==== 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 04-SEP-01 1JWJ . COMPND 2 MOLECULE: NITRIC OXIDE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR M.AOYAGI,A.S.ARVAI,S.GHOSH,D.J.STUEHR,J.A.TAINER,E.D.GETZOFF . 823 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 39951.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 536 65.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 18 2.2 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 81 9.8 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 . 4 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 . 65 7.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 96 11.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 225 27.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 14 1.7 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 5 2 1 0 1 2 0 0 0 2 0 0 2 2 2 4 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 4 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 0 PARALLEL BRIDGES PER LADDER . 6 6 10 1 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 . 5 5 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 77 A Q 0 0 117 0, 0.0 2,-0.3 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -57.2 111.2 89.8 11.5 2 78 A Y - 0 0 112 17,-0.0 2,-0.4 16,-0.0 15,-0.2 -0.963 360.0-103.0-162.2 170.3 111.3 93.4 13.0 3 79 A V E -A 16 0A 55 13,-2.1 13,-2.9 -2,-0.3 2,-0.4 -0.895 32.6-126.7-109.6 137.7 109.3 95.9 14.9 4 80 A R E -A 15 0A 153 -2,-0.4 2,-0.4 11,-0.2 11,-0.2 -0.697 22.4-166.2 -86.5 128.4 107.7 98.9 13.2 5 81 A I E -A 14 0A 2 9,-2.8 9,-2.6 -2,-0.4 2,-0.4 -0.954 3.4-160.7-116.6 131.7 108.4 102.4 14.6 6 82 A K E -A 13 0A 64 -2,-0.4 383,-1.3 7,-0.2 2,-1.0 -0.947 14.7-151.7-121.6 133.3 106.4 105.5 13.6 7 83 A N B > -B 388 0B 18 5,-2.6 4,-2.6 -2,-0.4 5,-0.4 -0.813 10.1-163.3 -98.2 96.1 107.3 109.2 13.9 8 84 A W T 4 S+ 0 0 160 379,-1.4 380,-0.1 -2,-1.0 -1,-0.1 0.494 85.4 59.0 -59.4 -3.4 103.8 110.8 14.3 9 85 A G T 4 S+ 0 0 57 378,-0.5 -1,-0.2 375,-0.1 379,-0.1 0.914 124.3 13.9 -89.3 -55.4 105.5 114.1 13.4 10 86 A S T 4 S- 0 0 80 -3,-0.3 -2,-0.2 377,-0.1 3,-0.1 0.374 97.4-125.1-100.1 -0.4 106.8 113.3 9.9 11 87 A G < + 0 0 40 -4,-2.6 -3,-0.2 1,-0.2 0, 0.0 0.447 57.9 154.3 69.7 0.5 104.8 110.1 9.5 12 88 A E - 0 0 89 -5,-0.4 -5,-2.6 -6,-0.1 2,-0.4 -0.176 34.6-142.0 -63.0 150.8 108.1 108.3 8.8 13 89 A I E -A 6 0A 54 -7,-0.2 2,-0.3 -3,-0.1 -7,-0.2 -0.955 13.4-170.0-120.8 132.6 108.5 104.6 9.5 14 90 A L E -A 5 0A 26 -9,-2.6 -9,-2.8 -2,-0.4 2,-0.6 -0.893 16.7-138.2-118.1 149.1 111.6 102.8 10.9 15 91 