==== 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 OXIDOREDUCTASE 21-SEP-99 1D1X . COMPND 2 MOLECULE: BOVINE ENDOTHELIAL NITRIC OXIDE SYNTHASE HEME DOM . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR C.S.RAMAN,H.LI,P.MARTASEK,G.J.SOUTHAN,B.S.S.MASTERS,T.L.POUL . 830 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 34965.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 537 64.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 15 1.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 90 10.8 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 2 0.2 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 0.7 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 . 63 7.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 86 10.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 226 27.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 19 2.3 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 2 0 2 0 2 0 0 0 1 1 0 2 2 2 4 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 1 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 0 PARALLEL BRIDGES PER LADDER . 12 6 12 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 . 7 4 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 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 67 A G 0 0 110 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0-136.6 8.6 -19.5 53.2 2 68 A P - 0 0 59 0, 0.0 2,-0.4 0, 0.0 4,-0.1 -0.138 360.0-127.2 -51.4 143.8 10.1 -18.2 49.9 3 69 A K S S+ 0 0 174 2,-0.1 3,-0.0 14,-0.0 14,-0.0 -0.139 80.7 87.2 -86.9 38.1 13.6 -16.8 50.1 4 70 A F S S- 0 0 60 -2,-0.4 15,-0.1 1,-0.0 0, 0.0 -0.926 94.7 -69.3-133.9 159.9 12.6 -13.6 48.4 5 71 A P - 0 0 8 0, 0.0 13,-2.0 0, 0.0 2,-0.6 -0.218 47.2-136.6 -51.3 127.3 11.2 -10.2 49.5 6 72 A R E -A 17 0A 112 11,-0.2 2,-0.5 -4,-0.1 11,-0.2 -0.802 21.7-160.3 -87.8 122.9 7.6 -10.7 50.7 7 73 A V E -A 16 0A 8 9,-4.0 9,-2.3 -2,-0.6 2,-0.3 -0.914 6.3-165.9-112.4 127.8 5.5 -7.9 49.3 8 74 A K E -A 15 0A 56 -2,-0.5 391,-2.3 7,-0.2 2,-0.6 -0.860 19.5-151.2-117.3 146.1 2.1 -6.9 50.7 9 75 A N B > -B 398 0B 2 5,-2.5 4,-1.4 -2,-0.3 5,-0.4 -0.964 13.2-162.5-108.1 116.8 -0.8 -4.8 49.6 10 76 A W T 4 S+ 0 0 79 387,-2.6 388,-0.1 -2,-0.6 -1,-0.1 0.570 84.0 56.2 -79.5 -9.0 -2.4 -3.4 52.8 11 77 A E T 4 S+ 0 0 58 386,-0.4 -1,-0.2 383,-0.2 387,-0.1 0.910 123.3 22.5 -84.4 -49.0 -5.7 -2.5 51.2 12 78 A L T 4 S- 0 0 119 385,-0.1 -2,-0.2 2,-0.1 -1,-0.1 0.511 98.1-129.8 -95.7 -9.5 -6.5 -5.9 49.7 13 79 A G < + 0 0 46 -4,-1.4 2,-0.2 1,-0.2 -3,-0.2 