==== 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 24-JUL-02 1M8I . COMPND 2 MOLECULE: INDUCIBLE NITRIC OXIDE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR R.J.ROSENFELD,E.D.GARCIN,K.PANDA,G.ANDERSSON,A.ABERG,A.V.WAL . 825 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 39802.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 528 64.0 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 . 80 9.7 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 . 71 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 90 10.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 224 27.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 1.8 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 6 0 2 0 0 2 0 0 0 2 0 0 3 0 4 3 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 7 8 3 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 . 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 0 122 0, 0.0 2,-0.2 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -59.1 111.3 90.3 10.5 2 78 A Y - 0 0 117 17,-0.0 2,-0.4 16,-0.0 15,-0.2 -0.635 360.0-107.7-137.3-167.4 111.4 93.9 11.8 3 79 A V E -A 16 0A 48 13,-0.7 13,-2.7 -2,-0.2 2,-0.2 -0.977 26.0-129.9-137.2 120.2 109.3 96.4 13.7 4 80 A R E -A 15 0A 157 -2,-0.4 2,-0.4 11,-0.2 11,-0.2 -0.484 22.6-169.4 -71.1 135.4 107.7 99.5 12.2 5 81 A I E -A 14 0A 7 9,-2.2 9,-1.7 -2,-0.2 2,-0.4 -0.995 6.4-157.6-128.2 120.3 108.4 102.7 14.0 6 82 A K E -A 13 0A 73 -2,-0.4 384,-2.0 7,-0.2 2,-0.7 -0.815 13.6-150.3-106.5 144.6 106.4 105.8 13.0 7 83 A N B >> -B 389 0B 18 5,-2.3 4,-3.1 -2,-0.4 3,-0.8 -0.817 10.1-161.2-110.7 90.2 107.2 109.5 13.4 8 84 A W T 34 S+ 0 0 162 380,-1.4 381,-0.1 -2,-0.7 -1,-0.1 0.516 85.2 56.1 -49.4 -8.8 103.8 111.2 13.8 9 85 A G T 34 S+ 0 0 55 379,-0.2 -1,-0.2 376,-0.2 380,-0.1 0.888 123.0 18.6 -92.2 -47.5 105.4 114.6 13.0 10 86 A S T <4 S- 0 0 78 -3,-0.8 -2,-0.2 2,-0.1 3,-0.1 0.542 97.8-128.5 -97.3 -14.1 107.1 113.9 9.6 11 87 A G < + 0 0 40 -4,-3.1 -3,-0.2 1,-0.2 0, 0.0 0.333 56.8 151.0 80.4 -5.1 105.0 110.8 8.9 12 88 A E - 0 0 99 -5,-0.4 -5,-2.3 -6,-0.1 2,-0.3 -0.174 34.7-145.3 -62.2 147.0 108.1 108.9 8.2 13 89 A I E -A 6 0A 57 -7,-0.2 2,-0.3 -3,-0.1 -7,-0.2 -0.850 13.4-171.7-114.3 151.6 108.4 105.2 8.9 14 90 A L E -A 5 0A 23 -9,-1.7 -9,-2.2 -2,-0.3 2,-0.6 -0.971 18.1-135.2-140.0 153.9 111.4 