==== 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 16-FEB-04 1VAF . COMPND 2 MOLECULE: NITRIC OXIDE SYNTHASE, INDUCIBLE; . SOURCE 2 ORGANISM_SCIENTIFIC: MUS MUSCULUS; . AUTHOR R.FEDOROV,R.VASAN,D.K.GHOSH,I.SCHLICHTING . 838 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 39558.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 545 65.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 22 2.6 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 78 9.3 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 . 1 0.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 5 0.6 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 . 70 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 99 11.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 222 26.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 17 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 2 2 2 0 0 2 0 0 0 2 0 0 3 0 3 4 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 3 2 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 . 7 6 9 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 ANTIPARALLEL BRIDGES PER LADDER . 8 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 77 A Q 0 0 199 0, 0.0 19,-0.1 0, 0.0 2,-0.0 0.000 360.0 360.0 360.0-134.5 -27.0 135.1 66.0 2 78 A Y - 0 0 85 17,-0.0 2,-0.5 1,-0.0 15,-0.2 -0.223 360.0-120.7 -82.5 172.4 -30.3 136.9 65.3 3 79 A V E -A 16 0A 55 13,-1.3 13,-3.0 -2,-0.0 2,-0.1 -0.970 28.3-127.4-116.7 117.7 -31.1 139.9 63.1 4 80 A R E -A 15 0A 140 -2,-0.5 2,-0.4 11,-0.2 11,-0.2 -0.427 31.1-177.9 -65.9 133.4 -32.6 142.9 65.0 5 81 A I E -A 14 0A 3 9,-3.2 9,-3.6 -2,-0.1 2,-0.4 -0.999 4.0-164.2-137.0 130.6 -35.9 144.1 63.3 6 82 A K E -A 13 0A 47 -2,-0.4 391,-1.4 7,-0.3 2,-0.6 -0.915 21.2-142.6-126.4 150.1 -38.0 147.0 64.4 7 83 A N B > -B 396 0B 13 5,-2.5 4,-1.8 -2,-0.4 389,-0.2 -0.915 15.3-159.1-100.9 119.7 -41.5 148.5 63.9 8 84 A W T 4 S+ 0 0 166 387,-2.5 388,-0.1 -2,-0.6 -1,-0.1 0.678 87.4 55.1 -75.4 -18.1 -41.2 152.3 63.9 9 85 A G T 4 S+ 0 0 62 386,-0.6 -1,-0.2 383,-0.2 387,-0.1 0.805 125.5 20.7 -83.7 -30.1 -44.8 152.9 64.7 10 86 A S T 4 S- 0 0 80 385,-0.2 -2,-0.2 2,-0.2 3,-0.1 0.478 