==== 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 09-JUL-08 3DQS . COMPND 2 MOLECULE: NITRIC OXIDE SYNTHASE, ENDOTHELIAL; . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR J.IGARASHI,H.LI,T.L.POULOS . 807 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 34463.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 529 65.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 19 2.4 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 88 10.9 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 . 58 7.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 86 10.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 224 27.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 16 2.0 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 0 2 0 2 3 1 4 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 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 . 11 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 96 0, 0.0 5,-0.0 0, 0.0 2,-0.0 0.000 360.0 360.0 360.0-142.5 8.3 -19.1 53.5 2 68 A P - 0 0 62 0, 0.0 2,-1.9 0, 0.0 4,-0.0 -0.309 360.0-126.1 -56.3 133.0 9.8 -18.2 50.1 3 69 A K S S+ 0 0 197 14,-0.1 14,-0.0 2,-0.0 3,-0.0 -0.308 80.9 88.7 -80.5 54.9 13.3 -16.7 50.4 4 70 A F S S- 0 0 79 -2,-1.9 15,-0.1 17,-0.0 2,-0.0 -0.914 95.6 -67.9-140.8 162.9 12.4 -13.6 48.4 5 71 A P - 0 0 9 0, 0.0 13,-2.2 0, 0.0 2,-0.6 -0.331 46.7-138.8 -57.8 131.9 11.0 -10.2 49.5 6 72 A R E -A 17 0A 85 11,-0.2 2,-0.5 9,-0.0 11,-0.2 -0.843 20.4-161.8 -93.2 125.8 7.4 -10.6 50.7 7 73 A V E -A 16 0A 8 9,-3.3 9,-2.2 -2,-0.6 2,-0.4 -0.932 4.6-164.0-114.1 130.1 5.3 -7.7 49.3 8 74 A K E -A 15 0A 43 -2,-0.5 381,-2.4 7,-0.2 2,-0.6 -0.892 17.8-150.9-120.2 143.7 1.9 -6.8 50.8 9 75 A N B > -B 388 0B 2 5,-2.4 4,-2.0 -2,-0.4 5,-0.4 -0.950 12.6-162.4-104.8 116.7 -1.0 -4.6 49.7 10 76 A W T 4 S+ 0 0 82 377,-2.8 378,-0.1 -2,-0.6 -1,-0.1 0.605 84.4 54.7 -79.0 -10.7 -2.6 -3.2 52.8 11 77 A E T 4 S+ 0 0 61 376,-0.4 -1,-0.2 373,-0.2 377,-0.1 0.902 123.7 24.9 -83.2 -46.8 -5.9 -2.3 51.2 12 78 A L T 4 S- 0 0 119 375,-0.1 -2,-0.2 2,-0.1 3,-0.1 0.627 96.0-132.0 -92.5 -16.8 -6.6 -5.7 49.8 13 79 A G < + 0 0 46 -4,-2.0 -3,-0.2 1,-0.2 2,-0.2 0.607 56.7 146.4 73.7 11.2 -4.5 -7.8 52.2 14 80 A S - 0 0 56 -5,-0.4 -5,-2.4 -6,-0.0 2,-0.3 -0.479 34.2-150.9 -83.4 154.2 -3.0 -9.6 49.3 15 81 A I E +A 8 0A 62 -7,-0.2 2,-0.3 -2,-0.2 -7,-0.2 -0.944 17.0 170.0-128.4 143.5 