==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=27-SEP-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE/OXIDOREDUCTASE INHIBITOR 14-APR-13 4K5H . COMPND 2 MOLECULE: NITRIC OXIDE SYNTHASE, ENDOTHELIAL; . SOURCE 2 ORGANISM_SCIENTIFIC: BOS TAURUS; . AUTHOR G.CHREIFI,H.LI,T.L.POULOS . 808 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 34419.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 529 65.5 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 . 82 10.1 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 . 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 . 61 7.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 83 10.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 226 28.0 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 5 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 . 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 . 8 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 0 104 0, 0.0 2,-0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 -55.4 9.0 -20.0 53.2 2 68 A P - 0 0 54 0, 0.0 2,-1.0 0, 0.0 4,-0.1 -0.262 360.0-143.1 -65.1 135.0 10.2 -18.1 50.1 3 69 A K S S+ 0 0 165 2,-0.1 14,-0.0 14,-0.1 3,-0.0 -0.313 72.7 89.5 -92.1 52.3 13.7 -16.5 50.3 4 70 A F S S- 0 0 77 -2,-1.0 15,-0.1 17,-0.0 0, 0.0 -0.944 96.0 -73.1-143.1 152.6 12.7 -13.5 48.3 5 71 A P - 0 0 11 0, 0.0 13,-2.3 0, 0.0 2,-0.4 -0.279 46.2-134.6 -56.9 130.8 11.3 -10.2 49.5 6 72 A R E -A 17 0A 92 11,-0.2 2,-0.5 -4,-0.1 11,-0.3 -0.775 20.8-159.1 -82.6 132.1 7.7 -10.6 50.6 7 73 A V E -A 16 0A 11 9,-3.4 9,-2.4 -2,-0.4 2,-0.4 -0.946 6.7-165.0-123.3 122.4 5.6 -7.7 49.3 8 74 A K E -A 15 0A 58 -2,-0.5 381,-2.5 7,-0.2 2,-0.6 -0.838 18.0-151.0-116.6 143.3 2.2 -6.8 50.8 9 75 A N B > -B 388 0B 0 5,-2.5 4,-1.6 -2,-0.4 5,-0.4 -0.967 11.8-162.9-105.1 119.4 -0.7 -4.6 49.7 10 76 A W T 4 S+ 0 0 81 377,-3.3 378,-0.1 -2,-0.6 -1,-0.1 0.689 84.4 55.4 -84.4 -18.3 -2.3 -3.2 52.8 11 77 A E T 4 S+ 0 0 57 376,-0.4 -1,-0.2 373,-0.2 377,-0.1 0.899 123.5 24.5 -74.3 -40.6 -5.6 -2.3 51.2 12 78 A L T 4 S- 0 0 121 375,-0.2 -2,-0.2 2,-0.1 -1,-0.1 0.586 97.1-128.5-102.7 -13.9 -6.3 -5.8 49.9 