -1,-0.2 0.850 106.2 62.1 -53.9 -35.7 36.0 3.3 26.4 52 68 A D H 3< S+ 0 0 107 -4,-1.6 -1,-0.3 -5,-0.3 -2,-0.2 0.876 102.8 46.8 -59.5 -42.0 34.0 4.1 29.5 53 69 A S T << S+ 0 0 75 -4,-1.3 -1,-0.3 -3,-0.9 2,-0.2 0.202 106.2 73.7 -89.7 17.8 35.7 1.4 31.6 54 70 A K S < S- 0 0 53 -3,-1.4 2,-0.4 -4,-0.1 6,-0.0 -0.763 89.5 -94.1-124.5 172.3 39.2 2.4 30.5 55 71 A N > - 0 0 92 -2,-0.2 3,-3.2 1,-0.1 -2,-0.1 -0.739 29.7-129.5 -88.3 130.9 41.7 5.2 31.2 56 72 A D T 3 S+ 0 0 59 -2,-0.4 166,-0.3 1,-0.3 -1,-0.1 0.573 108.2 63.5 -55.4 -7.7 41.5 8.0 28.6 57 73 A N T 3 S+ 0 0 21 165,-0.1 2,-0.3 164,-0.1 -1,-0.3 0.496 87.4 86.6 -94.7 -7.3 45.3 7.6 28.4 58 74 A D S < S- 0 0 76 -3,-3.2 -4,-0.1 1,-0.1 2,-0.0 -0.727 78.6-120.5 -97.3 144.9 45.1 4.0 27.1 59 75 A N - 0 0 39 -2,-0.3 2,-0.4 349,-0.1 347,-0.2 -0.339 25.2-153.6 -74.2 162.1 44.8 3.1 23.5 60 76 A I E +B 405 0B 0 345,-2.4 345,-1.8 247,-0.1 2,-0.3 -0.999 18.5 165.6-140.3 135.7 41.8 1.0 22.3 61 77 A F E +B 404 0B 1 -2,-0.4 2,-0.3 343,-0.2 343,-0.2 -0.894 9.3 139.8-156.9 126.8 41.5 -1.3 19.3 62 78 A L E -B 403 0B 0 341,-2.2 341,-2.2 -2,-0.3 3,-0.1 -0.914 45.0-121.8-151.1 173.5 39.0 -3.9 18.3 63 79 A S > - 0 0 0 -2,-0.3 4,-1.5 339,-0.2 3,-0.4 -0.888 20.4-172.8-123.9 94.9 37.1 -5.3 15.4 64 80 A P H > S+ 0 0 2 0, 0.0 4,-2.9 0, 0.0 5,-0.2 0.890 86.3 58.2 -56.8 -37.0 33.4 -5.0 16.2 65 81 A L H > S+ 0 0 2 336,-0.6 4,-2.7 335,-0.6 5,-0.1 0.900 103.4 54.0 -58.4 -41.5 32.5 -7.1 13.1 66 82 A S H > S+ 0 0 0 335,-0.5 4,-2.3 -3,-0.4 -1,-0.2 0.884 110.5 44.5 -60.6 -42.8 34.6 -9.9 14.5 67 83 A I H X S+ 0 0 0 -4,-1.5 4,-2.8 2,-0.2 5,-0.3 0.955 112.8 51.5 -67.4 -49.1 32.7 -9.9 17.8 68 84 A S H X S+ 0 0 1 -4,-2.9 4,-1.5 1,-0.2 -2,-0.2 0.900 111.3 49.3 -53.2 -43.1 29.4 -9.7 16.0 69 85 A T H >X S+ 0 0 0 -4,-2.7 4,-2.3 -5,-0.2 3,-0.5 0.983 111.4 46.7 -61.5 -58.4 30.4 -12.6 13.8 70 86 A A H 3X S+ 0 0 0 -4,-2.3 4,-1.8 1,-0.3 -2,-0.2 0.874 115.1 45.7 -53.4 -44.0 31.5 -14.9 16.6 71 87 A F H 3X S+ 0 0 2 -4,-2.8 4,-1.3 2,-0.2 -1,-0.3 0.799 109.5 55.7 -74.2 -22.0 28.5 -14.3 18.7 72 88 A A H << S+ 0 0 0 -4,-1.5 4,-0.5 -3,-0.5 -2,-0.2 