93.0-135.4-113.2 -10.9 -44.9 150.8 67.9 11 87 A G < + 0 0 41 -4,-1.8 -3,-0.1 1,-0.3 2,-0.0 0.299 53.7 147.6 73.3 -13.3 -41.1 150.8 68.6 12 88 A E - 0 0 69 -6,-0.1 -5,-2.5 1,-0.1 2,-0.3 -0.332 34.9-151.7 -58.8 130.4 -41.4 147.1 69.3 13 89 A I E -A 6 0A 65 -7,-0.2 2,-0.3 -3,-0.1 -7,-0.3 -0.768 12.0-170.1-106.6 151.7 -38.2 145.3 68.3 14 90 A L E -A 5 0A 24 -9,-3.6 -9,-3.2 -2,-0.3 2,-0.5 -0.876 18.1-133.4-134.7 166.1 -37.8 141.6 67.1 15 91 A H E -A 4 0A 74 -2,-0.3 2,-0.7 -11,-0.2 -11,-0.2 -0.975 15.9-150.5-125.9 116.6 -34.9 139.2 66.4 16 92 A D E +A 3 0A 0 -13,-3.0 -13,-1.3 -2,-0.5 358,-0.2 -0.783 33.8 149.6 -94.6 115.8 -35.0 137.2 63.3 17 93 A T > + 0 0 56 356,-2.8 3,-2.3 -2,-0.7 357,-0.2 0.694 57.7 78.4-109.1 -33.9 -33.3 133.8 63.6 18 94 A L G > S+ 0 0 4 355,-3.1 3,-2.5 1,-0.3 356,-0.2 0.763 76.8 74.9 -50.0 -31.2 -35.3 131.7 61.2 19 95 A H G > S+ 0 0 44 1,-0.3 3,-2.6 354,-0.3 -1,-0.3 0.800 76.8 79.3 -55.7 -26.9 -33.5 133.2 58.2 20 96 A H G < S+ 0 0 107 -3,-2.3 -1,-0.3 1,-0.3 -2,-0.2 0.738 87.2 58.4 -52.1 -23.9 -30.5 131.0 59.2 21 97 A K G < S+ 0 0 151 -3,-2.5 -1,-0.3 -4,-0.2 -2,-0.2 0.188 77.3 135.2 -94.5 17.4 -32.4 128.2 57.5 22 98 A A < - 0 0 38 -3,-2.6 381,-0.2 1,-0.1 3,-0.0 -0.399 49.3-139.3 -69.7 144.0 -32.6 129.8 54.1 23 99 A T - 0 0 83 379,-1.9 -1,-0.1 -2,-0.1 380,-0.1 0.944 61.7 -14.8 -64.5 -99.4 -31.7 127.7 51.1 24 100 A S S S- 0 0 101 1,-0.2 378,-0.3 378,-0.1 2,-0.1 -0.186 92.0 -53.9 -99.6-169.2 -29.7 129.4 48.4 25 101 A D - 0 0 150 1,-0.1 -1,-0.2 -2,-0.1 4,-0.1 -0.460 55.8-142.0 -68.1 140.7 -28.7 133.0 47.6 26 102 A F - 0 0 55 2,-0.2 -1,-0.1 -2,-0.1 375,-0.1 0.024 40.4 -72.5 -86.5-161.0 -31.7 135.3 47.3 27 103 A T S S+ 0 0 20 10,-0.1 2,-0.3 13,-0.1 14,-0.1 0.669 102.5 91.1 -71.2 -20.6 -32.1 138.1 44.7 28 104 A C - 0 0 61 5,-0.1 -2,-0.2 7,-0.1 5,-0.2 -0.656 62.2-144.7 -96.8 140.9 -29.6 140.4 46.4 29 105 A K - 0 0 130 3,-1.6 3,-0.5 -2,-0.3 -2,-0.0 -0.491 31.7-110.0 -88.5 155.1 -25.9 140.9 46.0 30 106 A S S S+ 0 0 129 1,-0.2 -1,-0.1 -2,-0.2 3,-0.0 0.887 120.1 26.0 -53.2 -41.7 -23.4 141.8 48.8 31 107 A K S S+ 0 0 193 1,-0.1 2,-0.3 2,-0.0 -1,-0.2 0.334 123.7 49.0-107.2 4.7 -23.0 145.3 47.4 32 108 A S - 0 0 67 -3,-0.5 -3,-1.6 2,-0.0 2,-0.6 -0.999 66.6-140.7-146.1 144.1 -26.3 145.8 45.5 33 109 A C + 0 0 103 -2,-0.3 3,-0.2 -5,-0.2 -5,-0.1 -0.911 19.0 172.5-112.0 116.0 -30.0 145.4 46.4 34 110 A L > + 0 0 41 -2,-0.6 3,-1.6 1,-0.2 -1,-0.1 -0.197 34.0 132.4-109.7 39.5 -32.5 144.0 43.8 35 111 A G T 3 + 0 0 27 1,-0.3 -1,-0.2 -8,-0.0 345,-0.2 0.615 67.7 57.9 -66.7 -14.3 -35.4 143.7 46.2 36 112 A S T 3 S+ 0 0 87 -3,-0.2 2,-0.5 344,-0.0 -1,-0.3 0.340 75.3 115.1 -98.5 5.9 -37.8 145.4 43.8 37 113 A I < - 0 0 76 -3,-1.6 -10,-0.1 1,-0.2 -3,-0.0 -0.675 52.8-159.0 -78.2 123.4 -37.2 142.8 41.0 38 114 A M S S+ 0 0 93 -2,-0.5 -1,-0.2 1,-0.2 -3,-0.0 0.970 78.8 28.9 -67.0 -61.8 -40.5 141.0 40.5 39 115 A N S S+ 0 0 114 3,-0.0 -1,-0.2 5,-0.0 2,-0.1 -0.581 79.7 171.4-106.1 69.5 -39.6 137.8 38.8 40 116 A P > - 0 0 7 0, 0.0 3,-1.7 0, 0.0 4,-0.2 -0.438 43.3-123.0 -77.2 152.0 -36.1 137.0 40.0 41 117 A K G > S+ 0 0 197 1,-0.3 3,-1.2 2,-0.2 368,-0.0 0.755 111.2 68.1 -65.0 -21.6 -34.4 133.6 39.3 42 118 A S G 3 S+ 0 0 28 1,-0.3 -1,-0.3 3,-0.0 -18,-0.1 0.730 104.7 42.8 -69.5 -18.9 -34.1 133.2 43.0 43 119 A L G < S+ 0 0 6 -3,-1.7 366,-1.9 365,-0.1 2,-0.3 0.311 104.8 82.8-107.9 8.1 -37.8 132.9 43.2 44 120 A T B < -c 409 0C 39 -3,-1.2 2,-0.4 364,-0.2 366,-0.2 -0.874 50.7-168.0-118.7 147.8 -38.2 130.7 40.1 45 121 A R - 0 0 67 364,-2.5 366,-0.2 -2,-0.3 3,-0.1 -0.853 25.3-172.0-133.6 96.3 -37.9 126.9 39.6 46 122 A G - 0 0 24 -2,-0.4 362,-0.0 1,-0.2 364,-0.0 0.134 33.5 -35.4 -80.8-167.3 -37.9 126.0 35.9 47 123 A P - 0 0 67 0, 0.0 2,-0.2 0, 0.0 -1,-0.2 -0.146 49.4-152.0 -52.1 134.0 -37.9 122.9 33.6 48 124 A R - 0 0 70 123,-0.2 122,-0.1 -3,-0.1 121,-0.1 -0.659 8.4-169.4-102.2 163.0 -36.2 119.7 34.8 49 125 A D + 0 0 90 1,-0.3 -1,-0.1 -2,-0.2 121,-0.1 0.604 65.6 15.5-128.2 -26.1 -34.8 117.3 32.2 50 126 A K S S- 0 0 143 1,-0.2 -1,-0.3 121,-0.1 119,-0.0 -0.797 99.8 -67.3-139.5 178.4 -33.9 114.1 34.0 51 127 A P - 0 0 87 0, 0.0 -1,-0.2 0, 0.0 119,-0.1 -0.238 62.5 -98.7 -65.2 167.1 -34.6 112.7 37.4 52 128 A T - 0 0 24 117,-0.3 5,-0.1 43,-0.2 119,-0.0 -0.780 50.3 -90.2 -91.6 134.3 -33.1 114.7 40.2 53 129 A P >> - 0 0 45 0, 0.0 4,-2.0 0, 0.0 3,-0.9 -0.077 