13 79 A G < + 0 0 48 -4,-1.6 -3,-0.2 1,-0.2 2,-0.2 0.569 57.7 145.8 73.8 11.1 -4.3 -7.9 52.3 14 80 A S - 0 0 58 -5,-0.4 -5,-2.5 -6,-0.0 2,-0.4 -0.497 34.1-152.5 -86.8 154.0 -2.5 -9.7 49.4 15 81 A I E +A 8 0A 63 -7,-0.2 2,-0.3 -2,-0.2 -7,-0.2 -0.952 15.7 171.0-125.1 135.7 1.1 -11.0 49.4 16 82 A T E -A 7 0A 48 -9,-2.4 -9,-3.4 -2,-0.4 2,-0.4 -0.876 23.3-136.8-131.6 169.3 3.6 -11.6 46.6 17 83 A Y E -A 6 0A 52 -2,-0.3 2,-0.7 -11,-0.3 -11,-0.2 -0.996 17.4-133.4-125.4 134.9 7.3 -12.4 46.6 18 84 A D + 0 0 5 -13,-2.3 348,-0.2 -2,-0.4 347,-0.1 -0.804 33.9 161.5 -97.1 116.7 9.7 -10.7 44.2 19 85 A T > + 0 0 58 346,-2.2 3,-1.3 -2,-0.7 347,-0.2 0.531 65.8 76.3-103.8 -16.3 12.0 -13.1 42.4 20 86 A L G > S+ 0 0 12 345,-1.2 3,-2.9 1,-0.3 4,-0.2 0.821 78.7 71.9 -65.3 -33.8 12.9 -10.8 39.7 21 87 A C G > S+ 0 0 5 1,-0.3 3,-1.5 344,-0.3 -1,-0.3 0.683 82.7 71.5 -59.7 -18.9 15.3 -8.8 41.9 22 88 A A G < S+ 0 0 43 -3,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.587 88.9 62.6 -74.8 -11.1 17.7 -11.7 41.8 23 89 A Q G < S+ 0 0 122 -3,-2.9 -1,-0.3 -4,-0.1 2,-0.2 0.485 74.7 117.1 -87.5 -6.3 18.4 -10.7 38.2 24 90 A S < - 0 0 1 -3,-1.5 371,-0.2 -4,-0.2 3,-0.1 -0.461 42.3-175.5 -59.5 125.2 19.8 -7.3 39.5 25 91 A Q + 0 0 150 369,-0.5 2,-0.3 -2,-0.2 -1,-0.1 0.379 62.4 60.0 -99.8 5.3 23.5 -7.2 38.4 26 92 A Q S S- 0 0 94 368,-0.5 368,-0.6 412,-0.2 -1,-0.1 -0.994 77.4-117.7-155.7 126.3 24.1 -4.0 40.2 27 93 A D - 0 0 110 -2,-0.3 411,-0.2 366,-0.1 366,-0.1 -0.329 19.0-155.7 -67.3 133.7 24.0 -2.3 43.7 28 94 A G - 0 0 33 409,-3.7 -1,-0.1 408,-0.2 411,-0.1 -0.140 42.9 -86.2 -81.5-164.2 21.7 0.6 44.6 29 95 A P S S+ 0 0 46 0, 0.0 2,-0.1 0, 0.0 409,-0.1 0.503 91.7 101.1 -84.0 -9.9 22.6 3.0 47.5 30 96 A C + 0 0 4 406,-0.3 5,-0.2 407,-0.2 -2,-0.1 -0.455 42.3 177.7 -85.5 154.0 21.0 1.0 50.5 31 97 A T - 0 0 43 3,-1.9 3,-0.5 405,-0.2 404,-0.3 -0.926 47.8 -97.5-140.1 164.1 22.8 -1.2 53.0 32 98 A P S S+ 0 0 48 0, 0.0 401,-3.8 0, 0.0 403,-0.2 0.747 122.5 52.8 -50.6 -27.3 21.6 -3.2 56.1 33 99 A R S S+ 0 0 140 1,-0.3 766,-0.4 399,-0.2 2,-0.3 0.827 121.1 12.1 -85.8 -33.0 22.7 -0.2 58.3 34 100 A R - 0 0 37 -3,-0.5 -3,-1.9 764,-0.1 