0.871 108.2 48.9 -72.8 -35.3 26.2 -14.7 15.7 73 89 A M H >< S+ 0 0 0 -4,-2.3 3,-0.9 1,-0.2 -2,-0.2 0.873 110.4 50.6 -67.8 -37.8 27.9 -18.2 15.3 74 90 A T H >< S+ 0 0 1 -4,-1.8 3,-1.1 1,-0.2 -1,-0.2 0.780 100.1 66.2 -69.5 -27.6 27.2 -18.9 18.9 75 91 A K G >< S+ 0 0 3 -4,-1.3 3,-1.2 1,-0.2 -1,-0.2 0.675 79.7 81.8 -68.8 -17.9 23.6 -17.8 18.4 76 92 A L G < S+ 0 0 6 -3,-0.9 -56,-0.7 -4,-0.5 -55,-0.2 0.762 101.2 34.0 -60.3 -26.4 23.0 -20.8 16.1 77 93 A G G < S+ 0 0 0 -3,-1.1 670,-1.8 -4,-0.2 671,-0.4 0.286 96.2 113.4-112.5 10.5 22.5 -23.1 19.1 78 94 A A < - 0 0 2 -3,-1.2 -57,-0.5 667,-0.2 2,-0.3 -0.307 41.6-175.1 -79.7 165.5 20.8 -20.6 21.4 79 95 A b >> - 0 0 13 665,-1.4 3,-1.6 -59,-0.1 4,-0.7 -0.995 40.7 -11.9-158.8 160.3 17.2 -20.8 22.6 80 96 A N H >> S- 0 0 108 -2,-0.3 4,-1.9 1,-0.3 3,-0.7 -0.149 127.3 -3.7 47.8-136.1 14.5 -19.0 24.6 81 97 A D H 3> S+ 0 0 70 1,-0.3 4,-2.1 2,-0.2 -1,-0.3 0.759 133.2 59.4 -56.7 -30.7 15.9 -16.1 26.6 82 98 A T H <> S+ 0 0 0 -3,-1.6 4,-1.9 660,-0.2 -1,-0.3 0.925 109.6 44.5 -65.3 -40.7 19.5 -16.8 25.7 83 99 A L H S+ 0 0 2 -4,-2.2 5,-2.0 2,-0.2 6,-1.5 0.919 119.2 38.2 -61.3 -44.5 19.3 -10.9 19.2 88 104 A E H ><5S+ 0 0 75 -4,-2.9 3,-2.6 3,-0.2 -2,-0.2 0.960 111.1 53.8 -74.4 -54.4 18.8 -7.7 21.2 89 105 A V H 3<5S+ 0 0 11 -4,-3.7 -1,-0.2 1,-0.3 -3,-0.2 0.832 115.3 43.7 -52.4 -32.5 22.3 -7.1 22.6 90 106 A F T 3<5S- 0 0 0 -4,-1.5 -1,-0.3 -5,-0.4 -48,-0.2 0.284 110.1-123.2 -97.3 11.8 23.7 -7.4 19.0 91 107 A K T X 5S+ 0 0 48 -3,-2.6 3,-0.9 1,-0.1 -3,-0.2 0.707 73.3 129.4 56.8 24.2 20.9 -5.3 17.5 92 108 A F G > < + 0 0 2 -5,-2.0 3,-1.6 -6,-0.3 -4,-0.2 0.742 60.8 72.6 -76.1 -22.4 19.9 -8.1 15.1 93 109 A D G 3 S+ 0 0 34 -6,-1.5 -1,-0.2 1,-0.3 -5,-0.1 0.345 84.2 68.3 -74.2 8.0 16.4 -7.5 16.3 94 110 A T G < S+ 0 0 60 -3,-0.9 2,-0.7 -7,-0.2 -1,-0.3 0.338 71.9 108.0-107.1 4.4 16.2 -4.3 14.3 95 111 A I S < S- 0 0 4 -3,-1.6 2,-2.1 1,-0.1 -70,-0.1 -0.754 81.7-119.2 -86.3 117.7 16.4 -6.0 11.0 96 112 A S S S+ 0 0 60 -2,-0.7 2,-0.2 -70,-0.1 -1,-0.1 -0.327 80.0 96.7 -57.9 81.1 13.0 -5.7 9.3 97 113 A E - 0 0 81 -2,-2.1 3,-0.1 -72,-0.2 -73,-0.0 -0.473 68.2-128.4-141.8-146.7 12.4 -9.5 9.1 98 114 A K S S+ 0 0 48 1,-0.4 -73,-1.1 -2,-0.2 2,-0.4 0.527 75.2 54.2-144.5 -47.9 10.5 -12.0 11.2 99 115 A T B > -A 24 0A 56 -75,-0.2 3,-1.7 1,-0.1 4,-0.4 -0.844 69.7-130.5-106.8 138.6 12.4 -15.1 12.3 100 116 A S T > S+ 0 0 3 -77,-1.1 3,-0.5 -2,-0.4 4,-0.3 0.657 103.1 66.3 -55.3 -19.8 15.8 -15.2 14.1 101 117 A D T >> S+ 0 0 30 1,-0.2 3,-0.8 2,-0.1 4,-0.6 0.768 83.8 70.6 -77.3 -26.8 17.2 -17.6 11.6 102 118 A Q H <> S+ 0 0 15 -3,-1.7 4,-1.6 1,-0.2 3,-0.5 0.739 85.4 68.6 -64.2 -24.4 17.1 -15.3 8.6 103 119 A I H <> S+ 0 0 5 -3,-0.5 4,-2.7 -4,-0.4 5,-0.2 0.846 92.8 57.2 -66.2 -31.4 20.0 -13.2 10.0 104 120 A H H <> S+ 0 0 3 -3,-0.8 4,-1.3 -4,-0.3 -1,-0.2 0.851 106.5 51.9 -65.6 -25.0 22.5 -16.0 9.5 105 121 A F H X S+ 0 0 18 -4,-0.6 4,-1.6 -3,-0.5 -2,-0.2 0.890 113.5 42.3 -77.0 -37.6 21.4 -15.9 5.8 106 122 A F H X S+ 0 0 20 -4,-1.6 4,-2.4 2,-0.2 -2,-0.2 0.848 110.7 55.2 -75.3 -36.3 22.0 -12.2 5.5 107 123 A F H X S+ 0 0 0 -4,-2.7 4,-2.5 2,-0.2 -1,-0.2 0.872 108.5 50.4 -64.0 -35.6 25.3 -12.3 7.5 108 124 A A H X S+ 0 0 3 -4,-1.3 4,-1.8 -5,-0.2 -1,-0.2 0.915 108.5 51.6 -68.1 -42.7 26.5 -14.9 5.0 109 125 A K H X S+ 0 0 28 -4,-1.6 4,-1.8 1,-0.2 -2,-0.2 0.905 112.7 46.3 -59.7 -42.3 25.5 -12.6 2.1 110 126 A L H X S+ 0 0 0 -4,-2.4 4,-2.7 1,-0.2 -2,-0.2 0.905 109.7 51.9 -67.4 -44.5 27.5 -9.7 3.7 111 127 A N H X S+ 0 0 19 -4,-2.5 4,-2.2 1,-0.2 -1,-0.2 0.823 107.6 56.5 -62.6 -28.6 30.5 -11.9 4.4 112 128 A a H < S+ 0 0 22 -4,-1.8 4,-0.3 2,-0.2 -2,-0.2 0.965 110.1 41.6 -65.6 -53.0 30.4 -12.8 0.8 113 129 A R H >< S+ 0 0 109 -4,-1.8 3,-0.8 1,-0.2 -2,-0.2 0.912 117.0 50.2 -60.7 -45.2 30.6 -9.2 -0.5 114 130 A L H 3< S+ 0 0 12 -4,-2.7 -2,-0.2 1,-0.2 -1,-0.2 0.941 115.5 36.5 -60.2 -54.5 33.2 -8.3 2.1 115 131 A Y T 3< 0 0 47 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.159 360.0 360.0 -92.1 20.4 35.8 -11.0 1.6 116 132 A R < 0 0 123 -3,-0.8 -4,-0.1 -4,-0.3 -3,-0.1 -0.498 360.0 360.0 118.0 360.0 35.3 -11.3 -2.2 117 ! 