0.6 -11.0 49.2 16 82 A T E -A 7 0A 49 -9,-2.2 -9,-3.3 -2,-0.3 2,-0.4 -0.931 24.1-133.8-142.9 164.1 3.2 -11.6 46.5 17 83 A Y E -A 6 0A 70 -2,-0.3 2,-0.8 -11,-0.2 -11,-0.2 -0.981 16.8-133.2-122.6 136.5 6.9 -12.4 46.5 18 84 A D + 0 0 5 -13,-2.2 348,-0.2 -2,-0.4 347,-0.1 -0.789 36.3 157.4 -93.7 115.1 9.4 -10.7 44.3 19 85 A T > + 0 0 60 346,-2.6 3,-1.3 -2,-0.8 4,-0.2 0.532 63.9 77.9-106.6 -13.7 11.7 -13.2 42.5 20 86 A L G > S+ 0 0 2 345,-1.4 3,-2.7 1,-0.2 4,-0.2 0.834 77.8 73.0 -64.9 -31.0 12.6 -10.8 39.7 21 87 A C G > S+ 0 0 7 1,-0.3 3,-1.7 344,-0.3 -1,-0.2 0.736 81.2 73.4 -57.3 -20.4 15.0 -8.9 42.0 22 88 A A G < S+ 0 0 56 -3,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.716 88.7 61.0 -66.6 -19.5 17.3 -11.9 41.7 23 89 A Q G < S+ 0 0 112 -3,-2.7 -1,-0.3 -4,-0.2 2,-0.3 0.520 77.9 114.3 -84.7 -6.2 18.1 -10.7 38.1 24 90 A S < + 0 0 1 -3,-1.7 371,-0.2 -4,-0.2 3,-0.0 -0.491 36.4 175.5 -69.6 128.8 19.5 -7.4 39.4 25 91 A Q + 0 0 128 369,-0.5 2,-0.4 -2,-0.3 -1,-0.1 0.319 59.2 69.5-115.3 6.9 23.2 -7.1 38.7 26 92 A Q B S-C 394 0C 97 368,-0.8 368,-0.7 412,-0.1 2,-0.2 -0.990 76.4-126.7-130.9 134.4 23.7 -3.6 39.9 27 93 A D - 0 0 103 -2,-0.4 411,-0.2 366,-0.1 366,-0.1 -0.493 16.4-148.9 -80.5 144.5 23.6 -2.3 43.5 28 94 A G - 0 0 31 409,-4.2 -1,-0.1 -2,-0.2 411,-0.1 -0.116 37.7 -87.3 -91.8-162.8 21.5 0.6 44.7 29 95 A P S S+ 0 0 54 0, 0.0 2,-0.1 0, 0.0 409,-0.1 0.562 90.6 94.2 -88.5 -11.1 22.3 3.0 47.5 30 96 A C - 0 0 3 406,-0.4 5,-0.2 407,-0.1 -2,-0.1 -0.395 44.0-179.3 -85.3 163.9 20.9 1.1 50.6 31 97 A T B > -D 34 0D 40 3,-1.6 3,-0.9 405,-0.2 404,-0.3 -0.916 48.6 -94.9-147.5 166.2 22.6 -1.2 53.1 32 98 A P T 3 S+ 0 0 45 0, 0.0 401,-4.2 0, 0.0 403,-0.1 0.778 124.0 57.2 -58.8 -21.9 21.3 -3.1 56.1 33 99 A R T 3 S+ 0 0 105 1,-0.2 765,-0.3 399,-0.2 2,-0.3 0.777 119.7 3.5 -81.3 -30.0 22.6 -0.2 58.2 34 100 A R B < -D 31 0D 42 -3,-0.9 -3,-1.6 763,-0.1 2,-0.5 -0.933 59.9-131.1-163.5 139.8 20.6 2.6 56.5 35 101 A C B +E 796 0E 17 761,-2.8 761,-2.1 -2,-0.3 3,-0.2 -0.772 19.3 174.9 -92.0 124.8 18.0 3.2 53.9 36 102 A L > + 0 0 10 -2,-0.5 3,-1.9 759,-0.2 -1,-0.1 -0.034 38.6 127.3-114.5 27.4 18.7 5.9 51.3 37 103 A G T 3 + 0 0 21 1,-0.3 -1,-0.1 759,-0.1 335,-0.1 0.686 65.3 60.2 -59.8 -19.6 15.6 5.2 49.3 38 104 A S T 3 S+ 0 0 23 756,-0.5 2,-0.4 -3,-0.2 -1,-0.3 0.415 76.8 111.5 -90.5 1.9 14.5 8.9 49.4 39 105 A L < - 0 0 21 -3,-1.9 -3,-0.1 1,-0.1 373,-0.0 -0.627 59.3-149.7 -81.2 132.7 17.6 10.3 47.7 40 106 A V S S+ 0 0 34 -2,-0.4 -1,-0.1 373,-0.1 -3,-0.0 0.895 82.3 44.9 -65.1 -42.6 17.0 11.7 44.2 41 107 A L 0 0 78 1,-0.0 -1,-0.1 360,-0.0 -2,-0.0 -0.883 360.0 360.0-110.9 135.8 20.5 10.9 42.9 42 108 A P 0 0 141 0, 0.0 -2,-0.1 0, 0.0 -14,-0.0 -0.351 360.0 360.0 -58.0 360.0 22.4 7.6 43.4 43 ! 