==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=16-AUG-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE/OXIDOREDUCTASE INHIBITOR 22-MAR-13 4JSE . COMPND 2 MOLECULE: NITRIC OXIDE SYNTHASE, BRAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS; . AUTHOR H.LI,T.L.POULOS . 820 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 35456.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 538 65.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 16 2.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 86 10.5 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 . 1 0.1 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 . 69 8.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 84 10.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 222 27.1 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 2 0 0 2 2 2 4 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 0 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 . 9 6 10 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 1 299 A R 0 0 212 0, 0.0 19,-0.0 0, 0.0 16,-0.0 0.000 360.0 360.0 360.0 -19.2 20.3 27.0 39.4 2 300 A F - 0 0 165 2,-0.0 2,-0.3 17,-0.0 15,-0.2 -0.173 360.0-177.3 177.6 79.4 23.6 25.2 40.5 3 301 A L E -A 16 0A 17 13,-1.5 13,-4.0 448,-0.0 2,-0.4 -0.645 19.0-151.1-106.5 143.7 22.7 21.6 41.5 4 302 A K E -A 15 0A 136 -2,-0.3 2,-0.4 11,-0.2 11,-0.2 -0.881 5.5-165.7-110.6 141.5 24.5 18.6 43.0 5 303 A V E -A 14 0A 0 9,-2.6 9,-2.7 -2,-0.4 2,-0.4 -0.980 10.2-154.9-120.0 140.1 23.7 14.9 42.5 6 304 A K E -A 13 0A 59 -2,-0.4 381,-2.1 7,-0.2 2,-0.6 -0.905 13.2-143.0-113.0 139.4 25.2 12.2 44.7 7 305 A N B > -B 386 0B 7 5,-2.6 4,-1.9 -2,-0.4 379,-0.2 -0.922 14.6-159.4 -93.9 122.0 25.8 8.5 44.0 8 306 A W T 4 S+ 0 0 90 377,-2.6 378,-0.1 -2,-0.6 -1,-0.1 0.578 87.6 51.3 -82.8 -12.0 25.1 6.8 47.3 9 307 A E T 4 S+ 0 0 34 376,-0.2 -1,-0.2 373,-0.2 377,-0.1 0.831 126.5 21.7 -88.0 -38.6 27.0 3.6 46.4 10 308 A T T 4 S- 0 0 81 2,-0.1 -2,-0.2 375,-0.1 3,-0.1 0.498 91.9-129.8-108.4 -8.1 30.3 5.4 45.3 11 309 A D < + 0 0 105 -4,-1.9 -3,-0.1 1,-0.3 2,-0.1 0.368 54.2 151.8 66.6 -2.4 30.0 8.9 47.1 12 310 A V - 0 0 59 -6,-0.1 -5,-2.6 -5,-0.1 2,-0.5 -0.379 30.1-159.2 -57.0 125.5 30.8 10.5 43.7 13 311 A V E -A 6 0A 71 -7,-0.2 2,-0.3 -3,-0.1 -7,-0.2 -0.964 7.7-170.3-112.9 126.0 29.2 14.0 43.6 14 312 A L E -A 5 0A 32 -9,-2.7 -9,-2.6 -2,-0.5 2,-0.5 -0.894 15.4-135.5-117.3 147.6 28.5 15.7 40.2 15 313 A T E -A 4 0A 68 -2,-0.3 2,-0.6 -11,-0.2 -11,-0.2 -0.880 13.2-149.2-106.6 128.3 