A H E -A 4 0A 85 -2,-0.3 2,-0.7 -11,-0.2 -11,-0.2 -0.912 14.4-152.1-113.1 108.0 112.3 99.1 11.1 16 92 A D E +A 3 0A 0 -13,-2.9 -13,-2.1 -2,-0.6 350,-0.2 -0.685 34.7 148.9 -82.9 113.1 113.9 98.0 14.3 17 93 A T > + 0 0 61 348,-2.8 3,-1.0 -2,-0.7 349,-0.2 0.486 59.8 78.4-115.4 -13.0 116.0 94.8 13.9 18 94 A L G > S+ 0 0 4 347,-2.4 3,-2.0 1,-0.2 348,-0.2 0.727 74.0 77.1 -70.8 -24.0 118.6 95.6 16.6 19 95 A H G > S+ 0 0 45 346,-0.3 3,-1.6 1,-0.3 -1,-0.2 0.705 78.0 74.9 -61.1 -20.2 116.3 94.5 19.5 20 96 A H G < S+ 0 0 118 -3,-1.0 -1,-0.3 1,-0.3 -2,-0.1 0.722 89.1 59.2 -65.0 -20.7 117.0 90.9 18.6 21 97 A K G < S+ 0 0 155 -3,-2.0 -1,-0.3 -4,-0.1 -2,-0.2 0.197 82.5 121.0 -93.3 14.9 120.5 91.4 20.2 22 98 A A < 0 0 41 -3,-1.6 373,-0.2 1,-0.1 374,-0.0 -0.407 360.0 360.0 -77.6 155.8 118.9 92.3 23.6 23 99 A T 0 0 134 371,-2.1 -1,-0.1 -2,-0.1 -2,-0.1 -0.341 360.0 360.0 -76.0 360.0 119.6 90.3 26.8 24 ! 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 25 109 A C 0 0 173 0, 0.0 2,-0.9 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 100.6 104.0 96.9 32.5 26 110 A L + 0 0 147 1,-0.2 0, 0.0 2,-0.1 0, 0.0 -0.832 360.0 129.2 -97.9 100.1 106.8 98.6 34.4 27 111 A G + 0 0 34 -2,-0.9 -1,-0.2 345,-0.0 345,-0.1 0.734 65.2 51.0-116.3 -50.2 107.7 101.7 32.5 28 112 A S S S+ 0 0 105 344,-0.0 2,-0.6 2,-0.0 -2,-0.1 0.064 79.2 123.8 -81.4 24.6 107.7 104.7 34.8 29 113 A I - 0 0 76 1,-0.2 -3,-0.0 0, 0.0 0, 0.0 -0.796 50.2-156.5 -89.8 124.2 110.0 102.9 37.3 30 114 A M S S+ 0 0 108 -2,-0.6 -1,-0.2 1,-0.2 -2,-0.0 0.947 84.7 19.9 -65.1 -54.5 113.2 104.8 38.0 31 115 A N S S+ 0 0 106 370,-0.0 -1,-0.2 3,-0.0 5,-0.1 -0.584 80.6 176.5-120.0 69.0 115.6 102.1 39.1 32 116 A P > - 0 0 21 0, 0.0 3,-1.8 0, 0.0 4,-0.3 -0.335 41.2-115.1 -71.3 155.7 114.1 98.7 37.8 33 117 A K G > S+ 0 0 198 1,-0.3 3,-1.2 2,-0.2 368,-0.1 0.793 113.4 65.4 -60.3 -29.5 116.0 95.5 38.3 34 118 A S G 3 S+ 0 0 83 1,-0.3 -1,-0.3 3,-0.1 -3,-0.0 0.654 106.2 44.0 -67.8 -16.6 116.5 95.0 34.6 35 119 A L G < S+ 0 0 14 -3,-1.8 366,-3.1 365,-0.1 2,-0.3 0.355 102.5 84.7-108.0 2.7 118.7 98.2 34.7 36 120 A T B < -c 401 0C 28 -3,-1.2 2,-0.5 -4,-0.3 366,-0.2 -0.809 54.4-164.5-110.1 145.0 120.6 97.2 37.8 37 121 A R - 0 0 71 364,-2.5 366,-0.2 -2,-0.3 363,-0.1 -0.902 22.2-159.4-129.2 101.0 123.7 95.0 38.2 38 122 A G - 0 0 26 -2,-0.5 2,-0.0 364,-0.2 364,-0.0 0.062 20.7 -81.1 -73.2-176.9 124.3 94.0 41.7 39 123 A P - 0 0 62 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 -0.229 35.8-162.4 -80.7 168.5 127.3 92.7 43.8 40 124 A R - 0 0 58 123,-0.3 122,-0.1 -2,-0.0 4,-0.1 -0.935 21.0-154.2-145.6 164.9 128.8 89.2 44.0 41 125 A D S S+ 0 0 102 -2,-0.3 122,-0.2 2,-0.1 123,-0.1 0.145 82.0 52.5-128.8 15.0 131.1 87.3 46.3 42 126 A K S S- 0 0 148 1,-0.1 -1,-0.1 119,-0.0 120,-0.0 -0.977 92.8 -94.5-146.8 149.6 132.4 84.8 43.8 43 127 A P - 0 0 79 0, 0.0 119,-0.1 0, 0.0 -2,-0.1 0.034 54.8 -80.5 -57.7 172.0 134.0 85.2 40.3 44 128 A T - 0 0 26 117,-0.4 5,-0.1 43,-0.2 119,-0.0 -0.683 56.3-103.9 -79.4 125.9 132.0 85.1 37.1 45 129 A P >> - 0 0 50 0, 0.0 4,-2.6 0, 0.0 3,-1.3 -0.222 24.0-130.2 -50.9 132.7 131.4 81.4 36.2 46 130 A L H 3> S+ 0 0 83 1,-0.3 4,-1.9 2,-0.2 -2,-0.1 0.776 105.5 59.6 -57.8 -31.5 133.6 80.4 33.3 47 131 A E H 34 S+ 0 0 144 2,-0.2 -1,-0.3 1,-0.2 -3,-0.0 0.753 113.8 38.6 -71.0 -22.0 130.8 78.9 31.3 48 132 A E H <> S+ 0 0 103 -3,-1.3 4,-1.5 2,-0.1 -2,-0.2 0.888 116.1 50.0 -90.8 -46.7 129.1 82.3 31.3 49 133 A L H X S+ 0 0 4 -4,-2.6 4,-2.4 1,-0.2 5,-0.2 0.942 104.1 56.6 -57.3 -56.5 132.2 84.5 30.9 50 134 A L H X S+ 0 0 56 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.859 107.1 47.3 -47.5 -49.9 133.7 82.7 27.9 51 135 A P H > S+ 0 0 58 0, 0.0 4,-2.4 0, 0.0 -1,-0.2 0.943 113.1 48.6 -60.6 -46.3 130.6 83.1 25.6 52 136 A H H X S+ 0 0 86 -4,-1.5 4,-2.2 1,-0.2 -2,-0.2 0.869 110.9 51.5 -60.0 -38.5 130.2 86.8 26.4 53 137 A A H X S+ 0 0 0 -4,-2.4 4,-2.6 2,-0.2 -1,-0.2 0.897 108.5 50.8 -66.2 -40.9 133.9 87.4 25.8 54 138 A I H X S+ 0 0 51 -4,-2.2 4,-2.0 -5,-0.2 -2,-0.2 0.938 109.3 51.6 -61.6 -46.5 133.6 85.7 22.4 55 139 A E H X S+ 0 0 117 -4,-2.4 4,-2.2 1,-0.2 -2,-0.2 0.922 112.1 46.2 -55.4 -49.3 130.6 87.8 21.5 56 140 A F H X S+ 0 0 4 -4,-2.2 4,-3.1 2,-0.2 5,-0.2 0.925 109.3 51.9 -61.7 -50.5 132.5 91.0 22.4 57 141 A I H X S+ 0 0 0 -4,-2.6 4,-2.0 1,-0.2 -1,-0.2 0.854 112.3 48.9 -56.2 -34.2 135.7 90.1 20.6 58 142 A N H X S+ 0 0 66 -4,-2.0 4,-1.9 -5,-0.2 -1,-0.2 0.893 111.0 49.1 -72.2 -39.6 133.6 89.4 17.5 59 143 A Q H X S+ 0 0 66 -4,-2.2 4,-0.9 2,-0.2 -2,-0.2 0.975 112.3 48.4 -62.4 -53.0 131.7 92.7 17.8 60 144 A Y H >< S+ 0 0 14 -4,-3.1 3,-0.6 1,-0.2 4,-0.3 0.872 115.6 42.8 -54.8 -46.6 135.0 94.7 18.2 61 145 A Y H >< S+ 0 0 19 -4,-2.0 3,-0.8 -5,-0.2 7,-0.3 0.781 109.0 58.8 -74.3 -24.9 136.6 93.1 15.2 62 146 A G H 3< S+ 0 0 63 -4,-1.9 -1,-0.2 1,-0.2 -2,-0.2 0.629 94.7 66.9 -78.4 -11.4 133.5 93.3 13.1 63 147 A S T << S+ 0 0 64 -4,-0.9 -1,-0.2 -3,-0.6 -2,-0.2 0.611 75.2 107.6 -84.8 -12.9 133.4 97.1 13.6 64 148 A F S < S- 0 0 58 -3,-0.8 3,-0.3 -4,-0.3 -3,-0.0 -0.360 74.1-130.5 -67.1 144.2 136.6 97.7 11.5 65 149 A K S S+ 0 0 197 1,-0.3 2,-0.5 -2,-0.1 -1,-0.1 