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 44 120 A P 0 0 112 0, 0.0 2,-0.2 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 167.0 35.6 -0.0 28.8 45 121 A P >> - 0 0 70 0, 0.0 4,-2.3 0, 0.0 3,-0.9 -0.146 360.0-149.4 -42.5 99.6 37.0 -3.3 30.2 46 122 A A H 3> S+ 0 0 49 1,-0.3 4,-2.5 2,-0.2 5,-0.2 0.802 95.5 66.9 -43.9 -29.9 36.1 -5.7 27.4 47 123 A E H 3> S+ 0 0 158 1,-0.2 4,-1.3 2,-0.2 -1,-0.3 0.966 107.8 32.1 -56.1 -59.7 35.9 -8.1 30.3 48 124 A Q H <> S+ 0 0 119 -3,-0.9 4,-1.9 2,-0.2 -2,-0.2 0.858 116.6 57.5 -68.6 -38.8 32.9 -6.5 32.0 49 125 A L H X S+ 0 0 5 -4,-2.3 4,-3.1 1,-0.2 5,-0.2 0.940 104.4 52.6 -57.8 -48.8 31.3 -5.3 28.7 50 126 A L H X S+ 0 0 15 -4,-2.5 4,-3.0 -5,-0.3 -1,-0.2 0.885 108.0 50.0 -56.3 -43.4 31.2 -8.8 27.3 51 127 A S H X S+ 0 0 59 -4,-1.3 4,-2.0 2,-0.2 -1,-0.2 0.885 114.1 45.4 -65.8 -36.8 29.4 -10.2 30.4 52 128 A Q H X S+ 0 0 46 -4,-1.9 4,-2.1 2,-0.2 -2,-0.2 0.882 113.8 50.2 -71.2 -38.1 26.8 -7.4 30.1 53 129 A A H X S+ 0 0 0 -4,-3.1 4,-2.5 2,-0.2 -2,-0.2 0.905 111.0 48.2 -66.3 -41.7 26.5 -8.0 26.4 54 130 A R H X S+ 0 0 109 -4,-3.0 4,-2.5 1,-0.2 5,-0.2 0.921 110.2 52.0 -65.5 -42.1 26.0 -11.7 26.9 55 131 A D H X S+ 0 0 45 -4,-2.0 4,-2.0 -5,-0.2 -1,-0.2 0.913 111.5 47.2 -59.6 -42.7 23.4 -11.1 29.5 56 132 A F H X S+ 0 0 1 -4,-2.1 4,-2.6 2,-0.2 -2,-0.2 0.910 110.9 50.1 -65.6 -44.3 21.6 -8.7 27.2 57 133 A I H X S+ 0 0 0 -4,-2.5 4,-2.8 2,-0.2 -1,-0.2 0.872 110.1 51.4 -62.7 -37.4 21.7 -11.2 24.2 58 134 A N H X S+ 0 0 63 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.906 109.3 51.1 -65.6 -39.8 20.4 -13.9 26.5 59 135 A Q H X S+ 0 0 30 -4,-2.0 4,-2.1 -5,-0.2 -2,-0.2 0.922 111.1 48.7 -60.4 -45.4 17.5 -11.6 27.5 60 136 A Y H X S+ 0 0 30 -4,-2.6 4,-1.1 1,-0.2 -2,-0.2 0.951 112.9 45.2 -61.2 -51.6 16.8 -10.9 23.8 61 137 A Y H <>S+ 0 0 12 -4,-2.8 5,-2.8 1,-0.2 6,-0.4 0.844 111.5 53.1 -64.6 -30.3 16.8 -14.6 22.8 62 138 A S H ><5S+ 0 0 60 -4,-2.3 3,-1.4 1,-0.2 -1,-0.2 0.904 105.5 56.0 -67.8 -38.6 14.6 -15.5 25.8 63 139 A S H 3<5S+ 0 0 51 -4,-2.1 -1,-0.2 1,-0.3 -2,-0.2 0.745 112.0 40.9 -66.7 -24.6 12.2 -12.8 24.8 64 140 A I T 3<5S- 0 0 61 -4,-1.1 -1,-0.3 -3,-0.2 -2,-0.2 0.278 115.1-116.2-105.4 10.7 11.8 -14.4 21.3 65 141 A K T < 5S+ 0 0 161 -3,-1.4 -3,-0.2 -5,-0.1 -2,-0.1 0.832 85.1 110.2 61.5 40.6 11.7 -17.9 22.8 66 142 A R > < + 0 0 157 -5,-2.8 3,-1.8 -6,-0.1 6,-0.4 -0.094 36.4 154.0-131.7 32.1 14.9 -19.2 21.1 67 143 A S T 3 S+ 0 0 79 -6,-0.4 3,-0.1 1,-0.3 -9,-0.1 -0.497 72.6 14.7 -68.6 125.4 17.2 -19.4 24.1 68 144 A G T 3 S+ 0 0 53 -2,-0.3 -1,-0.3 1,-0.3 -10,-0.0 0.308 99.0 133.3 94.3 -7.0 19.9 -22.0 23.6 69 145 A S S <> S- 0 0 39 -3,-1.8 4,-2.4 1,-0.1 -1,-0.3 -0.137 72.6-103.7 -72.7 170.4 19.3 -22.1 19.8 70 146 A Q H > S+ 0 0 146 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.892 122.3 50.2 -60.9 -43.8 21.8 -22.0 17.0 71 147 A A H > S+ 0 0 46 2,-0.2 4,-2.5 1,-0.2 -1,-0.2 0.885 109.9 52.1 -63.3 -39.1 21.0 -18.4 16.2 72 148 A H H > S+ 0 0 6 -6,-0.4 4,-2.2 2,-0.2 -2,-0.2 0.945 112.6 43.3 -62.5 -49.8 21.4 -17.5 19.9 73 149 A E H X S+ 0 0 94 -4,-2.4 4,-2.1 1,-0.2 -2,-0.2 0.873 113.9 52.2 -64.6 -37.6 24.9 -19.1 20.2 74 150 A E H X S+ 0 0 101 -4,-2.5 4,-2.3 -5,-0.2 -1,-0.2 0.901 108.7 49.7 -66.2 -40.5 25.9 -17.6 16.8 75 151 A R H X S+ 0 0 6 -4,-2.5 4,-2.7 2,-0.2 5,-0.2 0.935 109.6 51.7 -64.9 -42.4 24.9 -14.1 18.0 76 152 A L H X S+ 0 0 19 -4,-2.2 4,-2.1 1,-0.2 -1,-0.2 0.905 111.7 46.6 -59.4 -41.7 26.9 -14.6 21.2 77 153 A Q H X S+ 0 0 129 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.862 111.3 53.1 -67.7 -35.9 30.0 -15.6 19.2 78 154 A E H X S+ 0 0 83 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.919 109.5 47.2 -65.1 -45.0 29.4 -12.7 16.9 79 155 A V H X S+ 0 0 2 -4,-2.7 4,-2.5 2,-0.2 5,-0.2 0.916 112.3 49.6 -64.4 -43.6 29.3 -10.2 19.8 80 156 A E H X S+ 0 0 58 -4,-2.1 4,-3.1 -5,-0.2 -1,-0.2 0.915 111.7 49.0 -61.6 -43.2 32.4 -11.7 21.4 81 157 A A H X S+ 0 0 59 -4,-2.2 4,-2.5 2,-0.2 5,-0.2 0.912 111.1 49.5 -63.6 -44.2 34.3 -11.5 18.1 82 158 A E H X S+ 0 0 53 -4,-2.3 4,-2.2 2,-0.2 6,-0.5 0.908 115.4 42.6 -63.7 -41.5 33.3 -7.9 17.5 83 159 A V H X S+ 0 0 5 -4,-2.5 4,-2.4 3,-0.2 -2,-0.2 0.919 110.9 58.5 -69.7 -40.7 34.3 -6.9 21.0 84 160 A A H < S+ 0 0 85 -4,-3.1 -2,-0.2 -5,-0.2 -1,-0.2 0.931 117.6 30.0 -51.7 -52.3 37.5 -9.0 20.6 85 161 A S H < S+ 0 0 99 -4,-2.5 -1,-0.2 -5,-0.1 -2,-0.2 0.743 136.8 22.1 -83.6 -25.1 38.7 -7.1 17.5 86 162 A T H < S- 0 0 76 -4,-2.2 -3,-0.2 