2,-0.4 -0.983 63.0-136.4-151.2 134.5 20.8 2.6 56.5 35 101 A C B +C 797 0C 21 762,-2.3 762,-2.0 -2,-0.3 3,-0.1 -0.776 18.5 176.1 -85.5 131.0 18.1 3.0 53.9 36 102 A L > + 0 0 9 -2,-0.4 3,-2.4 760,-0.2 -1,-0.1 0.076 39.3 125.7-122.1 19.4 18.8 5.7 51.3 37 103 A G T 3 + 0 0 19 1,-0.3 335,-0.1 760,-0.1 -1,-0.1 0.694 67.7 57.8 -54.6 -26.3 15.7 5.0 49.2 38 104 A S T 3 S+ 0 0 21 757,-0.5 2,-0.3 -3,-0.1 -1,-0.3 0.441 77.7 109.8 -88.9 -0.6 14.6 8.6 49.4 39 105 A L < - 0 0 10 -3,-2.4 -3,-0.1 1,-0.1 373,-0.1 -0.600 57.3-153.3 -76.4 132.7 17.7 10.1 47.8 40 106 A V S S+ 0 0 31 -2,-0.3 -1,-0.1 1,-0.2 -3,-0.0 0.935 88.4 12.0 -67.5 -45.5 17.0 11.6 44.3 41 107 A L S S+ 0 0 76 360,-0.0 -1,-0.2 0, 0.0 2,-0.2 -0.687 70.7 173.6-135.8 79.1 20.7 11.1 43.1 42 108 A P 0 0 46 0, 0.0 -6,-0.0 0, 0.0 0, 0.0 -0.637 360.0 360.0 -74.9 147.5 22.9 9.0 45.4 43 109 A R 0 0 227 -2,-0.2 0, 0.0 -14,-0.1 0, 0.0 0.762 360.0 360.0 -84.5 360.0 26.4 8.4 43.8 44 ! 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 45 121 A P >> 0 0 129 0, 0.0 4,-2.2 0, 0.0 3,-0.6 0.000 360.0 360.0 360.0 73.5 36.8 -2.4 29.6 46 122 A A H 3> + 0 0 63 1,-0.3 4,-2.4 2,-0.2 5,-0.1 0.687 360.0 35.8 -49.0 -52.1 36.6 -5.6 27.5 47 123 A E H 3> S+ 0 0 152 1,-0.2 4,-1.9 2,-0.2 -1,-0.3 0.873 118.4 53.3 -74.0 -35.0 35.5 -8.5 29.8 48 124 A Q H <> S+ 0 0 99 -3,-0.6 4,-1.5 2,-0.2 -1,-0.2 0.930 112.6 44.2 -56.5 -50.4 33.2 -6.2 31.7 49 125 A L H X S+ 0 0 13 -4,-2.2 4,-2.9 1,-0.2 -2,-0.2 0.917 110.3 56.2 -61.3 -43.5 31.5 -5.1 28.5 50 126 A L H X S+ 0 0 28 -4,-2.4 4,-2.7 -5,-0.2 -1,-0.2 0.870 106.4 48.2 -65.5 -34.6 31.4 -8.7 27.2 51 127 A S H X S+ 0 0 46 -4,-1.9 4,-1.6 2,-0.2 -1,-0.2 0.835 112.1 49.1 -79.8 -29.9 29.4 -10.0 30.2 52 128 A Q H X S+ 0 0 60 -4,-1.5 4,-2.2 2,-0.2 -2,-0.2 0.914 112.6 49.9 -65.1 -42.6 27.0 -7.1 30.0 53 129 A A H X S+ 0 0 0 -4,-2.9 4,-2.8 1,-0.2 -2,-0.2 0.935 109.8 49.4 -63.3 -46.0 26.6 -7.9 26.3 54 130 A R H X S+ 0 0 94 -4,-2.7 4,-2.7 1,-0.2 -1,-0.2 0.876 109.8 51.0 -61.6 -40.6 26.0 -11.6 26.8 55 131 A D H X S+ 0 0 48 -4,-1.6 4,-2.0 2,-0.2 -1,-0.2 0.923 112.0 47.4 -60.9 -47.9 23.4 -11.0 29.4 56 132 A F H X S+ 0 0 2 