0.901 103.5 26.3 -59.7 -41.3 136.2 99.3 8.1 66 150 A E S S- 0 0 149 2,-0.0 -1,-0.3 -3,-0.0 -3,-0.1 -0.969 97.0-120.8-129.2 112.5 138.5 96.5 6.7 67 151 A A - 0 0 78 -2,-0.5 2,-0.4 -3,-0.3 -5,-0.1 -0.121 13.2-157.0 -52.7 141.7 138.5 93.2 8.6 68 152 A K > + 0 0 89 -7,-0.3 4,-2.0 1,-0.1 3,-0.2 -0.723 16.8 177.1-123.0 76.1 141.8 91.9 10.0 69 153 A I H > S+ 0 0 113 -2,-0.4 4,-2.7 1,-0.2 5,-0.3 0.807 72.1 56.0 -52.4 -42.2 141.0 88.2 10.3 70 154 A E H > S+ 0 0 172 1,-0.2 4,-2.9 2,-0.2 -1,-0.2 0.962 112.2 43.0 -59.4 -50.4 144.4 86.9 11.5 71 155 A E H > S+ 0 0 87 1,-0.2 4,-3.3 2,-0.2 -1,-0.2 0.871 111.6 56.9 -59.8 -39.9 144.3 89.3 14.5 72 156 A H H X S+ 0 0 39 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.950 111.8 39.8 -56.8 -53.7 140.7 88.4 15.1 73 157 A L H X S+ 0 0 96 -4,-2.7 4,-2.7 2,-0.2 5,-0.2 0.952 115.6 52.8 -61.4 -48.5 141.4 84.7 15.4 74 158 A A H X S+ 0 0 50 -4,-2.9 4,-3.0 -5,-0.3 -2,-0.2 0.914 111.2 46.7 -53.2 -47.8 144.6 85.4 17.4 75 159 A R H X S+ 0 0 34 -4,-3.3 4,-2.8 2,-0.2 5,-0.3 0.933 110.6 50.5 -62.7 -49.4 142.7 87.5 19.8 76 160 A L H X S+ 0 0 31 -4,-2.5 4,-1.9 1,-0.2 -1,-0.2 0.932 116.1 43.8 -53.5 -45.6 139.8 85.1 20.3 77 161 A E H X S+ 0 0 109 -4,-2.7 4,-2.3 1,-0.2 -2,-0.2 0.905 113.7 49.2 -66.5 -45.2 142.4 82.3 21.0 78 162 A A H X S+ 0 0 40 -4,-3.0 4,-1.6 -5,-0.2 -1,-0.2 0.851 111.3 50.5 -64.4 -36.1 144.5 84.5 23.2 79 163 A V H X S+ 0 0 0 -4,-2.8 4,-2.3 2,-0.2 -1,-0.2 0.865 109.7 50.2 -69.7 -39.5 141.4 85.6 25.3 80 164 A T H X S+ 0 0 28 -4,-1.9 4,-3.0 -5,-0.3 5,-0.2 0.958 110.8 48.6 -63.2 -50.8 140.3 82.0 25.7 81 165 A K H X S+ 0 0 98 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.858 111.1 51.8 -57.7 -35.8 143.8 80.9 26.9 82 166 A E H X>S+ 0 0 54 -4,-1.6 4,-2.4 2,-0.2 6,-0.6 0.917 110.8 46.7 -68.4 -43.0 143.8 83.8 29.3 83 167 A I H X5S+ 0 0 3 -4,-2.3 4,-2.2 3,-0.2 -2,-0.2 0.907 113.2 49.5 -65.5 -42.0 140.4 82.8 30.7 84 168 A E H <5S+ 0 0 121 -4,-3.0 -2,-0.2 1,-0.2 -1,-0.2 0.913 119.1 37.9 -63.1 -43.0 141.5 79.2 31.0 85 169 A T H <5S+ 0 0 112 -4,-2.5 -2,-0.2 -5,-0.2 -1,-0.2 0.732 134.8 18.3 -83.5 -24.4 144.7 80.2 32.8 86 170 A T H <5S- 0 0 90 -4,-2.4 -3,-0.2 2,-0.3 -2,-0.2 0.601 91.7-122.8-122.5 -16.3 143.4 83.1 35.0 87 171 A G S <> - 0 0 53 -2,-0.2 4,-2.5 1,-0.1 3,-0.7 -0.475 31.3-110.3 -75.0 152.5 143.2 96.0 25.2 93 177 A L H 3> S+ 0 0 90 1,-0.3 4,-2.5 2,-0.2 5,-0.1 0.907 122.6 51.6 -50.3 -41.4 143.1 99.8 25.6 94 178 A D H 3> S+ 0 0 83 1,-0.2 4,-2.2 2,-0.2 -1,-0.3 0.819 108.1 50.0 -65.6 -34.1 141.5 100.0 22.2 95 179 A E H <> S+ 0 0 0 -3,-0.7 4,-2.6 