2,-0.4 -2,-0.2 0.629 92.9-118.7-119.1 -18.0 37.2 -3.6 18.2 87 163 A G S < S+ 0 0 30 -4,-2.4 2,-0.2 -5,-0.4 -4,-0.2 0.224 91.1 43.1 97.0 -14.7 36.5 -3.2 21.9 88 164 A T - 0 0 20 -6,-0.5 -2,-0.4 74,-0.0 -1,-0.3 -0.735 68.4-147.3-143.5-171.0 32.8 -2.7 21.4 89 165 A Y - 0 0 0 -2,-0.2 2,-0.4 -3,-0.1 -10,-0.1 -0.941 13.9-118.5-156.1 174.3 29.9 -4.2 19.4 90 166 A H - 0 0 88 -2,-0.3 2,-0.2 182,-0.0 -8,-0.1 -0.946 18.8-125.5-127.7 149.3 26.7 -3.1 17.7 91 167 A L - 0 0 8 -2,-0.4 2,-0.1 1,-0.1 179,-0.0 -0.596 23.7-120.4 -89.5 149.2 23.1 -4.1 18.2 92 168 A R > - 0 0 107 -2,-0.2 4,-2.1 1,-0.1 3,-0.3 -0.450 36.6-101.9 -78.6 161.8 20.8 -5.4 15.5 93 169 A E H > S+ 0 0 144 1,-0.2 4,-2.0 2,-0.2 3,-0.2 0.925 122.1 45.5 -50.5 -54.2 17.7 -3.3 14.8 94 170 A S H > S+ 0 0 49 1,-0.2 4,-2.4 2,-0.2 -1,-0.2 0.805 109.5 56.6 -64.3 -28.9 15.3 -5.6 16.6 95 171 A E H > S+ 0 0 0 -3,-0.3 4,-2.7 2,-0.2 -1,-0.2 0.904 106.8 49.0 -69.0 -40.1 17.7 -5.9 19.6 96 172 A L H X S+ 0 0 1 -4,-2.1 4,-2.7 2,-0.2 5,-0.2 0.917 111.4 49.7 -63.8 -44.2 17.7 -2.1 19.9 97 173 A V H X S+ 0 0 43 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.942 113.7 45.5 -59.2 -49.3 13.9 -2.0 19.8 98 174 A F H X S+ 0 0 30 -4,-2.4 4,-2.4 1,-0.2 -2,-0.2 0.917 113.7 50.6 -60.6 -43.6 13.7 -4.7 22.5 99 175 A G H X S+ 0 0 0 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.902 108.2 50.3 -63.3 -42.9 16.3 -3.0 24.6 100 176 A A H X S+ 0 0 0 -4,-2.7 4,-1.6 2,-0.2 -1,-0.2 0.914 112.7 46.9 -63.0 -44.2 14.6 0.4 24.5 101 177 A K H X S+ 0 0 57 -4,-2.0 4,-2.8 -5,-0.2 -1,-0.2 0.904 111.3 51.7 -65.0 -39.7 11.3 -1.1 25.6 102 178 A Q H X S+ 0 0 6 -4,-2.4 4,-2.7 1,-0.2 -1,-0.2 0.888 105.7 55.5 -63.6 -38.4 12.9 -3.1 28.4 103 179 A A H X S+ 0 0 0 -4,-2.2 4,-0.7 2,-0.2 296,-0.4 0.883 111.4 43.3 -61.9 -39.1 14.6 0.0 29.7 104 180 A W H >< S+ 0 0 36 -4,-1.6 3,-1.4 2,-0.2 -2,-0.2 0.958 113.7 51.3 -68.7 -50.4 11.2 1.7 30.0 105 181 A R H 3< S+ 0 0 29 -4,-2.8 -2,-0.2 1,-0.3 -1,-0.2 0.848 111.8 49.2 -52.7 -36.6 9.7 -1.4 31.5 106 182 A N H 3< S+ 0 0 3 -4,-2.7 289,-0.3 -5,-0.2 -1,-0.3 0.609 79.4 115.8 -81.5 -13.7 12.6 -1.5 34.0 107 183 A A X< - 0 0 22 -3,-1.4 3,-1.5 -4,-0.7 6,-0.1 -0.423 49.5-162.3 -62.9 102.5 12.4 2.2 35.1 108 184 A P T 3 S+ 0 0 33 0, 0.0 262,-2.7 0, 0.0 -1,-0.2 0.729 85.1 53.0 -58.3 -25.5 11.4 2.1 38.8 109 185 A R T 3 S+ 0 0 60 260,-0.2 2,-0.6 264,-0.1 260,-0.1 0.439 84.8 98.1 -93.9 0.7 10.2 