0.608 55.9 148.8 69.6 12.6 -4.3 -7.9 52.1 14 80 A S - 0 0 58 -5,-0.4 -5,-2.5 -6,-0.0 2,-0.3 -0.492 32.8-151.3 -83.0 150.5 -2.7 -9.8 49.3 15 81 A I E +A 8 0A 52 -7,-0.2 2,-0.3 -2,-0.2 -7,-0.2 -0.920 16.3 171.2-122.4 144.4 0.9 -11.1 49.3 16 82 A T E -A 7 0A 48 -9,-2.3 -9,-4.0 -2,-0.3 2,-0.4 -0.961 24.5-133.1-144.9 160.3 3.5 -11.7 46.5 17 83 A Y E -A 6 0A 65 -2,-0.3 2,-0.8 -11,-0.2 -11,-0.2 -0.966 15.5-138.8-119.2 131.8 7.1 -12.6 46.4 18 84 A D + 0 0 5 -13,-2.0 358,-0.2 -2,-0.4 357,-0.1 -0.811 33.4 159.2 -93.1 112.1 9.6 -10.7 44.2 19 85 A T > + 0 0 57 356,-2.6 3,-1.1 -2,-0.8 4,-0.2 0.524 62.9 78.3-105.4 -11.7 12.0 -13.1 42.5 20 86 A L G > S+ 0 0 12 355,-1.3 3,-2.3 1,-0.3 4,-0.2 0.798 79.2 69.7 -68.2 -29.0 12.9 -10.8 39.7 21 87 A C G > S+ 0 0 5 1,-0.3 3,-1.7 354,-0.3 -1,-0.3 0.736 83.7 72.0 -60.8 -22.1 15.2 -8.8 41.9 22 88 A A G < S+ 0 0 36 -3,-1.1 -1,-0.3 1,-0.3 -2,-0.2 0.716 91.5 60.6 -65.1 -18.8 17.5 -11.9 41.9 23 89 A Q G < S+ 0 0 116 -3,-2.3 -1,-0.3 -4,-0.2 -2,-0.2 0.571 75.9 117.9 -83.6 -13.3 18.1 -10.8 38.3 24 90 A S < - 0 0 2 -3,-1.7 381,-0.2 -4,-0.2 3,-0.1 -0.330 37.9-179.1 -58.3 135.0 19.6 -7.4 39.4 25 91 A Q + 0 0 140 379,-0.8 2,-0.4 1,-0.1 -1,-0.2 0.539 62.5 63.4-110.7 -14.5 23.2 -7.1 38.3 26 92 A Q B S-C 404 0C 56 378,-0.9 378,-0.7 422,-0.1 -1,-0.1 -0.942 77.7-126.0-121.6 134.3 23.8 -3.7 39.7 27 93 A D - 0 0 87 -2,-0.4 421,-0.2 376,-0.1 376,-0.1 -0.373 18.9-148.7 -73.5 149.2 23.8 -2.4 43.3 28 94 A G - 0 0 17 419,-3.9 -1,-0.1 418,-0.2 421,-0.1 -0.101 37.6 -85.1 -96.9-158.6 21.7 0.5 44.4 29 95 A P S S+ 0 0 36 0, 0.0 2,-0.1 0, 0.0 14,-0.1 0.528 91.2 96.2 -91.7 -6.5 22.5 3.0 47.2 30 96 A C + 0 0 4 416,-0.3 5,-0.2 417,-0.2 -2,-0.1 -0.409 43.1 179.2 -88.4 161.7 21.1 1.1 50.3 31 97 A T B > -D 34 0D 40 3,-1.9 3,-0.9 415,-0.2 414,-0.3 -0.952 48.0 -97.6-149.3 160.9 22.8 -1.2 52.8 32 98 A P T 3 S+ 0 0 43 0, 0.0 411,-4.6 0, 0.0 413,-0.2 0.776 122.8 57.6 -53.6 -26.2 21.6 -3.2 55.9 33 99 A R T 3 S+ 0 0 95 1,-0.2 786,-0.5 409,-0.2 2,-0.3 0.840 120.3 0.8 -75.9 -37.4 22.9 -0.2 58.0 34 100 A R B < -D 31 0D 33 -3,-0.9 -3,-1.9 784,-0.1 2,-0.5 -0.987 60.7-128.3-157.5 148.1 20.8 2.5 56.3 35 101 A C B +E 817 0E 18 782,-3.1 782,-2.1 -2,-0.3 3,-0.2 -0.833 19.0 175.0 -98.4 126.1 18.2 3.2 53.7 36 102 A L > + 0 0 10 -2,-0.5 3,-1.7 780,-0.2 -1,-0.1 -0.070 39.5 126.1-115.6 29.0 18.9 5.9 51.0 37 103 A G T 3 + 0 0 22 1,-0.3 -1,-0.1 780,-0.1 345,-0.1 0.726 67.0 58.1 -61.6 -23.0 15.7 5.1 49.1 38 104 A S T 3 S+ 0 0 24 777,-0.5 2,-0.4 -3,-0.2 -1,-0.3 0.430 79.5 110.6 -88.8 1.4 14.5 8.7 49.2 