25.2-137.5 -41.7 125.7 -29.8 113.2 41.6 54 130 A L H 3> S+ 0 0 80 1,-0.3 4,-2.2 2,-0.2 -2,-0.0 0.828 102.8 67.2 -56.9 -32.4 -30.4 110.8 44.4 55 131 A E H 34 S+ 0 0 145 1,-0.2 -1,-0.3 2,-0.2 -3,-0.0 0.909 113.2 29.3 -56.3 -42.0 -27.4 112.4 46.1 56 132 A E H <> S+ 0 0 89 -3,-0.9 4,-1.4 2,-0.1 -2,-0.2 0.682 115.6 59.8 -93.3 -17.9 -29.4 115.6 46.5 57 133 A L H X S+ 0 0 6 -4,-2.0 4,-2.9 2,-0.2 -3,-0.2 0.946 103.2 50.9 -73.7 -47.9 -32.9 114.1 46.8 58 134 A L H X S+ 0 0 58 -4,-2.2 4,-2.4 2,-0.2 5,-0.2 0.872 108.5 51.4 -58.1 -41.9 -32.2 112.0 49.8 59 135 A P H > S+ 0 0 66 0, 0.0 4,-1.9 0, 0.0 -1,-0.2 0.962 114.0 43.5 -61.0 -51.4 -30.7 114.9 51.8 60 136 A H H X S+ 0 0 92 -4,-1.4 4,-2.2 1,-0.2 219,-0.2 0.920 111.8 55.2 -59.5 -44.6 -33.7 117.1 51.1 61 137 A A H X S+ 0 0 0 -4,-2.9 4,-2.5 1,-0.2 5,-0.2 0.924 108.0 46.6 -53.8 -52.7 -36.1 114.2 51.8 62 138 A I H X S+ 0 0 47 -4,-2.4 4,-2.6 1,-0.2 -1,-0.2 0.883 109.4 58.6 -57.6 -39.3 -34.7 113.5 55.3 63 139 A E H X S+ 0 0 128 -4,-1.9 4,-2.0 -5,-0.2 -2,-0.2 0.941 110.5 39.1 -54.7 -55.7 -34.9 117.3 55.9 64 140 A F H X S+ 0 0 4 -4,-2.2 4,-3.2 2,-0.2 -2,-0.2 0.954 113.3 54.0 -60.4 -56.7 -38.6 117.5 55.3 65 141 A I H X S+ 0 0 0 -4,-2.5 4,-2.5 1,-0.3 5,-0.3 0.916 111.4 46.9 -44.5 -52.0 -39.5 114.2 57.1 66 142 A N H X S+ 0 0 55 -4,-2.6 4,-1.4 1,-0.2 -1,-0.3 0.900 112.7 50.0 -58.9 -42.2 -37.6 115.5 60.1 67 143 A Q H X S+ 0 0 56 -4,-2.0 4,-0.8 -5,-0.2 -2,-0.2 0.868 110.4 50.9 -63.8 -40.0 -39.4 118.8 59.8 68 144 A Y H >X S+ 0 0 13 -4,-3.2 3,-1.7 2,-0.2 4,-0.6 0.972 112.0 43.2 -61.8 -59.6 -42.8 117.1 59.5 69 145 A Y H >< S+ 0 0 15 -4,-2.5 3,-0.7 1,-0.3 -1,-0.2 0.795 109.4 61.4 -60.1 -24.5 -42.5 114.9 62.6 70 146 A G H 3< S+ 0 0 59 -4,-1.4 -1,-0.3 -5,-0.3 -2,-0.2 0.763 90.4 67.6 -72.3 -24.0 -41.1 118.0 64.3 71 147 A S H << S+ 0 0 61 -3,-1.7 -1,-0.2 -4,-0.8 -2,-0.2 0.803 83.9 103.7 -63.7 -28.8 -44.4 119.8 63.7 72 148 A F S << S- 0 0 49 -3,-0.7 2,-0.6 -4,-0.6 3,-0.3 -0.196 76.0-128.1 -60.6 140.6 -45.9 117.3 66.2 73 149 A K S S+ 0 0 158 1,-0.3 -1,-0.1 2,-0.0 -2,-0.1 -0.826 98.6 2.4 -86.5 124.9 -46.8 118.1 69.7 74 150 A E S S- 0 0 150 -2,-0.6 -1,-0.3 -4,-0.1 -4,-0.0 0.945 103.1-120.2 