103.1 10.0 15 91 A H E -A 4 0A 64 -2,-0.3 2,-0.6 -11,-0.2 -11,-0.2 -0.924 15.4-152.5-116.7 110.7 112.2 99.4 10.4 16 92 A D E +A 3 0A 0 -13,-2.7 -13,-0.7 -2,-0.6 351,-0.2 -0.715 32.3 151.7 -86.1 119.0 113.9 98.3 13.6 17 93 A T > + 0 0 67 349,-2.2 3,-1.0 -2,-0.6 350,-0.2 0.505 61.4 76.9-116.3 -14.4 116.0 95.1 13.2 18 94 A L G > S+ 0 0 2 348,-2.7 3,-1.7 1,-0.2 349,-0.1 0.700 73.9 78.0 -71.2 -23.2 118.6 95.9 15.9 19 95 A H G > S+ 0 0 44 347,-0.3 3,-1.1 1,-0.3 -1,-0.2 0.626 78.1 73.9 -64.3 -13.4 116.2 94.9 18.8 20 96 A H G < S+ 0 0 123 -3,-1.0 -1,-0.3 1,-0.2 -2,-0.1 0.753 87.7 62.2 -71.2 -22.0 116.9 91.3 18.1 21 97 A K G < S+ 0 0 154 -3,-1.7 -1,-0.2 -4,-0.1 -2,-0.2 0.238 84.6 112.5 -88.1 13.6 120.4 91.7 19.6 22 98 A A < - 0 0 39 -3,-1.1 374,-0.2 1,-0.1 372,-0.0 -0.041 61.0-135.0 -76.6-177.3 118.9 92.6 23.0 23 99 A T 0 0 101 372,-0.9 -1,-0.1 373,-0.1 373,-0.1 0.673 360.0 360.0-103.8 -97.8 119.0 90.6 26.3 24 100 A S 0 0 146 11,-0.1 370,-0.0 371,-0.1 -1,-0.0 -0.880 360.0 360.0-143.6 360.0 115.9 90.2 28.4 25 ! 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 26 109 A C 0 0 170 0, 0.0 2,-1.7 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 100.7 104.2 96.4 32.7 27 110 A L + 0 0 136 1,-0.2 3,-0.1 2,-0.1 0, 0.0 -0.347 360.0 164.9 -60.2 84.0 107.0 98.3 34.4 28 111 A G + 0 0 53 -2,-1.7 2,-0.2 1,-0.2 -1,-0.2 0.977 61.2 6.3 -68.6 -93.1 106.3 101.7 32.8 29 112 A S S S+ 0 0 94 344,-0.0 2,-0.4 0, 0.0 -1,-0.2 -0.115 81.8 147.6 -91.4 37.4 107.9 104.8 34.4 30 113 A I - 0 0 86 -2,-0.2 -3,-0.0 1,-0.2 0, 0.0 -0.598 36.5-155.0 -76.0 126.7 110.1 103.0 36.9 31 114 A M S S+ 0 0 107 -2,-0.4 -1,-0.2 1,-0.2 0, 0.0 0.967 85.8 25.9 -65.9 -56.4 113.3 105.0 37.5 32 115 A N S S+ 0 0 111 3,-0.0 -1,-0.2 5,-0.0 2,-0.2 -0.663 78.7 179.1-111.5 73.3 115.6 102.2 38.6 33 116 A P > - 0 0 15 0, 0.0 3,-2.3 0, 0.0 4,-0.2 -0.531 37.9-122.5 -75.0 143.3 114.2 98.9 37.1 34 117 A K G > S+ 0 0 191 1,-0.3 3,-1.9 2,-0.2 368,-0.1 0.818 110.8 67.5 -52.7 -32.8 116.2 95.8 37.9 35 118 A S G 3 S+ 0 0 69 1,-0.3 -1,-0.3 3,-0.1 -11,-0.1 0.715 102.0 47.1 -60.9 -23.5 116.6 95.2 34.2 36 119 A L G < S+ 0 0 16 -3,-2.3 366,-2.6 365,-0.1 2,-0.4 0.275 100.9 85.5-101.8 9.5 118.8 98.3 34.1 37 120 A T B < -c 402 0C 30 -3,-1.9 2,-0.6 364,-0.2 366,-0.2 -0.924 51.8-168.0-119.9 136.2 121.0 97.3 37.1 38 121 A R - 0 0 66 