39 105 A L < - 0 0 10 -3,-1.7 -3,-0.1 1,-0.1 383,-0.0 -0.644 56.5-155.0 -81.8 131.4 17.6 10.1 47.5 40 106 A V S S+ 0 0 31 -2,-0.4 -1,-0.1 1,-0.2 -3,-0.0 0.902 88.5 20.5 -68.4 -46.3 17.0 11.5 44.0 41 107 A L S S+ 0 0 48 2,-0.0 -1,-0.2 4,-0.0 2,-0.2 -0.567 71.7 178.5-126.8 69.2 20.6 11.0 42.8 42 108 A P > - 0 0 30 0, 0.0 2,-2.7 0, 0.0 4,-0.6 -0.540 44.6-110.2 -68.7 138.9 22.5 8.5 44.9 43 109 A R T 4 S+ 0 0 133 -2,-0.2 -2,-0.0 1,-0.2 -15,-0.0 -0.324 95.1 82.2 -73.7 68.2 25.9 8.3 43.3 44 110 A K T 4 S+ 0 0 114 -2,-2.7 -1,-0.2 -18,-0.0 -16,-0.1 0.524 90.2 33.0-125.4 -80.9 25.6 4.7 41.9 45 111 A L T 4 S+ 0 0 54 -3,-0.3 -2,-0.1 2,-0.1 365,-0.0 0.855 85.1 128.9 -48.8 -40.5 23.8 4.4 38.6 46 112 A Q < - 0 0 24 -4,-0.6 2,-2.5 1,-0.2 366,-0.2 0.157 58.1-144.4 -23.2 95.1 25.3 7.8 37.7 47 113 A T - 0 0 18 364,-2.0 -1,-0.2 229,-0.1 3,-0.1 -0.436 23.7-168.6 -72.9 75.1 26.9 7.1 34.3 48 114 A R - 0 0 152 -2,-2.5 2,-0.0 1,-0.2 364,-0.0 -0.379 40.4 -80.7 -65.3 141.2 29.9 9.4 34.9 49 115 A P - 0 0 75 0, 0.0 -1,-0.2 0, 0.0 363,-0.0 -0.213 47.1-174.4 -48.6 113.5 31.9 10.1 31.7 50 116 A S + 0 0 55 1,-0.2 -2,-0.0 -3,-0.1 -3,-0.0 -0.652 9.4 174.1-112.7 71.1 34.2 7.0 31.2 51 117 A P + 0 0 90 0, 0.0 122,-0.8 0, 0.0 -1,-0.2 0.916 52.9 72.4 -40.0 -83.6 36.3 8.2 28.2 52 118 A G S S- 0 0 53 120,-0.1 0, 0.0 1,-0.1 0, 0.0 -0.102 106.1 -82.8 -42.4 131.4 38.9 5.5 27.8 53 119 A P - 0 0 83 0, 0.0 -1,-0.1 0, 0.0 3,-0.1 0.060 52.5-105.3 -38.3 140.9 37.3 2.3 26.3 54 120 A P - 0 0 64 0, 0.0 2,-0.2 0, 0.0 5,-0.0 -0.338 45.9 -78.6 -73.0 152.6 35.7 -0.0 28.9 55 121 A P >> - 0 0 87 0, 0.0 4,-2.4 0, 0.0 3,-0.7 -0.314 37.6-141.8 -53.5 114.1 37.2 -3.3 30.0 56 122 A A H 3> S+ 0 0 52 1,-0.3 4,-2.7 2,-0.2 5,-0.2 0.839 103.3 55.4 -46.9 -37.4 36.4 -5.7 27.2 57 123 A E H 3> S+ 0 0 170 2,-0.2 4,-1.7 1,-0.2 -1,-0.3 0.926 109.1 46.4 -62.8 -45.3 35.8 -8.4 29.9 58 124 A Q H <> S+ 0 0 110 -3,-0.7 4,-1.8 2,-0.2 -2,-0.2 0.919 114.9 45.5 -62.3 -48.9 33.2 -6.1 31.5 59 125 A L H X S+ 0 0 6 -4,-2.4 4,-3.1 1,-0.2 5,-0.2 0.927 108.5 56.5 -62.9 -47.2 31.4 -5.2 28.3 60 126 A L H X S+ 0 0 16 -4,-2.7 4,-2.7 -5,-0.3 5,-0.2 0.900 107.1 50.0 -51.7 -45.6 31.4 -8.8 27.0 61 127 A S H X S+ 0 0 60 -4,-1.7 4,-2.1 2,-0.2 -1,-0.2 0.936 112.8 44.9 -61.6 -48.6 29.6 -9.9 30.1 62 128 A Q H X S+ 0 0 66 -4,-1.8 4,-2.0 1,-0.2 219,-0.2 0.897 115.0 50.5 -61.9 -39.4 26.9 -7.2 29.9 63 129 A A H X S+ 0 0 0 -4,-3.1 4,-2.5 2,-0.2 -2,-0.2 0.870 109.5 48.4 -66.5 -41.9 26.6 -7.9 26.1 64 130 A R H X S+ 0 0 89 -4,-2.7 4,-2.5 -5,-0.2 -1,-0.2 0.905 110.5 52.2 -66.9 -41.6 26.1 -11.7 26.6 65 131 A D H X S+ 0 0 47 -4,-2.1 4,-2.0 -5,-0.2 -2,-0.2 0.935 111.5 46.8 -59.7 -46.1 23.5 -11.1 29.2 66 132 A F H X S+ 0 0 0 -4,-2.0 4,-2.8 2,-0.2 -2,-0.2 0.925 110.8 50.5 -62.1 -47.2 21.6 -8.8 27.0 67 133 A I H X S+ 0 0 0 -4,-2.5 4,-2.7 1,-0.2 5,-0.3 0.908 109.7 52.0 -58.4 -41.1 21.8 -11.1 24.0 68 134 A N H X S+ 0 0 69 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.913 109.1 50.5 -61.4 -40.9 20.5 -13.9 26.2 69 135 A Q H X S+ 0 0 47 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.931 110.4 50.7 -60.9 -45.5 17.6 -11.6 27.2 70 136 A Y H X S+ 0 0 29 -4,-2.8 4,-0.9 1,-0.2 -2,-0.2 0.927 111.7 44.1 -59.6 -49.8 16.9 -10.9 23.6 71 137 A Y H <>S+ 0 0 12 -4,-2.7 5,-3.3 1,-0.2 6,-0.4 0.806 111.8 54.9 -68.3 -26.0 16.8 -14.5 22.4 72 138 A S H ><5S+ 0 0 54 -4,-1.8 3,-1.5 -5,-0.3 -1,-0.2 0.898 103.3 56.0 -70.2 -40.8 14.7 -15.5 25.5 73 139 A S H 3<5S+ 0 0 52 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.729 111.9 42.4 -65.1 -23.2 12.2 -12.8 24.5 74 140 A I T 3<5S- 0 0 64 -4,-0.9 -1,-0.3 -5,-0.1 -2,-0.2 0.290 117.1-114.8-104.9 8.6 11.7 -14.4 21.1 75 141 A K T < 5S+ 0 0 154 -3,-1.5 -3,-0.2 -5,-0.1 -2,-0.1 0.884 84.8 111.2 62.7 45.2 11.7 -17.9 22.6 76 142 A R > < + 0 0 146 -5,-3.3 3,-1.9 -6,-0.1 6,-0.4 0.017 33.3 153.2-136.1 28.7 14.9 -19.1 21.0 77 143 A S T 3 S+ 0 0 72 -6,-0.4 3,-0.1 1,-0.3 -9,-0.1 -0.389 73.6 16.3 -63.5 133.6 17.4 -19.5 23.9 78 144 A G T 3 S+ 0 0 55 1,-0.3 -1,-0.3 -2,-0.1 -10,-0.0 0.382 97.2 132.7 85.8 -5.0 20.1 -22.1 23.2 79 145 A S S <> S- 0 0 36 -3,-1.9 4,-2.1 1,-0.1 -1,-0.3 -0.180 72.6-105.3 -74.1 171.4 19.3 -22.1 19.5 80 146 A Q H > S+ 0 0 146 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.895 121.0 52.1 -63.9 -42.6 21.9 -21.9 16.7 81 147 A A H > S+ 0 0 50 1,-0.2 4,-2.8 2,-0.2 5,-0.2 0.898 109.2 51.3 -61.2 -40.4 21.0 -18.2 15.9 82 148 A H H > S+ 0 0 10 -6,-0.4 4,-2.0 2,-0.2 -2,-0.2 0.931 113.5 43.2 -62.8 -47.2 21.5 -17.4 19.6 83 149 A E H X S+ 0 0 97 -4,-2.1 4,-2.3 2,-0.2 -2,-0.2 0.878 115.1 49.1 -67.7 -38.6 24.9 -19.0 19.8 84 150 A E H X S+ 0 0 97 -4,-2.8 4,-2.6 2,-0.2 -2,-0.2 0.921 111.1 49.6 -67.1 -42.7 26.0 -17.5 16.5 85 151 A R H X S+ 0 0 2 -4,-2.8 4,-1.9 -5,-0.2 -2,-0.2 0.890 110.1 52.3 -62.2 -38.0 24.9 -14.1 17.5 86 152 A L H X S+ 0 0 17 -4,-2.0 4,-2.0 -5,-0.2 -1,-0.2 0.926 110.6 46.8 -62.5 -44.5 26.8 -14.6 20.8 87 153 A Q H X S+ 0 0 130 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.878 109.2 55.9 -63.0 -40.2 29.9 -15.5 18.8 88 154 A E H X S+ 0 0 85 -4,-2.6 4,-2.3 2,-0.2 -1,-0.2 0.865 