53.4 96.2 -45.1 115.3 71.6 75 151 A A - 0 0 59 -3,-0.3 2,-0.3 1,-0.1 3,-0.1 0.087 3.9-129.1 -62.1 170.3 -43.3 113.4 68.9 76 152 A K > + 0 0 64 -7,-0.2 4,-3.9 1,-0.2 5,-0.2 -0.674 25.7 178.9-122.2 70.0 -43.5 109.8 67.7 77 153 A I H > S+ 0 0 103 -2,-0.3 4,-2.7 1,-0.2 5,-0.3 0.843 83.5 50.3 -39.5 -48.4 -39.8 108.8 67.7 78 154 A E H > S+ 0 0 118 2,-0.2 4,-2.8 1,-0.2 -1,-0.2 0.986 114.6 41.5 -55.1 -64.5 -40.8 105.3 66.5 79 155 A E H > S+ 0 0 87 1,-0.2 4,-2.8 2,-0.2 5,-0.3 0.910 113.4 55.0 -51.2 -47.9 -42.9 106.6 63.7 80 156 A H H X S+ 0 0 38 -4,-3.9 4,-2.1 1,-0.2 -1,-0.2 0.932 112.5 40.6 -53.5 -51.8 -40.3 109.2 62.8 81 157 A L H X S+ 0 0 98 -4,-2.7 4,-2.4 -5,-0.2 5,-0.2 0.874 112.9 57.4 -65.3 -37.3 -37.5 106.7 62.4 82 158 A A H X S+ 0 0 56 -4,-2.8 4,-3.4 -5,-0.3 -2,-0.2 0.943 110.5 40.7 -58.7 -52.8 -39.8 104.3 60.7 83 159 A R H X S+ 0 0 34 -4,-2.8 4,-2.9 2,-0.2 5,-0.3 0.871 111.1 59.1 -65.0 -36.7 -40.7 106.7 57.9 84 160 A L H X S+ 0 0 27 -4,-2.1 4,-1.3 -5,-0.3 -1,-0.2 0.908 114.4 36.7 -57.6 -43.8 -37.1 107.9 57.7 85 161 A E H X S+ 0 0 119 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.937 115.0 55.9 -72.7 -48.1 -36.1 104.4 56.9 86 162 A A H X S+ 0 0 47 -4,-3.4 4,-1.6 1,-0.2 -2,-0.2 0.825 109.2 46.4 -53.3 -38.1 -39.2 103.7 54.8 87 163 A V H X S+ 0 0 0 -4,-2.9 4,-2.4 2,-0.2 -1,-0.2 0.878 108.1 54.7 -75.1 -39.5 -38.5 106.7 52.6 88 164 A T H X S+ 0 0 35 -4,-1.3 4,-3.2 -5,-0.3 -2,-0.2 0.916 107.9 50.1 -60.7 -44.2 -34.8 106.0 52.0 89 165 A K H X S+ 0 0 96 -4,-2.1 4,-4.2 1,-0.2 5,-0.3 0.979 110.6 49.8 -54.9 -59.0 -35.7 102.5 50.8 90 166 A E H X>S+ 0 0 50 -4,-1.6 4,-4.0 1,-0.2 5,-0.9 0.863 113.3 45.6 -47.7 -46.8 -38.3 103.8 48.4 91 167 A I H X5S+ 0 0 5 -4,-2.4 4,-1.6 3,-0.2 -1,-0.2 0.955 115.8 46.7 -64.6 -49.3 -35.8 106.4 47.0 92 168 A E H <5S+ 0 0 140 -4,-3.2 -2,-0.2 -5,-0.2 -1,-0.2 0.949 123.4 34.5 -54.9 -52.9 -33.1 103.7 46.8 93 169 A T H <5S+ 0 0 103 -4,-4.2 -2,-0.2 -5,-0.2 -3,-0.2 0.885 133.7 22.0 -73.2 -43.9 -35.5 101.3 45.1 94 170 A T H <5S- 0 0 89 -4,-4.0 -3,-0.2 -5,-0.3 -2,-0.2 0.762 97.2-116.8 -99.6 -29.9 -37.7 103.5 43.0 95 171 A G S <> - 0 0 54 -2,-0.3 4,-1.9 1,-0.2 3,-1.4 -0.502 37.1-109.7 -66.4 