364,-2.7 366,-0.2 -2,-0.4 363,-0.1 -0.915 28.1-169.0-120.4 96.7 124.0 95.1 37.3 39 122 A G - 0 0 24 -2,-0.6 362,-0.0 364,-0.2 364,-0.0 0.148 25.3 -60.6 -75.7-167.7 124.6 94.5 41.0 40 123 A P - 0 0 67 0, 0.0 2,-0.3 0, 0.0 -1,-0.2 -0.172 40.5-172.4 -73.8 166.1 127.4 93.0 43.2 41 124 A R - 0 0 66 123,-0.3 4,-0.1 4,-0.0 122,-0.0 -0.948 18.9-157.0-157.5 141.7 128.8 89.4 43.0 42 125 A D S S+ 0 0 96 -2,-0.3 122,-0.2 2,-0.1 123,-0.1 0.055 77.9 58.8-111.6 22.1 131.3 87.6 45.4 43 126 A K S S- 0 0 144 119,-0.1 120,-0.0 121,-0.0 -1,-0.0 -0.989 92.0 -95.6-147.3 144.5 132.5 85.1 42.9 44 127 A P - 0 0 79 0, 0.0 119,-0.1 0, 0.0 -2,-0.1 -0.017 54.8 -80.7 -55.9 164.2 134.2 85.5 39.4 45 128 A T - 0 0 27 117,-0.4 5,-0.1 1,-0.1 -4,-0.0 -0.593 56.7-108.0 -71.5 112.9 132.2 85.3 36.2 46 129 A P >> - 0 0 49 0, 0.0 3,-2.2 0, 0.0 4,-2.1 -0.135 24.1-126.2 -44.8 125.1 131.7 81.6 35.5 47 130 A L H 3> S+ 0 0 88 1,-0.3 4,-2.1 2,-0.2 -2,-0.1 0.748 107.4 60.6 -47.5 -33.5 133.8 80.6 32.5 48 131 A E H 34 S+ 0 0 144 2,-0.2 -1,-0.3 1,-0.2 -3,-0.0 0.797 112.7 38.6 -68.0 -27.1 130.9 79.2 30.6 49 132 A E H <> S+ 0 0 97 -3,-2.2 4,-1.6 2,-0.1 -2,-0.2 0.919 116.8 48.8 -85.8 -51.0 129.3 82.6 30.6 50 133 A L H X S+ 0 0 3 -4,-2.1 4,-2.9 1,-0.2 5,-0.2 0.923 104.6 57.2 -55.4 -53.0 132.4 84.8 30.1 51 134 A L H X S+ 0 0 66 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.845 109.4 43.9 -50.7 -45.6 133.9 82.9 27.1 52 135 A P H > S+ 0 0 61 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.941 115.4 47.2 -67.4 -47.4 130.8 83.3 24.9 53 136 A H H X S+ 0 0 94 -4,-1.6 4,-2.1 1,-0.2 219,-0.2 0.900 111.3 53.7 -59.3 -40.7 130.2 87.0 25.7 54 137 A A H X S+ 0 0 0 -4,-2.9 4,-2.2 -5,-0.2 -1,-0.2 0.915 108.9 47.3 -60.8 -46.2 133.9 87.6 25.2 55 138 A I H X S+ 0 0 42 -4,-1.8 4,-2.2 -5,-0.2 5,-0.2 0.921 108.9 54.0 -62.9 -45.9 133.8 86.1 21.7 56 139 A E H X S+ 0 0 127 -4,-2.3 4,-2.2 1,-0.2 -1,-0.2 0.914 110.5 47.6 -54.9 -44.7 130.7 88.0 20.7 57 140 A F H X S+ 0 0 5 -4,-2.1 4,-3.0 1,-0.2 -1,-0.2 0.898 109.8 51.3 -65.1 -42.7 132.5 91.2 21.7 58 141 A I H X S+ 0 0 0 -4,-2.2 4,-2.0 1,-0.2 -1,-0.2 0.821 112.1 48.6 -65.3 -28.4 135.7 90.3 19.8 59 142 A N H X S+ 0 0 66 -4,-2.2 4,-1.2 2,-0.2 -2,-0.2 0.864 111.0 49.8 -77.1 -37.1 133.5 89.6 16.7 60 143 A Q H < S+ 0 0 65 -4,-2.2 4,-0.4 -5,-0.2 -2,-0.2 0.975 113.7 46.3 -63.4 -52.9 131.7 