5.7 38.9 110 186 A C X - 0 0 37 -3,-1.5 3,-0.7 -6,-0.2 264,-0.1 -0.795 44.5-175.1 -96.9 120.3 7.8 5.6 36.0 111 187 A V T 3 S+ 0 0 23 -2,-0.6 3,-0.4 1,-0.2 -1,-0.1 0.530 78.4 71.3 -85.4 -7.5 4.1 5.2 36.8 112 188 A G T > + 0 0 27 1,-0.2 3,-1.9 2,-0.1 -1,-0.2 0.253 58.1 116.9 -95.2 17.6 3.2 4.9 33.1 113 189 A R G X + 0 0 0 -3,-0.7 3,-1.8 1,-0.3 4,-0.2 0.554 50.8 84.3 -66.0 -6.3 4.7 1.5 32.5 114 190 A I G 3 S+ 0 0 53 -3,-0.4 3,-0.4 1,-0.3 -1,-0.3 0.875 94.7 52.0 -60.0 -30.2 1.3 -0.2 31.6 115 191 A Q G X S+ 0 0 63 -3,-1.9 3,-2.6 1,-0.2 -1,-0.3 0.430 75.3 112.4 -82.6 -1.6 2.2 1.3 28.2 116 192 A W T < S+ 0 0 59 -3,-1.8 -1,-0.2 1,-0.3 -11,-0.2 0.731 71.3 56.6 -48.0 -33.8 5.7 -0.1 27.9 117 193 A G T 3 S+ 0 0 41 -3,-0.4 2,-0.8 -4,-0.2 -1,-0.3 0.657 97.9 68.5 -74.8 -14.0 5.0 -2.5 25.1 118 194 A K < + 0 0 147 -3,-2.6 2,-0.4 -17,-0.1 34,-0.2 -0.800 65.2 132.8-110.7 91.5 3.8 0.4 22.9 119 195 A L - 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0 0 8 -5,-2.5 -1,-0.2 -6,-0.1 -192,-0.2 -0.990 57.6-100.4-122.5 129.0 -9.0 19.7 71.8 746 418 B T + 0 0 37 -194,-2.7 -59,-0.4 -2,-0.4 2,-0.3 -0.175 55.3 150.6 -51.9 133.7 -5.4 19.8 70.8 747 419 B I - 0 0 26 -61,-0.1 2,-0.4 -193,-0.0 -59,-0.2 -0.958 29.7-148.6-161.3 150.9 -4.7 18.9 67.1 748 420 B V B -h 688 0X 36 -61,-1.8 -59,-2.6 -2,-0.3 2,-0.1 -0.992 15.6-132.9-129.4 134.7 -2.1 19.9 64.5 749 421 B D > - 0 0 9 -2,-0.4 4,-2.6 -61,-0.2 5,-0.2 -0.417 30.3-107.9 -79.9 162.8 -2.6 20.2 60.8 750 422 B H H > S+ 0 0 0 1,-0.2 4,-1.7 2,-0.2 5,-0.1 0.710 115.8 52.0 -65.4 -23.0 -0.2 18.6 58.4 751 423 B H H > S+ 0 0 6 2,-0.2 4,-2.2 3,-0.1 -1,-0.2 0.938 113.7 42.3 -77.1 -49.9 1.4 21.9 57.2 752 424 B A H > S+ 0 0 35 1,-0.2 4,-2.0 2,-0.2 -2,-0.2 0.934 116.0 51.2 -60.5 -44.7 2.1 23.1 60.7 753 425 B A H X S+ 0 0 5 -4,-2.6 4,-1.8 1,-0.2 -1,-0.2 0.911 111.4 45.0 -60.3 -46.7 3.3 19.6 61.7 754 426 B T H X S+ 0 0 0 -4,-1.7 4,-1.9 2,-0.2 -1,-0.2 0.863 109.9 55.6 -69.2 -32.6 5.7 19.2 58.8 755 427 B V H X S+ 0 0 84 -4,-2.2 4,-1.5 1,-0.2 -1,-0.2 0.910 108.8 48.0 -64.3 -39.4 7.1 22.8 59.3 756 428 B S H X S+ 0 0 36 -4,-2.0 4,-2.4 1,-0.2 -1,-0.2 0.860 108.0 55.7 -69.3 -32.6 7.9 21.9 62.9 757 429 B F H X S+ 0 0 0 -4,-1.8 4,-2.6 2,-0.2 -1,-0.2 0.879 103.1 54.3 -66.8 -37.0 9.5 18.6 61.8 758 430 B M H X S+ 0 0 38 -4,-1.9 4,-1.9 2,-0.2 -1,-0.2 0.899 109.1 48.9 -61.5 -40.0 11.9 20.6 59.5 759 431 B K H X S+ 0 0 104 -4,-1.5 4,-2.9 