139.2 -48.3 110.4 52.9 101 177 A L H 3> S+ 0 0 83 1,-0.3 4,-1.4 2,-0.2 -1,-0.2 0.785 121.9 53.3 -41.6 -31.6 -51.5 112.5 52.2 102 178 A D H 3> S+ 0 0 90 2,-0.2 4,-2.0 1,-0.2 -1,-0.3 0.885 104.5 51.4 -73.7 -39.6 -50.9 114.0 55.6 103 179 A E H <> S+ 0 0 0 -3,-1.4 4,-2.0 1,-0.2 -2,-0.2 0.789 109.5 53.5 -66.4 -27.6 -47.3 115.0 54.9 104 180 A L H X S+ 0 0 0 -4,-1.9 4,-2.2 2,-0.2 -1,-0.2 0.861 105.4 51.3 -76.0 -34.7 -48.7 116.7 51.8 105 181 A I H X S+ 0 0 41 -4,-1.4 4,-1.5 -5,-0.3 -2,-0.2 0.915 113.1 46.7 -65.5 -40.3 -51.3 118.7 53.7 106 182 A F H X S+ 0 0 31 -4,-2.0 4,-2.1 1,-0.2 5,-0.2 0.896 110.7 53.1 -65.3 -41.9 -48.4 119.8 56.0 107 183 A A H X S+ 0 0 0 -4,-2.0 4,-2.1 1,-0.2 -2,-0.2 0.877 108.2 49.9 -63.7 -37.4 -46.3 120.6 52.9 108 184 A T H X S+ 0 0 0 -4,-2.2 4,-0.8 1,-0.2 -1,-0.2 0.800 112.6 45.0 -74.5 -29.9 -49.1 122.8 51.4 109 185 A K H X S+ 0 0 46 -4,-1.5 4,-3.0 2,-0.2 -1,-0.2 0.821 114.1 48.9 -82.3 -32.5 -49.7 124.9 54.5 110 186 A M H X S+ 0 0 8 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.929 108.2 53.3 -70.8 -44.4 -46.0 125.4 55.2 111 187 A A H < S+ 0 0 0 -4,-2.1 296,-0.5 -5,-0.2 -1,-0.2 0.852 114.3 44.4 -57.5 -33.1 -45.2 126.4 51.6 112 188 A W H >< S+ 0 0 36 -4,-0.8 3,-2.8 2,-0.2 -2,-0.2 0.958 110.0 53.0 -73.4 -54.3 -48.0 128.9 52.1 113 189 A R H 3< S+ 0 0 31 -4,-3.0 -2,-0.2 1,-0.3 -1,-0.2 0.729 110.8 50.3 -52.7 -24.7 -46.8 130.0 55.5 114 190 A N T 3< S+ 0 0 1 -4,-1.9 289,-0.4 -5,-0.1 -1,-0.3 0.309 78.2 115.7 -98.4 4.3 -43.4 130.5 53.9 115 191 A A X - 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0 0 44 -5,-1.0 2,-4.8 -4,-0.0 -1,-0.2 -0.797 57.8 -96.9-112.2 152.9 -63.0 166.0 39.0 320 396 A E > + 0 0 127 -2,-0.3 3,-2.6 1,-0.2 6,-0.3 -0.195 52.1 174.0 -61.2 56.3 -60.1 168.3 37.9 321 397 A T T 3 S+ 0 0 16 -2,-4.8 -1,-0.2 1,-0.3 3,-0.1 0.418 71.4 51.8 -50.3 -1.3 -58.9 165.4 35.7 322 398 A H T 3 S+ 0 0 165 1,-0.1 2,-0.3 -3,-0.0 -1,-0.3 0.121 93.3 76.9-124.1 19.8 -56.2 167.6 34.1 323 399 A T X - 0 0 60 -3,-2.6 3,-3.6 1,-0.1 5,-0.4 -0.690 56.2-174.1-133.1 77.7 -54.7 168.9 37.3 324 400 A L G > S+ 0 0 129 -2,-0.3 3,-1.4 1,-0.3 5,-0.2 0.801 84.5 62.5 -38.5 -38.4 -52.5 166.2 38.8 325 401 A A G 3 