92.9 17.1 61 144 A Y H >< S+ 0 0 36 -4,-3.0 3,-1.8 1,-0.2 -2,-0.2 0.952 118.4 38.6 -53.8 -62.0 134.9 94.8 17.4 62 145 A Y H 3< S+ 0 0 32 -4,-2.0 -1,-0.2 1,-0.3 -2,-0.2 0.693 109.5 65.2 -66.7 -16.0 136.7 93.2 14.5 63 146 A G T 3< S+ 0 0 61 -4,-1.2 2,-0.7 -3,-0.2 -1,-0.3 0.503 88.7 77.7 -84.0 -3.0 133.5 93.3 12.6 64 147 A S < + 0 0 54 -3,-1.8 2,-0.2 -4,-0.4 -1,-0.1 -0.867 69.0 83.1-114.7 99.4 133.4 97.1 12.5 65 148 A F S S- 0 0 142 -2,-0.7 3,-0.3 1,-0.1 -3,-0.0 -0.780 70.6-122.5 175.1 144.6 135.8 98.6 10.0 66 149 A K S S+ 0 0 204 1,-0.3 2,-0.9 -2,-0.2 -1,-0.1 0.976 112.0 38.4 -60.8 -54.3 135.8 99.5 6.3 67 150 A E S S- 0 0 148 -3,-0.1 2,-0.4 2,-0.0 -1,-0.3 -0.832 87.9-156.5-102.0 98.0 138.9 97.3 5.7 68 151 A A - 0 0 63 -2,-0.9 2,-0.9 -3,-0.3 -5,-0.1 -0.629 5.3-149.6 -79.9 125.9 138.5 94.2 7.9 69 152 A K > - 0 0 78 -2,-0.4 4,-1.4 1,-0.2 -1,-0.0 -0.829 12.4-174.4 -98.5 101.9 141.7 92.4 8.8 70 153 A I H > S+ 0 0 125 -2,-0.9 4,-2.6 2,-0.2 5,-0.2 0.874 77.1 57.3 -62.1 -45.0 140.7 88.7 9.2 71 154 A E H > S+ 0 0 146 1,-0.2 4,-3.0 2,-0.2 5,-0.2 0.953 107.7 46.2 -53.2 -58.0 144.1 87.4 10.5 72 155 A E H > S+ 0 0 107 1,-0.2 4,-3.0 2,-0.2 -1,-0.2 0.874 112.3 54.4 -53.6 -39.3 144.2 89.8 13.5 73 156 A H H X S+ 0 0 33 -4,-1.4 4,-2.8 2,-0.2 -2,-0.2 0.971 111.0 41.7 -59.6 -58.8 140.6 88.8 14.2 74 157 A L H X S+ 0 0 98 -4,-2.6 4,-2.3 1,-0.2 -2,-0.2 0.917 116.2 51.6 -55.7 -44.6 141.2 85.1 14.3 75 158 A A H X S+ 0 0 44 -4,-3.0 4,-2.9 -5,-0.2 5,-0.2 0.920 109.9 47.6 -59.6 -46.6 144.4 85.7 16.3 76 159 A R H X S+ 0 0 33 -4,-3.0 4,-2.6 -5,-0.2 5,-0.2 0.936 109.3 54.3 -62.3 -44.2 142.6 87.8 18.8 77 160 A L H X S+ 0 0 30 -4,-2.8 4,-2.2 1,-0.2 -2,-0.2 0.935 113.3 43.0 -52.7 -47.9 139.9 85.3 19.2 78 161 A E H X S+ 0 0 103 -4,-2.3 4,-2.6 1,-0.2 -2,-0.2 0.901 114.2 48.1 -65.0 -49.7 142.5 82.6 20.0 79 162 A A H X S+ 0 0 40 -4,-2.9 4,-2.4 2,-0.2 -1,-0.2 0.842 112.4 51.0 -62.9 -34.2 144.6 84.7 22.3 80 163 A V H X S+ 0 0 0 -4,-2.6 4,-2.4 -5,-0.2 -2,-0.2 0.934 111.0 46.1 -69.3 -48.9 141.5 85.8 24.2 81 164 A T H X S+ 0 0 41 -4,-2.2 4,-2.5 -5,-0.2 -2,-0.2 0.939 114.0 50.3 -59.5 -44.2 140.2 82.3 24.7 82 165 A K H X S+ 0 0 97 -4,-2.6 4,-2.5 1,-0.2 5,-0.2 0.931 109.5 50.4 -59.4 -46.0 143.7 81.2 25.8 83 166 A E H X>S+ 0 0 56 -4,-2.4 4,-2.7 1,-0.2 5,-0.6 0.883 110.2 49.9 -60.5 -39.8 143.9 84.1 28.2 