1,-0.2 -2,-0.2 0.938 109.6 52.5 -63.4 -44.9 12.9 22.7 62.5 760 432 B H H X S+ 0 0 2 -4,-2.4 4,-2.6 1,-0.2 -2,-0.2 0.906 106.0 53.2 -57.6 -42.8 13.4 19.4 64.4 761 433 B L H X S+ 0 0 25 -4,-2.6 4,-1.9 1,-0.2 -1,-0.2 0.920 111.6 46.5 -58.6 -42.8 15.7 18.1 61.6 762 434 B D H X S+ 0 0 76 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.922 111.4 50.3 -66.0 -44.6 17.7 21.3 61.9 763 435 B N H X S+ 0 0 58 -4,-2.9 4,-2.1 1,-0.2 -2,-0.2 0.889 114.5 45.4 -58.2 -42.5 17.9 21.1 65.7 764 436 B E H X>S+ 0 0 4 -4,-2.6 4,-2.9 2,-0.2 6,-1.3 0.757 104.5 60.5 -73.8 -30.0 19.0 17.4 65.5 765 437 B Q H X5S+ 0 0 52 -4,-1.9 4,-1.3 4,-0.3 -1,-0.2 0.953 113.1 39.2 -62.7 -44.3 21.6 18.1 62.8 766 438 B K H <5S+ 0 0 156 -4,-1.8 -2,-0.2 2,-0.2 -1,-0.2 0.908 121.5 43.5 -70.0 -42.3 23.3 20.4 65.2 767 439 B A H <5S+ 0 0 65 -4,-2.1 -2,-0.2 -5,-0.2 -3,-0.2 0.893 137.0 2.4 -73.2 -43.0 22.8 18.3 68.3 768 440 B R H <5S- 0 0 45 -4,-2.9 -3,-0.2 2,-0.2 -2,-0.2 0.409 95.1-106.8-128.6 -1.0 23.6 14.8 66.9 769 441 B G S <> - 0 0 9 -262,-2.3 4,-2.1 -2,-0.3 3,-1.7 -0.860 16.6-159.8-101.2 100.7 11.2 7.5 57.1 775 447 B W H 3> S+ 0 0 26 -2,-0.9 4,-2.4 1,-0.3 -1,-0.2 0.847 86.5 57.3 -48.1 -48.5 10.3 9.7 54.2 776 448 B A H 34 S+ 0 0 18 1,-0.2 -1,-0.3 2,-0.2 -263,-0.1 0.697 115.1 38.3 -59.8 -23.4 7.1 7.7 53.2 777 449 B W H <4 S+ 0 0 117 -3,-1.7 -1,-0.2 -265,-0.1 -2,-0.2 0.750 113.4 53.2 -98.4 -30.5 5.7 8.1 56.7 778 450 B I H < S+ 0 0 0 -4,-2.1 -2,-0.2 -266,-0.1 -3,-0.2 0.860 93.2 79.6 -72.4 -38.4 6.8 11.7 57.4 779 451 B V S < S- 0 0 14 -4,-2.4 5,-0.1 -5,-0.2 6,-0.1 -0.622 93.7-114.9 -73.5 123.5 5.2 13.0 54.1 780 452 B P - 0 0 6 0, 0.0 -400,-0.2 0, 0.0 4,-0.2 -0.130 17.3-114.4 -57.3 154.0 1.4 13.4 54.8 781 453 B P S S+ 0 0 11 0, 0.0 -400,-2.1 0, 0.0 -399,-0.4 0.562 100.3 39.0 -70.2 -9.3 -1.2 11.3 52.9 782 454 B I S S+ 0 0 4 -403,-0.2 -404,-0.1 -402,-0.2 -92,-0.1 -0.947 120.6 12.5-133.8 157.2 -2.6 14.3 51.1 783 455 B S S > S+ 0 0 6 -2,-0.3 3,-1.3 -461,-0.1 4,-0.4 0.789 72.7 168.4 48.4 36.7 -0.9 17.4 49.6 784 456 B G G > S+ 0 0 5 1,-0.3 3,-1.7 -408,-0.2 6,-0.5 0.909 71.6 39.7 -44.1 -61.1 2.4 15.7 50.0 785 457 B S G 3 S+ 0 0 2 -408,-2.2 -1,-0.3 1,-0.3 -407,-0.1 0.570 101.4 72.6 -73.8 -5.7 4.5 18.1 47.9 786 458 B L G < S+ 0 0 12 -3,-1.3 -1,-0.3 -409,-0.4 -2,-0.2 0.521 92.0 73.2 -81.3 -6.5 2.7 21.1 49.3 787 459 B T S X S- 0 0 1 -3,-1.7 3,-1.0 -4,-0.4 4,-0.5 -0.813 