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.930 111.7 49.5 -60.3 -43.0 21.6 -8.6 27.1 57 133 A I H X S+ 0 0 0 -4,-2.8 4,-2.8 1,-0.3 5,-0.2 0.930 109.9 52.8 -66.0 -41.5 21.8 -11.0 24.1 58 134 A N H X S+ 0 0 61 -4,-2.7 4,-1.9 1,-0.2 -1,-0.3 0.850 107.2 51.6 -54.8 -40.4 20.5 -13.7 26.4 59 135 A Q H X S+ 0 0 46 -4,-2.0 4,-2.2 2,-0.2 -2,-0.2 0.928 110.5 48.5 -62.8 -41.0 17.6 -11.5 27.3 60 136 A Y H X S+ 0 0 32 -4,-2.2 4,-1.0 1,-0.2 -2,-0.2 0.958 112.0 47.7 -68.4 -49.5 16.8 -10.8 23.6 61 137 A Y H <>S+ 0 0 12 -4,-2.8 5,-3.2 1,-0.2 6,-0.4 0.860 112.7 49.6 -59.2 -35.4 16.9 -14.5 22.7 62 138 A S H ><5S+ 0 0 57 -4,-1.9 3,-1.6 1,-0.2 -1,-0.2 0.867 105.6 57.7 -67.7 -37.2 14.6 -15.4 25.7 63 139 A S H 3<5S+ 0 0 53 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.712 112.8 39.0 -69.2 -21.8 12.2 -12.7 24.7 64 140 A I T 3<5S- 0 0 65 -4,-1.0 -1,-0.3 -3,-0.4 -2,-0.2 0.127 114.0-117.7-110.3 18.2 11.8 -14.4 21.3 65 141 A K T < 5S+ 0 0 155 -3,-1.6 -3,-0.2 1,-0.1 -2,-0.1 0.831 84.2 113.6 54.7 42.3 11.9 -17.9 22.8 66 142 A R > < + 0 0 145 -5,-3.2 3,-2.2 -6,-0.1 6,-0.4 -0.030 35.6 150.5-128.0 28.4 15.0 -19.0 20.9 67 143 A S T 3 S+ 0 0 74 -6,-0.4 3,-0.1 1,-0.3 -9,-0.0 -0.454 72.4 14.4 -71.9 123.8 17.2 -19.3 24.0 68 144 A G T 3 S+ 0 0 50 -2,-0.3 -1,-0.3 1,-0.3 5,-0.1 0.225 100.0 133.1 97.4 -10.8 19.9 -22.0 23.4 69 145 A S S <> S- 0 0 34 -3,-2.2 4,-1.9 1,-0.1 -1,-0.3 -0.002 71.8-108.7 -66.5 174.0 19.2 -21.9 19.6 70 146 A Q H > S+ 0 0 142 2,-0.2 4,-2.0 1,-0.2 5,-0.2 0.882 120.0 55.2 -76.8 -36.0 21.8 -21.8 17.0 71 147 A A H > S+ 0 0 56 1,-0.2 4,-1.8 2,-0.2 -1,-0.2 0.863 109.8 51.4 -59.5 -33.9 20.9 -18.2 16.0 72 148 A H H > S+ 0 0 7 -6,-0.4 4,-2.0 2,-0.2 -2,-0.2 0.914 110.5 44.0 -69.1 -47.6 21.5 -17.4 19.7 73 149 A E H X S+ 0 0 99 -4,-1.9 4,-1.7 1,-0.2 -1,-0.2 0.801 113.8 53.4 -70.7 -26.6 24.9 -19.1 20.0 74 150 A E H X S+ 0 0 96 -4,-2.0 4,-2.0 2,-0.2 -2,-0.2 0.861 107.9 49.3 -75.2 -36.7 25.9 -17.5 16.7 75 151 A R H X S+ 0 0 5 -4,-1.8 4,-2.5 2,-0.2 -2,-0.2 0.897 108.6 53.1 -65.7 -41.0 25.0 -14.0 17.9 76 152 A L H X S+ 0 0 20 -4,-2.0 4,-2.3 1,-0.2 -2,-0.2 0.937 112.3 45.1 -57.3 -45.8 27.0 -14.5 21.1 77 153 A Q H X S+ 0 0 