84 167 A I H X5S+ 0 0 4 -4,-2.4 4,-1.6 3,-0.2 -1,-0.2 0.901 109.8 52.3 -66.3 -39.3 140.6 83.1 29.7 85 168 A E H <5S+ 0 0 147 -4,-2.5 -2,-0.2 1,-0.2 -1,-0.2 0.943 119.1 33.7 -61.4 -48.3 141.7 79.5 30.0 86 169 A T H <5S+ 0 0 108 -4,-2.5 -2,-0.2 -5,-0.1 -1,-0.2 0.810 134.6 22.0 -80.4 -32.7 144.9 80.4 31.9 87 170 A T H <5S- 0 0 89 -4,-2.7 2,-0.8 2,-0.3 -3,-0.2 0.645 90.7-129.6-110.6 -21.7 143.8 83.4 33.9 88 171 A G S < - 0 0 49 -2,-0.2 4,-2.6 1,-0.1 5,-0.2 -0.483 29.9-112.2 -77.1 156.1 143.3 96.1 24.4 94 177 A L H > S+ 0 0 86 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.921 121.2 53.7 -54.1 -42.0 143.2 99.9 24.7 95 178 A D H > S+ 0 0 101 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.890 108.8 48.2 -59.0 -42.9 141.7 100.1 21.3 96 179 A E H > S+ 0 0 0 2,-0.2 4,-3.1 1,-0.2 -1,-0.2 0.912 109.9 51.9 -64.7 -44.2 138.9 97.7 22.3 97 180 A L H X S+ 0 0 0 -4,-2.6 4,-3.1 2,-0.2 5,-0.2 0.933 109.1 50.0 -58.2 -48.2 138.2 99.6 25.5 98 181 A I H X S+ 0 0 54 -4,-2.5 4,-2.0 1,-0.2 5,-0.2 0.956 113.5 46.3 -54.3 -51.6 137.9 102.9 23.5 99 182 A F H X S+ 0 0 35 -4,-2.3 4,-2.3 1,-0.2 -1,-0.2 0.895 111.6 53.2 -59.1 -39.8 135.5 101.1 21.2 100 183 A A H X S+ 0 0 0 -4,-3.1 4,-3.2 1,-0.2 5,-0.2 0.948 108.0 48.8 -61.4 -49.4 133.6 99.6 24.2 101 184 A T H X S+ 0 0 0 -4,-3.1 4,-1.6 1,-0.2 -1,-0.2 0.849 112.9 46.1 -62.7 -37.5 133.1 102.9 25.9 102 185 A K H X S+ 0 0 45 -4,-2.0 4,-3.9 -5,-0.2 -1,-0.2 0.928 114.6 48.0 -71.5 -42.4 131.7 104.6 22.8 103 186 A M H X S+ 0 0 4 -4,-2.3 4,-2.7 -5,-0.2 -2,-0.2 0.947 110.0 52.0 -61.6 -47.8 129.4 101.7 21.9 104 187 A A H < S+ 0 0 0 -4,-3.2 296,-0.5 2,-0.2 -1,-0.2 0.885 114.7 43.3 -55.8 -40.5 128.2 101.5 25.5 105 188 A W H >< S+ 0 0 33 -4,-1.6 3,-2.9 -5,-0.2 -2,-0.2 0.961 110.5 54.8 -68.1 -51.2 127.4 105.2 25.3 106 189 A R H 3< S+ 0 0 33 -4,-3.9 -2,-0.2 1,-0.3 -1,-0.2 0.847 108.6 51.3 -48.9 -35.6 125.9 104.7 21.8 107 190 A N T 3< S+ 0 0 0 -4,-2.7 289,-0.4 -5,-0.2 -1,-0.3 0.072 78.6 122.8 -91.5 21.1 123.7 102.1 23.4 108 191 A A X - 0 0 18 -3,-2.9 3,-1.1 1,-0.2 6,-0.2 -0.754 44.1-166.7 -90.1 104.0 122.5 104.4 26.1 109 192 A P T 3 S+ 0 0 8 0, 0.0 262,-2.4 0, 0.0 -1,-0.2 0.826 86.0 49.3 -54.8 -35.1 118.6 104.5 25.9 110 193 A R T 3 S+ 0 0 44 260,-0.2 2,-0.5 -3,-0.1 260,-0.1 0.547 88.3 98.4 -87.9 -5.2 118.4 107.5 28.2 111 194 A C < - 0 0 38 -3,-1.1 