88.6-123.3-107.1 150.7 4.6 20.4 52.5 788 460 B P G > S+ 0 0 27 0, 0.0 3,-0.9 0, 0.0 -372,-0.2 0.788 103.9 65.7 -60.7 -30.4 8.3 21.1 53.1 789 461 B V G > S+ 0 0 0 1,-0.2 3,-1.6 2,-0.2 -10,-0.1 0.778 87.6 69.3 -66.6 -25.1 9.3 17.5 54.1 790 462 B F G < S+ 0 0 31 -3,-1.0 -1,-0.2 -6,-0.5 -5,-0.1 0.872 101.9 46.1 -59.1 -35.7 8.4 16.3 50.6 791 463 B H G < S+ 0 0 7 -3,-0.9 -376,-2.5 -4,-0.5 2,-0.5 0.265 96.0 94.4 -91.8 9.7 11.5 18.1 49.2 792 464 B Q B < -U 414 0P 24 -3,-1.6 -378,-0.2 -378,-0.2 2,-0.1 -0.908 69.6-138.4-109.2 120.6 13.8 16.9 52.0 793 465 B E - 0 0 5 -380,-2.0 2,-0.3 -2,-0.5 -754,-0.1 -0.479 26.5-164.7 -72.2 147.8 16.0 13.8 51.5 794 466 B M - 0 0 8 -2,-0.1 -756,-0.5 -21,-0.0 2,-0.5 -0.962 18.1-141.4-136.7 153.7 16.1 11.7 54.6 795 467 B V B -i 772 0Y 2 -24,-0.6 -22,-2.3 -2,-0.3 2,-0.4 -0.951 19.4-156.4-114.7 132.2 18.2 8.8 55.9 796 468 B N B +E 35 0E 36 -761,-2.1 -761,-2.8 -2,-0.5 2,-0.3 -0.939 28.1 136.0-115.3 132.7 16.4 6.0 57.7 797 469 B Y - 0 0 6 -2,-0.4 2,-0.6 -763,-0.2 -763,-0.1 -0.974 50.7 -93.4-163.4 165.6 18.1 3.7 60.2 798 470 B I B +V 431 0Q 62 -367,-0.6 -367,-0.8 -765,-0.3 -368,-0.7 -0.800 36.6 177.0 -99.1 116.6 17.6 2.1 63.6 799 471 B L - 0 0 11 -2,-0.6 -370,-0.1 -289,-0.3 -289,-0.0 -0.795 29.5 -99.6-108.7 154.6 18.9 3.8 66.8 800 472 B S S S+ 0 0 38 -2,-0.3 2,-0.2 2,-0.1 -127,-0.1 -0.952 97.7 59.0-122.4 143.2 18.4 2.5 70.4 801 473 B P S S+ 0 0 0 0, 0.0 2,-0.3 0, 0.0 -128,-0.2 0.424 90.0 169.1 -52.8 147.1 16.5 3.2 72.8 802 474 B A E -F 672 0W 15 -130,-1.8 -130,-3.1 -2,-0.2 2,-0.4 -0.973 44.0-133.9-146.1 155.9 13.7 2.3 70.3 803 475 B F E +F 671 0W 35 -296,-0.5 2,-0.3 -2,-0.3 -132,-0.2 -0.897 39.4 173.8-101.4 137.0 10.0 1.5 70.0 804 476 B R E -F 670 0W 97 -134,-2.7 -134,-3.0 -2,-0.4 2,-0.1 -0.954 32.2-101.0-142.6 164.2 9.4 -1.6 67.9 805 477 B Y - 0 0 85 -2,-0.3 -136,-0.1 -136,-0.2 -359,-0.0 -0.471 35.4-170.5 -80.2 158.0 6.6 -3.9 66.7 806 478 B Q - 0 0 28 -138,-0.4 -138,-0.0 -2,-0.1 0, 0.0 -0.976 32.7 -80.2-145.5 156.1 6.0 -7.2 68.4 807 479 B P - 0 0 110 0, 0.0 -1,-0.0 0, 0.0 0, 0.0 -0.159 51.7-101.3 -55.1 148.1 3.8 -10.3 67.7 808 480 B D - 0 0 83 1,-0.1 -234,-0.1 2,-0.1 -140,-0.0 -0.578 34.2-122.1 -70.3 133.3 0.1 -10.1 68.6 809 481 B P 0 0 39 0, 0.0 -1,-0.1 0, 0.0 -235,-0.1 0.324 360.0 360.0 -62.5 10.4 -0.3 -12.1 71.9 810 482 B W 0 0 123 -236,-0.1 -2,-0.1 0, 0.0 0, 0.0 -0.725 360.0 360.0-129.9 360.0 -2.8 -14.5 70.5