2,-0.2 -1,-0.2 0.875 109.9 51.8 -70.8 -37.8 138.9 97.4 23.1 96 180 A L H X S+ 0 0 0 -4,-2.5 4,-2.6 2,-0.2 -2,-0.2 0.931 109.3 49.5 -64.0 -45.2 138.2 99.4 26.3 97 181 A I H X S+ 0 0 49 -4,-2.5 4,-2.1 1,-0.2 5,-0.2 0.959 112.0 48.0 -57.2 -52.5 137.7 102.6 24.2 98 182 A F H X S+ 0 0 29 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.901 111.9 51.4 -55.0 -42.4 135.4 100.8 21.9 99 183 A A H X S+ 0 0 0 -4,-2.6 4,-2.6 1,-0.2 -1,-0.2 0.895 107.9 50.1 -63.3 -45.1 133.5 99.4 24.9 100 184 A T H X S+ 0 0 0 -4,-2.6 4,-1.7 2,-0.2 -1,-0.2 0.884 113.9 44.7 -63.8 -40.5 133.0 102.8 26.6 101 185 A K H X S+ 0 0 48 -4,-2.1 4,-3.5 2,-0.2 -2,-0.2 0.907 114.3 48.6 -69.7 -43.4 131.6 104.4 23.4 102 186 A M H X S+ 0 0 8 -4,-2.4 4,-2.1 -5,-0.2 -2,-0.2 0.899 110.4 51.5 -63.5 -41.2 129.3 101.5 22.5 103 187 A A H < S+ 0 0 0 -4,-2.6 296,-0.4 2,-0.2 -1,-0.2 0.911 112.5 46.2 -61.9 -41.5 128.0 101.4 26.1 104 188 A W H >< S+ 0 0 34 -4,-1.7 3,-2.4 1,-0.2 -2,-0.2 0.972 111.4 52.1 -61.9 -52.4 127.3 105.2 25.8 105 189 A R H 3< S+ 0 0 32 -4,-3.5 -2,-0.2 1,-0.3 -1,-0.2 0.809 109.2 51.1 -53.6 -31.9 125.8 104.5 22.4 106 190 A N T 3< S+ 0 0 0 -4,-2.1 289,-0.4 -5,-0.1 -1,-0.3 0.175 78.7 119.3 -95.0 18.7 123.6 101.8 24.0 107 191 A A X - 0 0 18 -3,-2.4 3,-2.1 1,-0.2 6,-0.2 -0.700 45.8-166.6 -90.7 99.8 122.3 104.1 26.8 108 192 A P T 3 S+ 0 0 8 0, 0.0 262,-2.1 0, 0.0 -1,-0.2 0.799 85.7 50.7 -50.6 -38.1 118.5 104.3 26.4 109 193 A R T 3 S+ 0 0 44 260,-0.2 2,-0.6 264,-0.1 260,-0.1 0.408 87.5 100.6 -87.8 4.2 118.2 107.3 28.8 110 194 A C X - 0 0 34 -3,-2.1 3,-0.6 -6,-0.2 264,-0.1 -0.804 42.8-176.5 -99.6 123.8 120.9 109.5 27.1 111 195 A I T 3 S+ 0 0 30 -2,-0.6 3,-0.3 1,-0.2 -1,-0.1 0.583 79.4 65.5 -88.5 -12.0 119.9 112.3 24.8 112 196 A G T > + 0 0 30 1,-0.2 3,-2.6 2,-0.1 -1,-0.2 0.335 61.2 120.7 -95.0 11.5 123.4 113.4 24.0 113 197 A R G X + 0 0 0 -3,-0.6 3,-1.4 1,-0.3 -1,-0.2 0.525 53.9 80.1 -55.0 -7.9 124.3 110.2 22.1 114 198 A I G 3 S+ 0 0 54 -3,-0.3 3,-0.4 1,-0.3 -1,-0.3 0.791 92.2 54.7 -69.6 -21.4 125.0 111.9 18.9 115 199 A Q G X S+ 0 0 58 -3,-2.6 3,-3.0 1,-0.2 -1,-0.3 0.446 74.7 119.6 -86.1 -2.5 128.4 112.7 20.5 116 200 A W T < S+ 0 0 64 -3,-1.4 -1,-0.2 1,-0.3 -11,-0.1 0.687 70.9 49.7 -36.6 -40.8 129.0 109.0 21.2 117 201 A S T 3 S+ 0 0 68 -3,-0.4 2,-1.1 1,-0.2 -1,-0.3 0.627 95.5 77.2 -80.6 -12.2 132.2 108.7 19.2 118 202 A N < + 0 0 105 -3,-3.0 2,-0.4 -17,-0.1 34,-0.2 -0.697 65.7 132.8 -99.5 84.0 133.8 111.7 20.8 119 203 A L - 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0 0 7 -5,-2.9 -1,-0.2 -6,-0.2 -192,-0.2 -0.892 