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 0.0 118 138 A S 0 0 75 0, 0.0 2,-0.6 0, 0.0 85,-0.2 0.000 360.0 360.0 360.0 145.7 43.7 -4.6 -0.8 119 139 A K E +J 202 0C 57 83,-1.8 83,-2.5 2,-0.0 2,-0.4 -0.783 360.0 160.7 -94.5 116.6 43.7 -7.8 1.3 120 140 A L E +J 201 0C 13 -2,-0.6 2,-0.3 81,-0.2 81,-0.2 -0.895 14.4 163.7-135.4 103.2 40.7 -8.4 3.6 121 141 A V E -J 200 0C 69 79,-2.9 79,-2.9 -2,-0.4 2,-0.3 -0.763 16.6-169.1-119.7 164.6 40.2 -12.0 4.7 122 142 A S E -J 199 0C 34 -2,-0.3 2,-0.4 77,-0.3 77,-0.2 -0.984 1.2-173.1-152.4 141.5 38.3 -13.8 7.4 123 143 A A E -J 198 0C 21 75,-1.2 75,-0.6 -2,-0.3 2,-0.4 -0.996 2.5-170.1-140.9 133.5 38.3 -17.4 8.8 124 144 A N E +J 197 0C 13 22,-0.4 25,-0.6 23,-0.4 2,-0.3 -0.968 10.1 172.3-124.6 140.8 35.9 -19.0 11.3 125 145 A R E -Jk 196 149C 58 71,-2.2 71,-2.6 -2,-0.4 2,-0.5 -0.994 24.2-138.7-148.2 149.7 36.3 -22.4 13.0 126 146 A L E -Jk 195 150C 1 23,-2.9 25,-2.9 -2,-0.3 2,-0.6 -0.928 12.2-165.0-110.5 132.2 34.7 -24.6 15.7 127 147 A F E +Jk 194 151C 0 67,-1.8 67,-2.3 -2,-0.5 2,-0.2 -0.908 17.8 173.3-118.8 102.3 36.9 -26.6 18.1 128 148 A G E -Jk 193 152C 0 23,-1.2 25,-2.3 -2,-0.6 65,-0.2 -0.662 40.4 -89.9-106.2 163.8 34.9 -29.2 20.0 129 149 A D E > - 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0 0 1 -6,-3.1 -23,-0.2 -23,-0.1 -1,-0.2 -0.841 22.5-168.0-100.5 106.5 33.1 -22.9 10.3 149 169 A K E -k 125 0C 101 -2,-0.8 -23,-2.9 -25,-0.6 2,-0.8 -0.567 25.1-114.3 -88.5 157.0 34.2 -26.6 10.2 150 170 A L E -k 126 0C 32 -2,-0.2 -23,-0.2 -25,-0.2 -25,-0.0 -0.820 28.3-169.8-100.3 104.9 34.5 -28.5 13.4 151 171 A Q E -k 127 0C 57 -25,-2.9 -23,-1.2 -2,-0.8 2,-0.2 -0.769 21.7-129.8 -90.7 129.5 38.0 -29.6 14.4 152 172 A P E +k 128 0C 82 0, 0.0 2,-0.3 0, 0.0 -23,-0.2 -0.592 29.7 176.8 -82.6 143.0 38.2 -32.1 17.3 153 173 A L E -k 129 0C 22 -25,-2.3 -23,-2.4 -2,-0.2 2,-1.1 -0.943 36.1-115.6-138.1 159.0 40.5 -31.4 20.2 154 174 A D > + 0 0 34 -2,-0.3 4,-3.0 4,-0.2 3,-0.3 -0.629 50.5 147.9-100.2 77.0 41.1 -33.2 23.5 155 175 A F H > S+ 0 0 1 -2,-1.1 4,-0.5 1,-0.2 -1,-0.2 0.955 70.2 61.0 -68.6 -52.3 39.9 -30.7 26.1 156 176 A K H 4 S+ 0 0 92 -3,-0.3 -1,-0.2 1,-0.2 33,-0.1 0.665 127.0 12.7 -48.3 -23.5 