27.4 19.4 39.6 16 314 A D E +A 3 0A 0 -13,-4.0 -13,-1.5 -2,-0.5 348,-0.2 -0.843 33.6 151.6-101.9 122.5 24.6 20.1 37.1 17 315 A T > + 0 0 57 346,-2.8 3,-1.3 -2,-0.6 347,-0.2 0.446 62.5 79.8-114.7 -10.6 24.7 23.4 35.2 18 316 A L G > S+ 0 0 8 345,-2.3 3,-2.7 1,-0.3 346,-0.2 0.812 74.9 75.0 -72.4 -26.6 22.9 22.2 32.1 19 317 A H G > S+ 0 0 13 344,-0.3 3,-1.9 1,-0.3 -1,-0.3 0.676 77.9 76.6 -60.0 -18.9 19.5 22.5 33.8 20 318 A L G < S+ 0 0 76 -3,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.722 92.3 54.1 -61.4 -22.3 19.8 26.3 33.3 21 319 A K G < S+ 0 0 147 -3,-2.7 373,-0.3 -4,-0.2 -1,-0.3 0.298 87.0 127.5 -93.3 10.2 19.0 25.6 29.6 22 320 A S < - 0 0 21 -3,-1.9 371,-0.2 371,-0.1 2,-0.2 -0.177 34.6-178.6 -74.6 167.2 15.7 23.7 30.6 23 321 A T + 0 0 31 369,-2.2 369,-0.4 418,-0.2 -1,-0.1 -0.501 36.9 22.1-145.3-158.3 12.3 24.5 29.2 24 322 A L S S- 0 0 108 -2,-0.2 2,-0.3 367,-0.1 -2,-0.0 0.111 95.4 -57.5 14.8-112.4 8.5 23.8 29.1 25 323 A E - 0 0 124 1,-0.1 416,-0.2 416,-0.1 415,-0.1 -0.993 21.2-151.3-153.6 147.6 7.4 22.0 32.3 26 324 A T - 0 0 37 414,-1.8 415,-0.1 -2,-0.3 3,-0.1 0.627 47.7-118.6 -86.9 -18.9 8.1 19.0 34.5 27 325 A G S S+ 0 0 36 1,-0.4 2,-0.1 413,-0.3 413,-0.1 0.128 80.7 112.9 90.9 -19.8 4.6 18.8 35.9 28 326 A C - 0 0 2 411,-0.4 -1,-0.4 5,-0.1 -2,-0.3 -0.470 43.7-174.4 -84.5 155.6 6.1 19.3 39.4 29 327 A T - 0 0 53 3,-2.4 409,-0.4 -2,-0.1 407,-0.2 -0.830 45.3 -95.4-130.6 179.4 5.7 22.2 41.7 30 328 A E S S+ 0 0 86 -2,-0.3 406,-2.0 1,-0.2 407,-0.3 0.767 126.6 42.4 -66.0 -25.4 7.2 23.2 45.0 31 329 A H S S+ 0 0 97 1,-0.2 773,-0.5 404,-0.2 2,-0.4 0.786 121.4 32.0 -89.5 -29.9 4.1 21.7 46.7 32 330 A I - 0 0 10 771,-0.1 -3,-2.4 400,-0.1 2,-0.6 -0.965 61.4-149.2-144.1 125.2 3.7 18.5 44.6 33 331 A C B -C 802 0C 10 769,-3.0 769,-2.0 -2,-0.4 3,-0.3 -0.795 8.9-177.1 -94.3 124.2 6.1 16.1 42.8 34 332 A M > + 0 0 22 -2,-0.6 3,-2.0 1,-0.2 -1,-0.1 0.002 39.7 129.6-107.4 27.1 4.7 14.4 39.8 35 333 A G T 3 S+ 0 0 18 1,-0.3 -1,-0.2 767,-0.1 335,-0.2 0.707 75.3 44.9 -52.0 -27.1 7.8 12.2 39.2 36 334 A S T 3 S+ 0 0 10 764,-0.5 2,-0.5 -3,-0.3 -1,-0.3 0.293 84.7 107.7-106.4 9.6 5.8 9.0 38.9 37 335 A I < - 0 0 16 -3,-2.0 4,-0.1 762,-0.2 -3,-0.1 -0.780 58.2-154.1 -84.8 125.4 3.0 10.4 36.7 38 336 A M + 0 0 35 -2,-0.5 -1,-0.1 378,-0.1 -4,-0.0 0.930 68.7 45.0 -70.4 -44.6 3.5 8.9 33.2 39 337 A L S S- 0 0 89 1,-0.1 2,-0.3 2,-0.0 -1,-0.0 -0.696 99.5 -83.5-108.4 152.6 1.8 11.6 31.1 40 338 A P 0 0 109 0, 0.0 -13,-0.1 0, 0.0 -1,-0.1 -0.279 360.0 360.0 -47.7 105.1 1.8 15.5 30.9 41 339 A S 0 0 105 -2,-0.3 373,-0.1 -4,-0.1 -14,-0.1 0.893 360.0 360.0 -72.5 360.0 -0.8 16.2 33.7 42 ! 