S+ 0 0 90 1,-0.3 -1,-0.3 2,-0.1 -2,-0.0 0.700 84.6 74.6 -67.5 -19.3 -52.0 168.4 41.8 326 402 A S G < S- 0 0 29 -3,-3.6 -1,-0.3 -6,-0.3 -2,-0.2 0.688 100.3-130.1 -67.6 -17.3 -55.7 168.3 42.7 327 403 A L <> + 0 0 98 -3,-1.4 4,-1.1 -4,-0.4 -2,-0.1 0.807 56.0 148.9 71.0 32.5 -55.3 164.8 44.0 328 404 A W H > + 0 0 19 -5,-0.4 4,-3.0 1,-0.2 5,-0.1 0.838 67.2 57.4 -67.1 -31.1 -58.2 163.6 41.9 329 405 A K H > S+ 0 0 91 1,-0.2 4,-1.5 2,-0.2 5,-0.4 0.911 103.3 53.3 -64.4 -40.2 -56.7 160.1 41.5 330 406 A D H > S+ 0 0 100 1,-0.2 4,-0.6 2,-0.2 -1,-0.2 0.826 112.8 46.7 -60.2 -31.6 -56.5 159.8 45.3 331 407 A R H X S+ 0 0 147 -4,-1.1 4,-1.6 2,-0.1 -2,-0.2 0.909 115.5 44.4 -75.0 -48.5 -60.2 160.6 45.2 332 408 A A H >X S+ 0 0 0 -4,-3.0 4,-2.4 2,-0.2 3,-1.0 0.997 108.3 50.7 -60.2 -77.2 -61.1 158.2 42.4 333 409 A V H 3X S+ 0 0 19 -4,-1.5 4,-1.5 1,-0.3 -1,-0.2 0.752 110.7 54.8 -36.2 -34.6 -59.3 155.0 43.3 334 410 A T H 3X S+ 0 0 73 -4,-0.6 4,-1.5 -5,-0.4 3,-0.3 0.952 107.0 45.5 -71.0 -48.4 -60.8 155.3 46.8 335 411 A E H S+ 0 0 0 -4,-0.8 5,-2.7 -5,-0.2 -2,-0.2 0.909 114.6 43.0 -86.3 -49.3 -68.9 142.0 47.1 345 421 A Q H ><5S+ 0 0 102 -4,-1.8 3,-0.8 3,-0.3 -2,-0.2 0.871 110.3 57.7 -63.7 -38.1 -70.6 142.2 50.5 346 422 A K H 3<5S+ 0 0 120 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.943 114.8 37.0 -55.6 -51.9 -73.9 143.1 48.9 347 423 A Q T 3<5S- 0 0 70 -4,-0.8 -1,-0.3 -5,-0.2 -2,-0.2 0.356 118.5-120.7 -82.1 2.5 -73.9 139.9 46.8 348 424 A N T < 5 + 0 0 130 -3,-0.8 2,-0.4 1,-0.2 -3,-0.3 0.699 58.8 148.5 64.7 29.5 -72.3 138.2 49.8 349 425 A V < - 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0 0 4 -5,-2.9 -1,-0.2 -6,-0.2 -192,-0.2 -0.904 55.8-106.0-103.9 120.9 -57.7 148.0 -18.9 770 426 B T + 0 0 41 -194,-2.4 -59,-0.6 -2,-0.6 2,-0.3 -0.119 55.8 154.4 -44.4 126.2 -57.4 145.2 -21.5 771 427 B I E -e 711 0U 32 -61,-0.1 2,-0.4 -193,-0.0 -59,-0.2 -0.988 28.7-149.5-155.0 160.9 -60.3 142.8 -21.3 772 428 B M E -e 712 0U 42 -61,-1.4 -59,-2.5 -2,-0.3 2,-0.1 -0.998 15.0-130.9-140.6 135.5 -62.3 140.4 -23.4 773 429 B D > - 0 0 39 -2,-0.4 4,-3.0 -61,-0.2 5,-0.2 -0.381 27.7-114.5 -79.6 160.7 -65.9 139.2 -23.5 774 430 B H H > S+ 0 0 14 