52.1-109.0-106.8 129.3 114.8 123.2 97.0 755 426 B T + 0 0 40 -194,-2.6 -59,-0.5 -2,-0.5 2,-0.3 -0.151 52.8 144.9 -55.9 141.3 117.3 121.6 99.3 756 427 B I - 0 0 23 -61,-0.1 2,-0.4 -193,-0.1 -59,-0.2 -0.913 32.2-144.6-171.7 153.0 120.9 122.8 99.0 757 428 B M B -d 697 0S 59 -61,-1.6 -59,-1.9 -2,-0.3 2,-0.1 -0.998 17.6-125.6-133.2 135.8 123.8 123.3 101.4 758 429 B D > - 0 0 42 -2,-0.4 4,-2.0 -61,-0.2 5,-0.2 -0.381 29.7-111.9 -72.7 158.6 126.5 126.0 101.3 759 430 B H H > S+ 0 0 15 2,-0.2 4,-2.2 1,-0.2 5,-0.1 0.813 112.9 55.8 -62.9 -31.5 130.2 124.9 101.3 760 431 B H H > S+ 0 0 71 2,-0.2 4,-2.2 1,-0.2 5,-0.2 0.982 110.5 42.3 -64.8 -56.0 130.9 126.4 104.8 761 432 B T H > S+ 0 0 67 1,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.875 114.4 54.0 -58.1 -38.1 128.1 124.5 106.5 762 433 B A H X S+ 0 0 7 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.898 106.6 51.2 -63.4 -43.1 129.1 121.4 104.5 763 434 B S H X S+ 0 0 0 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.933 110.7 46.8 -61.1 -48.4 132.7 121.6 105.6 764 435 B E H X S+ 0 0 129 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.892 111.1 54.6 -61.4 -37.6 131.8 121.8 109.3 765 436 B S H X S+ 0 0 26 -4,-2.1 4,-2.0 -5,-0.2 -2,-0.2 0.927 108.6 46.9 -61.5 -47.2 129.4 118.9 108.8 766 437 B F H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.833 109.3 54.8 -65.1 -34.7 132.2 116.7 107.3 767 438 B M H X S+ 0 0 14 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.935 107.4 49.5 -63.9 -44.9 134.5 117.7 110.2 768 439 B K H X S+ 0 0 110 -4,-2.3 4,-1.9 1,-0.2 -2,-0.2 0.903 110.4 52.2 -60.0 -40.5 131.9 116.5 112.7 769 440 B H H X S+ 0 0 3 -4,-2.0 4,-2.3 1,-0.2 -1,-0.2 0.913 104.3 55.1 -61.7 -46.7 131.6 113.3 110.7 770 441 B M H X S+ 0 0 2 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.879 108.1 49.3 -54.0 -43.3 135.3 112.6 110.8 771 442 B Q H X S+ 0 0 78 -4,-1.7 4,-1.5 1,-0.2 -1,-0.2 0.919 110.1 50.3 -63.5 -44.2 135.4 112.9 114.6 772 443 B N H X S+ 0 0 65 -4,-1.9 4,-2.1 1,-0.2 -2,-0.2 0.858 111.7 50.9 -61.2 -35.7 132.4 110.5 114.8 773 444 B E H X S+ 0 0 5 -4,-2.3 4,-3.0 2,-0.2 6,-0.7 0.850 107.3 48.3 -71.8 -42.4 134.3 108.1 112.5 774 445 B Y H X S+ 0 0 21 -4,-2.1 4,-0.9 4,-0.3 -1,-0.2 0.800 115.2 48.5 -69.7 -25.8 137.7 108.0 114.4 775 446 B R H < S+ 0 0 219 -4,-1.5 -2,-0.2 -5,-0.2 -1,-0.2 0.911 117.8 40.2 -77.1 -43.9 135.7 107.4 117.5 776 447 B A H < S- 0 0 71 -4,-2.1 -2,-0.2 -5,-0.2 -3,-0.2 0.878 141.3 -2.1 -74.9 -45.2 133.6 104.6 116.0 777 448 B R H < S- 0 0 54 -4,-3.0 -3,-0.2 2,-0.2 -2,-0.2 0.198 94.3-106.9-139.1 