38.8 -33.4 28.4 157 177 A E H 4 S+ 0 0 143 -3,-0.3 -1,-0.2 31,-0.1 -2,-0.2 0.626 136.1 31.8-129.5 -28.4 42.4 -34.7 28.6 158 178 A N H X + 0 0 89 -4,-3.0 4,-2.3 1,-0.1 -4,-0.2 -0.505 59.6 153.6-135.5 67.9 44.8 -32.1 27.1 159 179 A A H X S+ 0 0 21 -4,-0.5 4,-2.8 1,-0.2 3,-0.2 0.984 75.4 49.2 -58.1 -63.8 43.5 -28.6 27.7 160 180 A E H > S+ 0 0 80 1,-0.3 4,-2.1 2,-0.2 -1,-0.2 0.815 113.6 47.7 -46.4 -40.4 46.8 -26.8 27.6 161 181 A Q H > S+ 0 0 57 2,-0.2 4,-2.0 1,-0.2 -1,-0.3 0.923 111.9 49.3 -69.6 -43.7 47.8 -28.5 24.4 162 182 A S H X S+ 0 0 6 -4,-2.3 4,-2.6 -8,-0.3 -2,-0.2 0.884 108.6 54.4 -62.5 -38.3 44.5 -27.8 22.8 163 183 A R H X S+ 0 0 65 -4,-2.8 4,-2.7 1,-0.2 5,-0.3 0.976 107.3 49.2 -58.2 -54.4 44.8 -24.2 23.8 164 184 A A H X S+ 0 0 57 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.861 110.7 53.5 -51.4 -39.4 48.1 -23.9 22.1 165 185 A A H X S+ 0 0 36 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.958 109.6 44.2 -62.4 -56.1 46.5 -25.5 19.0 166 186 A I H X S+ 0 0 0 -4,-2.6 4,-2.3 1,-0.2 3,-0.2 0.939 113.7 51.6 -56.4 -48.2 43.7 -23.0 18.7 167 187 A N H X S+ 0 0 11 -4,-2.7 4,-2.2 1,-0.2 -1,-0.2 0.835 107.9 52.3 -58.9 -34.4 46.0 -20.1 19.3 168 188 A K H X S+ 0 0 57 -4,-1.8 4,-2.0 -5,-0.3 -1,-0.2 0.870 108.3 50.6 -70.2 -36.8 48.4 -21.3 16.6 169 189 A W H X S+ 0 0 37 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.908 111.0 48.4 -65.7 -42.6 45.5 -21.5 14.1 170 190 A V H X S+ 0 0 0 -4,-2.3 4,-0.7 1,-0.2 8,-0.3 0.923 109.8 52.8 -62.5 -42.7 44.5 -18.0 15.0 171 191 A S H ><>S+ 0 0 31 -4,-2.2 5,-3.5 8,-0.2 3,-0.7 0.889 108.9 51.1 -58.3 -39.1 48.1 -17.0 14.6 172 192 A N H ><5S+ 0 0 123 -4,-2.0 3,-0.9 1,-0.2 -1,-0.2 0.867 109.6 48.2 -66.8 -40.2 48.0 -18.6 11.1 173 193 A K H 3<5S+ 0 0 76 -4,-2.1 -1,-0.2 1,-0.2 -2,-0.2 0.470 115.6 44.5 -82.1 -1.2 44.9 -16.7 10.0 174 194 A T T X<5S- 0 0 0 -3,-0.7 3,-2.1 -4,-0.7 -1,-0.2 0.036 113.7-108.6-129.0 23.1 46.2 -13.4 11.2 175 195 A E T < 5S- 0 0 133 -3,-0.9 -3,-0.2 1,-0.3 -4,-0.1 0.816 77.9 -54.9 53.0 35.9 49.7 -13.6 9.8 176 196 A G T 3 - 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