123 -4,-1.7 4,-2.5 1,-0.2 -1,-0.2 0.818 110.9 53.1 -67.4 -42.5 30.0 -15.4 19.0 78 154 A E H X S+ 0 0 78 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.916 110.3 48.4 -53.3 -51.1 29.5 -12.5 16.7 79 155 A V H X S+ 0 0 0 -4,-2.5 4,-2.3 2,-0.2 -2,-0.2 0.924 113.4 45.3 -61.0 -48.3 29.4 -10.1 19.6 80 156 A E H X S+ 0 0 66 -4,-2.3 4,-3.2 2,-0.2 -2,-0.2 0.906 112.7 51.6 -65.7 -39.8 32.6 -11.5 21.3 81 157 A A H X S+ 0 0 59 -4,-2.5 4,-2.5 1,-0.2 5,-0.2 0.947 110.7 48.7 -56.6 -50.4 34.4 -11.5 17.9 82 158 A E H X S+ 0 0 49 -4,-2.5 4,-2.7 2,-0.2 6,-0.4 0.899 114.0 44.8 -61.0 -41.5 33.4 -7.9 17.4 83 159 A V H X S+ 0 0 5 -4,-2.3 4,-2.8 3,-0.2 -2,-0.2 0.970 109.8 57.7 -67.9 -48.9 34.5 -6.8 20.9 84 160 A A H < S+ 0 0 86 -4,-3.2 -2,-0.2 1,-0.2 -1,-0.2 0.919 118.2 29.7 -41.8 -56.2 37.7 -8.8 20.5 85 161 A S H < S+ 0 0 100 -4,-2.5 -1,-0.2 -5,-0.1 -2,-0.2 0.827 135.7 23.3 -86.1 -25.6 38.7 -6.9 17.3 86 162 A T H < S- 0 0 75 -4,-2.7 -3,-0.2 2,-0.4 -2,-0.2 0.548 90.0-123.0-118.5 -8.3 37.1 -3.4 17.9 87 163 A G S < S+ 0 0 42 -4,-2.8 2,-0.2 -5,-0.4 -4,-0.2 0.173 91.1 49.1 84.4 -20.7 36.6 -2.9 21.7 88 164 A T - 0 0 20 -6,-0.4 -2,-0.4 -5,-0.1 2,-0.3 -0.733 68.8-150.3-131.1-177.8 32.9 -2.3 21.2 89 165 A Y - 0 0 0 -2,-0.2 2,-0.3 -3,-0.1 -10,-0.1 -0.914 13.4-123.2-144.4 178.8 30.0 -4.0 19.3 90 166 A H - 0 0 91 -2,-0.3 2,-0.3 182,-0.0 -8,-0.1 -0.904 18.1-122.4-129.1 148.2 26.7 -2.9 17.6 91 167 A L - 0 0 8 -2,-0.3 2,-0.1 2,-0.0 179,-0.0 -0.682 21.5-120.8 -91.3 143.1 23.1 -3.9 18.0 92 168 A R > - 0 0 108 -2,-0.3 4,-2.5 1,-0.1 3,-0.5 -0.445 37.1-106.4 -67.8 153.1 20.8 -5.3 15.4 93 169 A E H > S+ 0 0 143 1,-0.2 4,-2.3 2,-0.2 5,-0.2 0.921 121.4 47.6 -48.4 -53.3 17.8 -3.1 14.8 94 170 A S H > S+ 0 0 45 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.821 108.4 57.0 -63.3 -28.5 15.4 -5.5 16.6 95 171 A E H > S+ 0 0 0 -3,-0.5 4,-2.8 2,-0.2 5,-0.2 0.939 107.4 48.0 -65.0 -45.0 17.8 -5.7 19.5 96 172 A L H X S+ 0 0 1 -4,-2.5 4,-3.3 1,-0.2 5,-0.2 0.938 111.1 50.4 -60.1 -47.0 17.7 -1.9 19.9 97 173 A V H X S+ 0 0 44 -4,-2.3 4,-2.1 1,-0.2 -1,-0.2 0.934 114.3 44.2 -55.8 -49.1 13.9 -1.9 19.8 98 174 A F H X S+ 0 0 29 -4,-2.2 