22.9 136.1 102.7 113.9 778 449 B G S < S+ 0 0 13 -4,-0.9 -347,-3.0 -5,-0.3 -346,-2.9 0.871 88.5 41.2 55.3 45.6 139.5 104.5 114.2 779 450 B G - 0 0 0 -6,-0.7 -2,-0.2 -349,-0.2 -3,-0.1 -0.721 50.5-156.9 157.2 153.0 139.6 106.0 110.8 780 451 B C - 0 0 1 -2,-0.2 24,-0.5 24,-0.1 2,-0.1 -0.854 28.0-130.4-152.7 107.9 137.9 107.8 107.9 781 452 B P + 0 0 0 0, 0.0 2,-0.3 0, 0.0 24,-0.3 -0.399 35.8 175.9 -62.1 132.2 139.3 107.7 104.4 782 453 B A - 0 0 1 22,-1.9 2,-1.0 -2,-0.1 -260,-0.2 -0.969 32.1-152.5-148.7 129.7 139.5 111.2 102.9 783 454 B D >> - 0 0 11 -262,-2.2 4,-1.9 -2,-0.3 3,-1.8 -0.810 14.7-164.5-100.7 89.8 140.8 112.6 99.6 784 455 B W H 3> S+ 0 0 96 -2,-1.0 4,-2.4 1,-0.3 3,-0.2 0.869 84.3 61.4 -39.5 -51.6 141.7 116.2 100.7 785 456 B I H 34 S+ 0 0 80 1,-0.2 -1,-0.3 2,-0.2 -263,-0.0 0.793 113.5 35.3 -50.7 -34.6 141.9 117.4 97.1 786 457 B F H <4 S+ 0 0 74 -3,-1.8 -1,-0.2 -265,-0.1 -2,-0.2 0.745 114.4 56.2 -93.2 -25.5 138.2 116.6 96.5 787 458 B L H < S+ 0 0 2 -4,-1.9 -2,-0.2 -3,-0.2 -3,-0.2 0.833 86.0 84.3 -77.3 -34.8 136.9 117.5 100.0 788 459 B V S < S- 0 0 18 -4,-2.4 5,-0.1 -5,-0.2 6,-0.1 -0.593 91.7-111.0 -73.6 122.1 138.2 121.1 100.1 789 460 B P - 0 0 9 0, 0.0 4,-0.1 0, 0.0 -1,-0.1 -0.051 23.5-110.0 -50.1 150.0 135.6 123.3 98.3 790 461 B P S S+ 0 0 61 0, 0.0 2,-0.3 0, 0.0 3,-0.1 0.485 102.8 30.5 -62.8 -4.1 136.5 124.9 95.0 791 462 B V S S+ 0 0 33 1,-0.1 -92,-0.1 2,-0.1 -88,-0.0 -0.977 112.8 27.4-151.6 156.0 136.6 128.3 96.7 792 463 B S >> + 0 0 53 -2,-0.3 3,-0.7 3,-0.1 4,-0.7 0.817 68.3 168.8 59.3 37.0 137.4 129.6 100.2 793 464 B G G >4 S+ 0 0 19 1,-0.2 3,-2.4 2,-0.2 6,-0.5 0.908 71.0 33.5 -41.5 -77.0 139.7 126.7 101.0 794 465 B S G 34 S+ 0 0 63 1,-0.3 -1,-0.2 5,-0.1 6,-0.1 0.573 110.0 67.5 -62.8 -11.1 141.5 127.8 104.2 795 466 B I G <4 S+ 0 0 120 -3,-0.7 -1,-0.3 4,-0.0 -2,-0.2 0.625 93.4 72.5 -81.9 -13.6 138.3 129.6 105.3 796 467 B T S X< S- 0 0 1 -3,-2.4 3,-1.3 -4,-0.7 4,-0.5 -0.814 87.3-130.3 -99.6 141.2 136.8 126.1 105.6 797 468 B P G > S+ 0 0 45 0, 0.0 3,-1.0 0, 0.0 -374,-0.2 0.812 101.4 68.4 -60.4 -31.3 138.0 123.8 108.5 798 469 B V G > S+ 0 0 0 1,-0.2 3,-1.1 2,-0.2 -10,-0.1 0.739 88.4 67.7 -61.2 -23.5 138.7 120.8 106.2 799 470 B F G < S+ 0 0 77 -3,-1.3 -1,-0.2 -6,-0.5 -5,-0.1 0.891 101.0 46.3 -63.2 -39.5 141.6 122.7 104.7 800 471 B H G < S+ 0 0 63 -3,-1.0 -378,-1.8 -4,-0.5 2,-0.5 0.261 93.9 98.5 -89.2 11.7 143.5 122.5 108.0 801 472 B Q B < -Q 421 0K 9 -3,-1.1 -380,-0.2 -380,-0.2 2,-0.2 -0.884 68.5-137.9-106.9 122.5 142.8 118.8 108.5 802 473 B E - 0 0 78 -382,-1.9 2,-0.3 -2,-0.5 -2,-0.1 -0.540 30.2-167.2 -73.4 143.0 145.4 116.2 107.6 803 474 B M - 0 0 30 -2,-0.2 2,-0.5 -21,-0.0 -383,-0.0 -0.959 22.6-141.7-136.8 155.3 143.8 113.2 105.9 804 475 B L - 0 0 38 -24,-0.5 -22,-1.9 -2,-0.3 2,-0.6 -0.972 17.0-155.7-118.2 121.4 144.6 109.7 104.8 805 476 B N + 0 0 78 -2,-0.5 2,-0.3 -24,-0.3 -22,-0.1 -0.863 28.9 146.6-101.9 118.3 143.2 108.5 101.5 806 477 B Y - 0 0 22 -2,-0.6 2,-0.7 -287,-0.1 -2,-0.0 -0.993 45.5-112.5-149.4 153.0 142.7 104.7 101.1 807 478 B V + 0 0 21 -2,-0.3 -370,-1.6 -374,-0.1 -287,-0.1 -0.779 37.0 172.5 -93.3 113.4 140.3 102.3 99.4 808 479 B L - 0 0 6 -2,-0.7 -372,-0.1 -289,-0.4 -371,-0.1 -0.100 32.6 -74.5 -96.6-159.2 138.2 100.1 101.7 809 480 B S S S+ 0 0 23 -2,-0.1 2,-0.2 2,-0.0 -127,-0.1 -0.969 104.9 44.1-155.2 134.9 135.3 97.7 100.8 810 481 B P S S+ 0 0 0 0, 0.0 2,-0.3 0, 0.0 -128,-0.2 0.532 88.9 172.6 -59.4 161.8 132.4 98.0 100.0 811 482 B F E -B 681 0R 6 -130,-2.2 -130,-3.0 -2,-0.2 2,-0.7 -0.996 41.0-131.5-152.2 151.0 133.4 100.8 97.5 812 483 B Y E -B 680 0R 17 -296,-0.5 -132,-0.2 -2,-0.3 2,-0.2 -0.914 38.5-171.5-102.7 108.2 132.1 103.0 94.7 813 484 B Y E -B 679 0R 8 -134,-2.7 -134,-2.6 -2,-0.7 -364,-0.2 -0.615 23.2-116.8-100.6 161.1 134.6 102.8 91.8 814 485 B Y B -r 449 0L 47 -366,-3.3 -364,-2.2 -2,-0.2 2,-0.3 -0.404 33.4-149.7 -82.7 169.0 135.0 104.6 88.5 815 486 B Q - 0 0 13 -366,-0.2 2,-0.3 -138,-0.2 -364,-0.2 -0.881 22.8 -92.6-136.7 167.8 134.6 102.6 85.3 816 487 B I - 0 0 67 -2,-0.3 5,-0.1 -366,-0.3 4,-0.0 -0.636 59.5 -90.9 -79.9 140.7 136.0 102.7 81.8 817 488 B E > - 0 0 56 -2,-0.3 3,-2.5 1,-0.1 4,-0.3 -0.385 36.3-135.4 -56.9 117.7 133.7 104.7 79.5 818 489 B P G >> S+ 0 0 2 0, 0.0 4,-3.1 0, 0.0 3,-1.8 0.793 100.7 65.7 -44.6 -39.9 131.3 102.0 78.1 819 490 B W G 34 S+ 0 0 92 1,-0.3 -2,-0.1 2,-0.2 -236,-0.0 0.528 99.7 55.6 -66.1 -3.0 131.6 103.3 74.5 820 491 B K G <4 S+ 0 0 149 -3,-2.5 -1,-0.3 -4,-0.0 -3,-0.1 0.528 120.2 25.3-103.9 -12.5 135.2 102.3 74.7 821 492 B T T <4 S+ 0 0 57 -3,-1.8 -2,-0.2 -4,-0.3 2,-0.1 0.614 92.0 106.7-122.7 -26.1 134.7 98.6 75.6 822 493 B H < - 0 0 29 -4,-3.1 2,-0.7 1,-0.1 -184,-0.0 -0.341 56.3-148.9 -62.7 131.9 131.2 97.8 74.3 823 494 B I - 0 0 152 -2,-0.1 -1,-0.1 -3,-0.0 -3,-0.0 -0.913 20.8-136.7-104.7 109.9 131.1 95.6 71.2 824 495 B W - 0 0 102 -2,-0.7 -187,-0.0 1,-0.1 0, 0.0 -0.226 9.6-152.4 -66.7 152.6 128.0 96.4 69.1 825 496 B Q 0 0 93 1,-0.3 -1,-0.1 0, 0.0 -188,-0.0 0.924 360.0 360.0 -85.8 -62.9 125.7 93.9 67.5 826 497 B N 0 0 123 0, 0.0 -1,-0.3 0, 0.0 0, 0.0 -0.698 360.0 360.0-148.3 360.0 124.4 95.9 64.6