3,-0.4 -6,-0.2 264,-0.1 -0.715 42.3-177.0 -94.9 126.4 121.0 109.8 26.6 112 195 A I S S+ 0 0 31 -2,-0.5 3,-0.4 1,-0.2 -1,-0.1 0.627 80.0 68.1 -88.4 -17.8 120.0 112.6 24.2 113 196 A G > + 0 0 28 1,-0.2 3,-2.6 2,-0.1 -1,-0.2 0.487 62.5 118.1 -84.5 3.1 123.6 113.6 23.4 114 197 A R G > + 0 0 0 -3,-0.4 3,-1.3 1,-0.3 -1,-0.2 0.466 52.9 79.2 -51.3 -7.8 124.4 110.4 21.5 115 198 A I G 3 S+ 0 0 56 -3,-0.4 3,-0.4 1,-0.3 -1,-0.3 0.847 93.6 55.5 -69.1 -24.3 125.1 112.1 18.2 116 199 A Q G X S+ 0 0 52 -3,-2.6 3,-2.9 1,-0.2 -1,-0.3 0.459 74.5 117.4 -82.4 -4.5 128.5 112.9 19.9 117 200 A W T < S+ 0 0 57 -3,-1.3 -1,-0.2 1,-0.3 -2,-0.1 0.744 72.7 47.9 -35.3 -49.7 129.1 109.2 20.6 118 201 A S T 3 S+ 0 0 65 -3,-0.4 2,-1.1 1,-0.2 -1,-0.3 0.645 97.2 77.9 -72.8 -13.6 132.2 108.8 18.5 119 202 A N < + 0 0 105 -3,-2.9 2,-0.4 -17,-0.1 34,-0.3 -0.604 68.0 127.2 -98.2 74.1 133.8 111.9 20.0 120 203 A L - 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0 0 9 -5,-2.7 -1,-0.2 -6,-0.2 -192,-0.2 -0.854 54.2-107.1-104.8 136.8 115.1 123.2 95.0 757 426 B T + 0 0 38 -194,-2.5 -59,-0.4 -2,-0.4 2,-0.3 -0.283 53.0 144.2 -63.0 140.8 117.6 121.6 97.3 758 427 B I - 0 0 26 -61,-0.1 2,-0.4 -193,-0.1 -59,-0.2 -0.909 31.9-147.9-170.9 151.9 121.2 122.9 97.1 759 428 B M B -d 699 0S 59 -61,-1.4 -59,-1.7 -2,-0.3 -2,-0.0 -1.000 20.1-124.5-132.7 131.5 124.0 123.5 99.6 760 429 B D > - 0 0 42 -2,-0.4 4,-1.7 -61,-0.2 5,-0.1 -0.304 31.3-110.3 -67.5 161.6 126.7 126.2 99.3 761 430 B H H > S+ 0 0 14 2,-0.2 4,-2.0 1,-0.2 5,-0.1 0.811 112.2 55.7 -65.4 -33.6 130.3 125.0 99.4 762 431 B H H >> S+ 0 0 68 2,-0.2 4,-2.5 1,-0.2 3,-0.7 0.988 109.3 44.4 -62.3 -59.6 131.2 126.4 102.9 763 432 B T H 3> S+ 0 0 66 1,-0.3 4,-1.3 2,-0.2 -1,-0.2 0.860 113.4 54.8 -51.4 -38.4 128.4 124.6 104.7 764 433 B A H 3X S+ 0 0 6 -4,-1.7 4,-2.5 2,-0.2 -1,-0.3 0.857 107.4 48.6 -65.3 -40.1 129.4 121.5 102.6 765 434 B S H S+ 0 0 4 -4,-2.2 4,-2.2 2,-0.2 5,-1.2 0.855 106.1 51.3 -67.6 -40.8 134.6 108.2 110.5 776 445 B Y H <5S+ 0 0 24 -4,-2.3 -1,-0.2 4,-0.3 -2,-0.2 0.742 114.6 47.2 -69.5 -20.1 137.9 108.3 112.4 777 446 B R H <5S+ 0 0 208 -4,-0.8 -2,-0.2 -5,-0.2 -1,-0.2 0.928 122.3 31.0 -83.4 -49.9 135.9 107.5 115.5 778 447 B A H <5S+ 0 0 78 -4,-2.6 -3,-0.2 1,-0.1 -2,-0.2 0.953 142.0 11.6 -74.3 -54.4 133.8 104.7 114.0 779 448 B R T <5S- 0 0 42 -4,-2.2 -3,-0.2 2,-0.2 -1,-0.1 0.489 94.5-122.4-103.4 -10.9 136.1 103.1 111.4 780 449 B G S > - 0 0 9 -262,-2.4 3,-2.5 -2,-0.4 4,-2.1 -0.804 12.4-163.5-103.7 91.1 141.1 112.9 97.8 786 455 B W H 3> S+ 0 0 96 -2,-0.9 4,-1.7 1,-0.3 -1,-0.2 0.865 85.6 62.4 -38.3 -51.9 142.1 116.4 98.8 787 456 B I H 34 S+ 0 0 84 1,-0.2 -1,-0.3 2,-0.2 -263,-0.1 0.748 113.1 34.7 -51.5 -29.2 142.2 117.6 95.2 788 457 B W H <4 S+ 0 0 107 -3,-2.5 -1,-0.2 -265,-0.2 -2,-0.2 0.774 112.9 58.4 -96.7 -29.6 138.5 116.8 94.8 789 458 B L H < S+ 0 0 2 -4,-2.1 -2,-0.2 -266,-0.2 -3,-0.2 0.663 86.6 84.4 -76.8 -16.6 137.3 117.8 98.2 790 459 B V S < S- 0 0 21 -4,-1.7 5,-0.1 -5,-0.2 6,-0.1 -0.790 89.0-115.9 -91.4 118.3 138.5 121.3 98.1 791 460 B P - 0 0 9 0, 0.0 4,-0.1 0, 0.0 7,-0.1 -0.030 20.8-114.1 -48.6 150.3 135.9 123.6 96.4 792 461 B P S S+ 0 0 59 0, 0.0 2,-0.3 0, 0.0 3,-0.1 0.395 100.7 38.9 -70.3 1.5 136.9 125.3 93.1 793 462 B V S S+ 0 0 28 1,-0.1 -92,-0.1 2,-0.1 -88,-0.0 -0.972 115.0 18.6-146.6 155.6 136.7 128.7 94.8 794 463 B S S >> S+ 0 0 56 -2,-0.3 3,-1.0 3,-0.1 4,-0.8 0.814 72.7 171.6 50.9 39.7 137.7 130.0 98.2 795 464 B G G >4 S+ 0 0 19 1,-0.3 3,-2.2 2,-0.2 6,-0.4 0.893 70.5 34.3 -40.2 -74.8 139.9 127.0 98.7 796 465 B S G 34 S+ 0 0 63 1,-0.3 -1,-0.3 5,-0.1 6,-0.1 0.530 107.3 70.4 -65.5 -9.0 141.8 127.9 102.0 797 466 B I G <4 S+ 0 0 116 -3,-1.0 -1,-0.3 4,-0.0 -2,-0.2 0.668 90.0 76.9 -80.4 -17.1 138.7 129.7 103.3 798 467 B T S XX S- 0 0 1 -3,-2.2 3,-0.8 -4,-0.8 4,-0.5 -0.710 85.4-130.6 -91.9 146.0 137.2 126.2 103.6 799 468 B P G >4 S+ 0 0 39 0, 0.0 3,-1.4 0, 0.0 4,-0.3 0.879 102.6 63.8 -61.7 -39.1 138.2 123.9 106.5 800 469 B V G >4 S+ 0 0 0 1,-0.3 3,-1.3 2,-0.2 -10,-0.1 0.775 89.9 68.8 -58.1 -27.6 139.0 120.8 104.3 801 470 B F G <4 S+ 0 0 74 -3,-0.8 -1,-0.3 -6,-0.4 -5,-0.1 0.872 102.5 45.3 -57.4 -39.1 141.8 122.8 102.6 802 471 B H G << S+ 0 0 67 -3,-1.4 -379,-1.4 -4,-0.5 2,-0.5 0.393 93.0 97.6 -85.5 -1.9 143.7 122.6 105.9 803 472 B Q B < S-Q 422 0K 5 -3,-1.3 -381,-0.2 -4,-0.3 2,-0.2 -0.806 71.3-132.8 -96.0 125.5 143.1 119.0 106.6 804 473 B E - 0 0 76 -383,-1.8 2,-0.3 -2,-0.5 -2,-0.1 -0.509 32.7-163.9 -72.0 140.9 145.7 116.4 105.7 805 474 B M - 0 0 31 -2,-0.2 2,-0.5 -21,-0.0 -19,-0.1 -0.979 22.6-145.4-135.7 151.1 144.1 113.5 103.9 806 475 B L - 0 0 39 -24,-0.4 -22,-2.5 -2,-0.3 2,-0.8 -0.952 