108.3 46.4 -61.3 -40.4 29.4 -12.5 16.5 89 155 A V H X S+ 0 0 2 -4,-1.9 4,-2.6 2,-0.2 5,-0.2 0.915 113.5 47.7 -70.6 -44.3 29.3 -10.1 19.5 90 156 A E H X S+ 0 0 84 -4,-2.0 4,-1.8 2,-0.2 -2,-0.2 0.901 112.8 50.0 -63.4 -41.0 32.4 -11.5 21.1 91 157 A A H X S+ 0 0 58 -4,-2.5 4,-1.8 2,-0.2 5,-0.2 0.972 112.7 46.3 -60.4 -54.4 34.3 -11.5 17.8 92 158 A E H X>S+ 0 0 50 -4,-2.3 4,-2.0 1,-0.3 5,-0.6 0.864 113.2 47.7 -57.2 -42.2 33.4 -7.9 17.2 93 159 A V H X5S+ 0 0 5 -4,-2.6 4,-1.1 1,-0.2 -1,-0.3 0.833 109.6 57.7 -69.5 -28.8 34.3 -6.7 20.7 94 160 A A H <5S+ 0 0 87 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.873 115.9 31.7 -68.2 -38.7 37.5 -8.7 20.2 95 161 A S H <5S+ 0 0 98 -4,-1.8 -2,-0.2 3,-0.2 -1,-0.2 0.662 136.3 20.8 -96.7 -17.7 38.6 -6.8 17.1 96 162 A T H <5S- 0 0 80 -4,-2.0 -3,-0.2 2,-0.4 -2,-0.2 0.545 95.4-119.8-124.3 -16.1 37.1 -3.3 17.7 97 163 A G S < - 0 0 118 -2,-0.3 4,-2.1 1,-0.1 3,-0.3 -0.336 36.7-101.2 -73.0 165.1 20.8 -5.3 15.2 103 169 A E H > S+ 0 0 147 1,-0.2 4,-2.0 2,-0.2 3,-0.4 0.956 121.9 43.5 -50.8 -62.4 17.7 -3.4 14.5 104 170 A S H > S+ 0 0 51 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.732 109.6 58.5 -59.0 -25.6 15.2 -5.6 16.4 105 171 A E H > S+ 0 0 0 -3,-0.3 4,-2.7 2,-0.2 -1,-0.2 0.919 106.0 48.9 -71.2 -41.3 17.7 -5.9 19.3 106 172 A L H X S+ 0 0 1 -4,-2.1 4,-2.6 -3,-0.4 -2,-0.2 0.924 111.0 49.6 -62.5 -44.7 17.6 -2.1 19.7 107 173 A V H X S+ 0 0 48 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.917 112.4 47.8 -60.6 -44.4 13.8 -2.0 19.6 108 174 A F H X S+ 0 0 29 -4,-2.0 4,-2.5 1,-0.2 -2,-0.2 0.926 113.6 47.3 -61.8 -46.5 13.6 -4.8 22.3 109 175 A G H X S+ 0 0 0 -4,-2.7 4,-2.6 2,-0.2 -2,-0.2 0.870 107.9 54.4 -65.2 -38.7 16.2 -3.1 24.5 110 176 A A H X S+ 0 0 0 -4,-2.6 4,-1.7 1,-0.2 -1,-0.2 0.947 113.1 43.7 -61.1 -46.3 14.5 0.3 24.3 111 177 A K H X S+ 0 0 56 -4,-1.9 4,-3.0 1,-0.2 -2,-0.2 0.891 112.3 51.9 -65.6 -40.7 11.2 -1.2 25.4 112 178 A Q H X S+ 0 0 10 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.898 106.2 56.0 -62.9 -38.6 12.9 -3.3 28.1 113 179 A A H < S+ 0 0 0 -4,-2.6 296,-0.4 2,-0.2 4,-0.4 0.918 111.1 42.7 -57.6 -46.2 14.6 -0.1 29.4 114 180 A W H >< S+ 0 0 34 -4,-1.7 3,-2.5 1,-0.2 -2,-0.2 0.978 112.6 54.0 -63.6 -52.4 11.2 1.6 29.8 115 181 A R H 3< S+ 0 0 30 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.825 109.3 49.0 -49.4 -38.6 9.8 -1.6 31.3 116 182 A N T 3< S+ 0 0 4 -4,-2.5 289,-0.4 -5,-0.2 -1,-0.3 0.470 79.0 123.0 -84.6 -1.5 12.6 -1.6 33.9 117 183 A A X - 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