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 43 350 A T > 0 0 117 0, 0.0 4,-2.1 0, 0.0 3,-0.4 0.000 360.0 360.0 360.0 178.6 2.3 30.7 15.1 44 351 A K H > + 0 0 92 1,-0.2 4,-1.4 2,-0.2 38,-0.1 0.790 360.0 59.3 -47.8 -38.3 4.9 33.0 13.6 45 352 A D H 4 S+ 0 0 132 1,-0.2 -1,-0.2 2,-0.2 3,-0.0 0.946 113.5 33.6 -59.4 -54.4 5.2 34.8 16.9 46 353 A Q H > S+ 0 0 108 -3,-0.4 4,-1.2 1,-0.2 -2,-0.2 0.744 110.8 67.7 -76.3 -24.4 6.3 31.8 18.9 47 354 A L H X S+ 0 0 20 -4,-2.1 4,-2.9 1,-0.2 5,-0.2 0.928 90.6 55.0 -69.1 -48.5 8.2 30.1 16.1 48 355 A F H X S+ 0 0 46 -4,-1.4 4,-3.1 1,-0.2 5,-0.2 0.894 107.5 50.3 -58.0 -41.2 11.2 32.5 15.5 49 356 A P H > S+ 0 0 78 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.910 113.1 47.4 -59.0 -40.8 12.4 32.4 19.2 50 357 A L H X S+ 0 0 54 -4,-1.2 4,-1.9 2,-0.2 219,-0.2 0.917 113.8 47.0 -66.2 -43.8 12.2 28.6 19.1 51 358 A A H X S+ 0 0 0 -4,-2.9 4,-3.0 2,-0.2 5,-0.2 0.940 113.3 48.8 -60.2 -49.4 14.1 28.5 15.8 52 359 A K H X S+ 0 0 84 -4,-3.1 4,-2.8 -5,-0.2 5,-0.2 0.921 108.3 53.5 -56.5 -49.6 16.8 31.0 17.1 53 360 A E H X S+ 0 0 79 -4,-2.6 4,-1.5 -5,-0.2 -1,-0.2 0.917 114.6 42.2 -50.6 -48.4 17.2 29.0 20.3 54 361 A F H X S+ 0 0 4 -4,-1.9 4,-2.7 2,-0.2 -2,-0.2 0.938 114.0 48.9 -66.6 -47.5 17.9 25.8 18.3 55 362 A L H X S+ 0 0 0 -4,-3.0 4,-3.0 1,-0.2 5,-0.2 0.856 108.5 54.9 -67.5 -34.1 20.1 27.5 15.6 56 363 A D H X S+ 0 0 28 -4,-2.8 4,-2.1 -5,-0.2 -1,-0.2 0.904 110.9 45.3 -59.1 -44.4 22.2 29.1 18.3 57 364 A Q H X S+ 0 0 52 -4,-1.5 4,-2.1 -5,-0.2 -2,-0.2 0.885 113.4 51.1 -69.5 -36.8 22.8 25.7 19.9 58 365 A Y H X S+ 0 0 20 -4,-2.7 4,-1.5 2,-0.2 -2,-0.2 0.965 111.7 44.9 -61.6 -55.0 23.6 24.2 16.5 59 366 A Y H <>S+ 0 0 27 -4,-3.0 5,-3.0 1,-0.2 6,-0.4 0.873 112.5 52.3 -62.6 -37.2 26.1 26.9 15.5 60 367 A S H ><5S+ 0 0 68 -4,-2.1 3,-2.0 4,-0.2 -1,-0.2 0.929 105.0 56.4 -56.4 -47.3 27.8 26.7 18.9 61 368 A S H 3<5S+ 0 0 51 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.809 108.8 46.0 -60.1 -32.9 28.1 22.9 18.5 62 369 A I T 3<5S- 0 0 53 -4,-1.5 -1,-0.3 -5,-0.1 -2,-0.2 0.047 118.9-110.8 -96.4 26.6 30.1 23.3 15.3 63 370 A K T < 5S+ 0 0 175 -3,-2.0 -3,-0.2 1,-0.1 -2,-0.1 0.763 91.4 108.0 50.0 36.3 32.3 26.0 16.9 64 371 A R > < + 0 0 141 -5,-3.0 3,-1.5 -6,-0.2 6,-0.4 -0.016 36.6 152.1-129.4 30.6 30.8 28.8 14.7 65 372 A F T 3 S+ 0 0 128 -6,-0.4 3,-0.1 1,-0.2 -9,-0.1 -0.410 74.8 8.2 -62.5 132.2 28.7 30.8 17.2 66 