14.9-158.8-115.5 119.5 144.9 109.9 102.9 807 476 B N + 0 0 79 -2,-0.5 2,-0.3 -24,-0.2 -22,-0.1 -0.832 28.5 149.4-105.1 99.3 143.4 108.7 99.6 808 477 B Y - 0 0 21 -2,-0.8 2,-0.6 -371,-0.0 -2,-0.0 -0.897 44.8-114.0-127.3 156.4 143.2 104.9 99.3 809 478 B V + 0 0 19 -2,-0.3 -371,-1.2 -375,-0.1 -287,-0.1 -0.819 37.4 172.8 -95.4 118.9 140.7 102.6 97.6 810 479 B L - 0 0 6 -2,-0.6 -373,-0.1 -289,-0.4 -372,-0.0 -0.095 29.8 -69.4-102.0-157.1 138.5 100.4 99.7 811 480 B S S S+ 0 0 33 1,-0.1 2,-0.2 -2,-0.1 -127,-0.1 -0.967 103.2 37.6-159.1 138.8 135.6 98.0 98.9 812 481 B P S S+ 0 0 0 0, 0.0 2,-0.3 0, 0.0 -128,-0.2 0.556 90.0 170.8 -61.7 165.4 132.8 98.1 98.0 813 482 B F E -B 683 0R 6 -130,-2.1 -130,-2.6 -2,-0.2 2,-0.7 -0.984 42.7-123.8-154.6 154.6 133.6 101.0 95.6 814 483 B Y E -B 682 0R 18 -296,-0.5 2,-0.2 -2,-0.3 -132,-0.2 -0.899 39.5-175.6-101.4 105.6 132.4 103.2 92.7 815 484 B Y E -B 681 0R 12 -134,-2.3 -134,-2.3 -2,-0.7 -364,-0.2 -0.637 24.6-115.0 -99.1 163.4 135.0 102.9 89.8 816 485 B Y B -r 451 0L 41 -366,-3.1 -364,-2.7 -2,-0.2 2,-0.3 -0.408 31.3-147.9 -85.0 169.3 135.1 104.6 86.5 817 486 B Q - 0 0 26 -138,-0.3 2,-0.3 -366,-0.2 -364,-0.2 -0.819 23.2 -92.4-133.1 171.4 134.7 102.6 83.3 818 487 B I - 0 0 69 -2,-0.3 5,-0.1 -366,-0.2 -366,-0.0 -0.693 57.2 -92.5 -83.6 138.8 136.0 102.8 79.8 819 488 B E >> - 0 0 89 -2,-0.3 3,-2.2 1,-0.1 4,-0.8 -0.385 38.0-138.3 -54.6 114.8 133.7 104.8 77.5 820 489 B P G >4 S+ 0 0 9 0, 0.0 3,-0.6 0, 0.0 -1,-0.1 0.822 95.9 65.0 -44.0 -47.4 131.5 102.0 76.0 821 490 B W G 34 S+ 0 0 65 1,-0.2 3,-0.3 -236,-0.1 5,-0.1 0.636 100.6 54.9 -58.1 -12.7 131.4 103.3 72.4 822 491 B K G <4 S+ 0 0 131 -3,-2.2 2,-0.5 1,-0.2 -1,-0.2 0.865 118.0 30.0 -87.0 -41.0 135.2 102.6 72.3 823 492 B T S << S+ 0 0 81 -4,-0.8 2,-0.4 -3,-0.6 -1,-0.2 -0.689 87.5 125.9-121.1 77.9 135.0 98.9 73.3 824 493 B H - 0 0 30 -2,-0.5 2,-2.4 -3,-0.3 -184,-0.0 -0.970 58.7-133.8-140.6 123.4 131.6 97.6 72.1 825 494 B I - 0 0 131 -2,-0.4 2,-0.2 -187,-0.1 -2,-0.0 -0.448 32.6-151.4 -71.4 72.6 130.9 94.6 69.9 826 495 B W - 0 0 124 -2,-2.4 -186,-0.1 -5,-0.1 -187,-0.1 -0.297 12.9-139.8 -53.0 113.1 128.5 96.5 67.6 827 496 B Q 0 0 61 -2,-0.2 -1,-0.1 0, 0.0 -3,-0.0 0.213 360.0 360.0 -63.1-172.3 126.0 93.9 66.3 828 497 B N 0 0 154 0, 0.0 -2,-0.0 0, 0.0 0, 0.0 0.950 360.0 360.0 -57.9 360.0 124.6 93.7 62.7