2,-0.2 4,-2.5 1,-0.2 5,-0.1 0.762 112.8 54.4 -68.6 -27.2 -66.9 135.6 -23.5 775 431 B H H > S+ 0 0 70 2,-0.2 4,-2.4 3,-0.2 -1,-0.2 0.945 115.5 39.3 -71.6 -45.7 -68.5 135.7 -27.0 776 432 B T H > S+ 0 0 61 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.940 118.0 48.6 -66.5 -47.1 -65.4 137.1 -28.5 777 433 B A H X S+ 0 0 2 -4,-3.0 4,-2.2 1,-0.2 -2,-0.2 0.954 112.8 49.9 -55.2 -50.6 -63.1 134.9 -26.4 778 434 B S H X S+ 0 0 0 -4,-2.5 4,-1.6 1,-0.2 -1,-0.2 0.878 110.5 48.7 -55.7 -44.8 -65.3 131.9 -27.4 779 435 B E H X S+ 0 0 131 -4,-2.4 4,-1.7 1,-0.2 -1,-0.2 0.868 108.1 54.5 -66.8 -37.3 -65.1 132.8 -31.0 780 436 B S H X S+ 0 0 30 -4,-2.5 4,-2.7 2,-0.2 -2,-0.2 0.954 104.0 54.8 -61.6 -50.3 -61.3 133.2 -31.0 781 437 B F H X S+ 0 0 0 -4,-2.2 4,-3.8 1,-0.2 5,-0.3 0.921 104.7 53.6 -48.4 -53.1 -60.8 129.8 -29.5 782 438 B M H X S+ 0 0 14 -4,-1.6 4,-2.3 1,-0.2 -1,-0.2 0.922 109.1 49.1 -47.0 -51.3 -62.7 128.2 -32.3 783 439 B K H X S+ 0 0 108 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.934 114.3 46.7 -54.2 -48.9 -60.4 129.9 -34.8 784 440 B H H X S+ 0 0 4 -4,-2.7 4,-2.7 1,-0.2 3,-0.4 0.980 109.4 52.1 -55.6 -61.9 -57.5 128.7 -32.7 785 441 B M H X S+ 0 0 0 -4,-3.8 4,-1.8 1,-0.3 -1,-0.2 0.798 108.6 52.8 -45.9 -36.7 -58.9 125.1 -32.5 786 442 B Q H X S+ 0 0 66 -4,-2.3 4,-2.1 -5,-0.3 -1,-0.3 0.949 110.3 46.3 -65.8 -48.4 -59.3 125.1 -36.3 787 443 B N H X S+ 0 0 46 -4,-2.0 4,-4.5 -3,-0.4 -2,-0.2 0.887 110.4 55.3 -60.0 -41.7 -55.6 126.2 -36.8 788 444 B E H X S+ 0 0 5 -4,-2.7 4,-2.6 2,-0.2 6,-0.8 0.876 107.4 46.7 -62.8 -40.1 -54.5 123.6 -34.3 789 445 B Y H X S+ 0 0 18 -4,-1.8 4,-1.7 4,-0.3 -1,-0.2 0.916 119.2 42.0 -69.1 -37.8 -56.1 120.7 -36.1 790 446 B R H < S+ 0 0 171 -4,-2.1 3,-0.2 2,-0.2 -2,-0.2 0.970 119.0 45.2 -69.8 -52.3 -54.7 121.9 -39.4 791 447 B A H < S- 0 0 70 -4,-4.5 -3,-0.2 1,-0.2 -2,-0.2 0.972 141.0 -2.2 -55.7 -63.4 -51.3 122.7 -37.8 792 448 B R H < S- 0 0 51 -4,-2.6 -1,-0.2 2,-0.3 -2,-0.2 -0.111 95.5-106.9-127.8 41.9 -50.9 119.5 -35.8 793 449 B G S < S+ 0 0 18 -4,-1.7 -356,-3.0 -3,-0.2 -355,-1.9 0.807 89.2 33.5 40.2 49.1 -54.0 117.4 -36.3 794 450 B G - 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