4,-2.7 2,-0.2 -1,-0.2 0.918 114.2 50.0 -63.4 -42.1 13.7 -4.6 22.4 99 175 A G H X S+ 0 0 0 -4,-2.8 4,-2.5 1,-0.2 -2,-0.2 0.935 109.1 50.7 -69.4 -42.0 16.3 -3.0 24.6 100 176 A A H X S+ 0 0 0 -4,-3.3 4,-1.7 -5,-0.2 -1,-0.2 0.925 113.1 45.8 -56.5 -47.8 14.7 0.4 24.5 101 177 A K H X S+ 0 0 57 -4,-2.1 4,-2.6 -5,-0.2 -2,-0.2 0.916 111.0 53.1 -63.0 -39.8 11.3 -1.1 25.5 102 178 A Q H X S+ 0 0 12 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.893 104.6 56.8 -67.3 -31.6 13.0 -3.1 28.2 103 179 A A H X S+ 0 0 0 -4,-2.5 4,-0.7 2,-0.2 296,-0.4 0.923 109.6 43.9 -66.6 -40.2 14.6 0.1 29.5 104 180 A W H >< S+ 0 0 35 -4,-1.7 3,-1.3 2,-0.2 -2,-0.2 0.947 112.6 52.0 -63.5 -44.9 11.3 1.7 30.0 105 181 A R H 3< S+ 0 0 28 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.863 111.0 50.3 -64.4 -31.3 9.8 -1.4 31.5 106 182 A N H 3< S+ 0 0 5 -4,-2.5 289,-0.3 -5,-0.2 -1,-0.3 0.629 79.8 114.2 -79.9 -9.0 12.8 -1.4 33.9 107 183 A A X< - 0 0 22 -3,-1.3 3,-1.6 -4,-0.7 6,-0.1 -0.437 48.4-164.9 -72.1 105.3 12.4 2.2 35.1 108 184 A P T 3 S+ 0 0 30 0, 0.0 262,-2.1 0, 0.0 -1,-0.2 0.736 84.4 56.4 -61.8 -25.0 11.5 2.2 38.8 109 185 A R T 3 S+ 0 0 55 260,-0.2 2,-0.6 264,-0.1 260,-0.1 0.484 86.3 94.3 -91.0 -0.3 10.4 5.8 38.8 110 186 A C X - 0 0 38 -3,-1.6 3,-0.6 -6,-0.2 264,-0.1 -0.811 44.0-177.2 -98.9 121.6 7.8 5.6 36.0 111 187 A V T 3 S+ 0 0 24 -2,-0.6 3,-0.4 1,-0.2 -1,-0.1 0.496 78.4 72.4 -84.7 -7.0 4.2 5.0 36.8 112 188 A G T > + 0 0 28 1,-0.2 3,-2.3 2,-0.1 -1,-0.2 0.322 58.8 116.8 -90.4 9.6 3.2 4.9 33.1 113 189 A R G X + 0 0 0 -3,-0.6 3,-1.8 1,-0.3 4,-0.2 0.553 51.1 81.9 -68.2 -5.0 4.8 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 0.855 94.8 53.1 -58.5 -29.0 1.5 -0.3 31.6 115 191 A Q G X S+ 0 0 61 -3,-2.3 3,-3.0 1,-0.2 -1,-0.3 0.477 76.5 112.7 -84.5 0.8 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 0.719 70.6 55.7 -52.3 -34.6 5.8 -0.1 28.0 117 193 A G T 3 S+ 0 0 43 -3,-0.4 2,-0.7 -4,-0.2 -1,-0.3 0.589 97.7 70.3 -74.0 -9.4 5.1 -2.5 25.0 118 194 A K < + 0 0 150 -3,-3.0 2,-0.4 -17,-0.1 34,-0.3 -0.815 64.4 129.9-118.6 91.1 3.9 0.4 22.9 119 195 A L - 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