373 A G T 3 S+ 0 0 48 1,-0.2 -1,-0.2 -2,-0.1 -10,-0.0 0.460 96.3 138.6 76.0 1.4 28.3 34.5 16.2 67 374 A S S <> S- 0 0 32 -3,-1.5 4,-2.8 1,-0.1 -1,-0.2 -0.261 71.0-106.4 -72.4 162.3 29.9 33.9 12.8 68 375 A K H > S+ 0 0 153 1,-0.2 4,-3.6 2,-0.2 5,-0.3 0.933 123.9 54.0 -53.0 -45.9 28.6 35.5 9.6 69 376 A A H > S+ 0 0 50 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.887 108.8 48.7 -58.4 -40.5 27.2 32.1 8.6 70 377 A H H > S+ 0 0 2 -6,-0.4 4,-2.2 2,-0.2 -2,-0.2 0.968 115.3 44.0 -60.2 -53.0 25.4 31.9 11.9 71 378 A M H X S+ 0 0 87 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.895 113.4 51.1 -62.0 -41.1 23.9 35.4 11.5 72 379 A D H X S+ 0 0 75 -4,-3.6 4,-2.8 -5,-0.2 -1,-0.2 0.876 110.3 49.3 -63.1 -40.4 23.1 34.8 7.8 73 380 A R H X S+ 0 0 6 -4,-2.1 4,-2.6 -5,-0.3 -2,-0.2 0.918 111.5 48.1 -66.8 -41.8 21.2 31.5 8.7 74 381 A L H X S+ 0 0 18 -4,-2.2 4,-2.7 1,-0.2 -2,-0.2 0.931 113.8 48.7 -63.1 -46.4 19.2 33.3 11.4 75 382 A E H X S+ 0 0 95 -4,-2.6 4,-2.4 -5,-0.2 -2,-0.2 0.931 110.8 50.3 -50.8 -52.2 18.5 36.0 9.0 76 383 A E H X S+ 0 0 87 -4,-2.8 4,-1.8 1,-0.2 -2,-0.2 0.871 112.7 46.4 -59.8 -41.8 17.4 33.4 6.3 77 384 A V H X S+ 0 0 0 -4,-2.6 4,-2.6 2,-0.2 -1,-0.2 0.892 109.6 52.7 -72.5 -41.7 15.1 31.6 8.7 78 385 A N H X S+ 0 0 56 -4,-2.7 4,-2.4 1,-0.2 -2,-0.2 0.941 111.1 48.2 -55.6 -48.3 13.5 34.8 10.0 79 386 A K H X S+ 0 0 124 -4,-2.4 4,-1.8 1,-0.2 -2,-0.2 0.889 111.6 50.7 -57.0 -44.5 12.8 35.8 6.4 80 387 A E H X S+ 0 0 48 -4,-1.8 4,-3.0 1,-0.2 6,-0.6 0.894 111.0 46.5 -66.1 -43.5 11.3 32.4 5.7 81 388 A I H X S+ 0 0 2 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.914 110.8 52.6 -64.5 -45.5 9.0 32.4 8.7 82 389 A E H < S+ 0 0 131 -4,-2.4 -1,-0.2 -5,-0.2 -2,-0.2 0.894 121.7 32.0 -55.3 -41.5 7.8 35.9 8.0 83 390 A S H < S+ 0 0 99 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.794 134.3 23.7 -90.5 -35.5 6.9 35.0 4.4 84 391 A T H < S- 0 0 66 -4,-3.0 -3,-0.2 2,-0.4 -2,-0.2 0.483 94.0-124.7-113.5 -9.1 5.9 31.3 4.6 85 392 A S S < S+ 0 0 63 -4,-2.1 2,-0.2 -5,-0.4 -4,-0.2 0.397 89.2 41.1 76.5 -1.2 4.8 31.0 8.3 86 393 A T S S- 0 0 29 -6,-0.6 -2,-0.4 -9,-0.0 2,-0.3 -0.851 74.2-136.2-150.5-175.3 7.3 28.2 8.8 87 394 A Y - 0 0 0 -2,-0.2 2,-0.4 -3,-0.1 -10,-0.1 -0.970 13.6-119.4-146.5 168.7 10.8 27.2 7.7 88 395 A Q - 0 0 93 -2,-0.3 2,-0.2 182,-0.0 -8,-0.1 -0.929 24.5-129.6-112.5 133.3 12.8 24.2 6.5 89 396 A L - 0 0 7 -2,-0.4 2,-0.1 1,-0.1 179,-0.0 -0.555 22.4-119.4 -73.9 140.0 15.7 22.6 8.3 90 397 A K > - 0 0 93 -2,-0.2 4,-2.6 1,-0.1 5,-0.2 -0.368 31.4-108.8 -68.7 159.0 19.0 22.0 6.5 91 398 A D H > S+ 0 0 99 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.908 120.9 51.2 -60.4 -42.8 20.0 18.4 6.4 92 399 A T H > S+ 0 0 79 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.862 111.2 48.3 -60.2 -37.8 22.9 19.0 8.8 93 400 A E H > S+ 0 0 2 2,-0.2 4,-2.5 1,-0.2 -2,-0.2 0.875 110.2 52.1 -72.5 -38.3 20.4 20.7 11.2 94 401 A L H X S+ 0 0 2 -4,-2.6 4,-2.3 2,-0.2 -2,-0.2 0.908 111.2 46.0 -62.1 -46.1 17.9 17.9 10.9 95 402 A I H X S+ 0 0 69 -4,-2.4 4,-2.6 2,-0.2 5,-0.2 0.924 114.6 48.2 -63.3 -45.9 20.6 15.2 11.7 96 403 A Y H X S+ 0 0 29 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.899 112.5 48.5 -61.7 -42.1 21.8 17.3 14.7 97 404 A G H X S+ 0 0 0 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.895 111.6 49.0 -69.1 -40.1 18.3 17.8 16.0 98 405 A A H X S+ 0 0 0 -4,-2.3 4,-1.6 2,-0.2 -2,-0.2 0.951 112.0 48.0 -64.4 -49.3 17.4 14.2 15.7 99 406 A K H X S+ 0 0 53 -4,-2.6 4,-2.5 1,-0.2 -1,-0.2 0.892 113.5 48.8 -58.0 -39.0 20.5 13.0 17.5 100 407 A H H X S+ 0 0 13 -4,-2.1 4,-2.5 2,-0.2 -1,-0.2 0.833 102.2 60.7 -75.8 -28.9 20.0 15.6 20.3 101 408 A A H < S+ 0 0 0 -4,-2.1 296,-0.5 2,-0.2 -1,-0.2 0.894 111.3 41.6 -61.8 -37.7 16.4 14.7 20.8 102 409 A W H >< S+ 0 0 34 -4,-1.6 3,-1.8 2,-0.2 -2,-0.2 0.928 111.6 55.1 -72.2 -43.0 17.7 11.2 21.7 103 410 A R H 3< S+ 0 0 35 -4,-2.5 -2,-0.2 1,-0.3 -1,-0.2 0.876 112.5 45.0 -55.1 -34.9 20.5 12.8 23.7 104 411 A N T 3< S+ 0 0 9 -4,-2.5 2,-1.2 291,-0.2 289,-0.4 0.403 78.5 119.3 -89.7 -1.5 17.9 14.7 25.7 105 412 A A X - 0 0 25 -3,-1.8 3,-2.0 1,-0.2 6,-0.1 -0.532 45.3-168.5 -75.9 97.1 15.5 11.8 26.2 106 413 A S T 3 S+ 0 0 23 -2,-1.2 262,-2.8 1,-0.3 -1,-0.2 0.700 80.7 54.6 -66.2 -21.4 15.4 11.6 30.0 107 414 A R T 3 S+ 0 0 59 260,-0.2 2,-0.6 264,-0.1 -1,-0.3 0.384 87.0 98.3 -88.3 2.7 13.7 8.3 30.1 108 415 A C X - 0 0 38 -3,-2.0 3,-0.7 -6,-0.2 264,-0.1 -0.844 46.0-174.7-104.1 119.9 16.2 6.4 27.9 109 416 A V T 3 S+ 0 0 25 -2,-0.6 3,-0.4 1,-0.2 -1,-0.1 0.574 80.6 69.1 -76.5 -13.1 18.9 4.3 29.5 110 417 A G T > + 0 0 27 1,-0.2 3,-1.7 2,-0.1 -1,-0.2 0.262 60.5 116.3 -94.3 17.7 20.5 3.6 26.1 111 418 A R G X + 0 0 0 -3,-0.7 3,-2.2 1,-0.3 4,-0.2 0.549 50.1 84.5 -75.4 -5.8 21.8 7.1 25.4 112 419 A I G 3 S+ 0 0 54 -3,-0.4 3,-0.4 1,-0.3 -1,-0.3 0.820 93.0 54.2 -58.9 -22.4 25.5 6.3 25.4 113 420 A Q G X S+ 0 0 46 -3,-1.7 3,-2.7 1,-0.2 -1,-0.3 0.462 75.5 113.2 -87.1 -0.3 24.7 5.4 21.7 114 421 A W T < S+ 0 0 40 -3,-2.2 -1,-0.2 1,-0.3 -11,-0.2 0.719 71.8 51.8 -56.8 -33.3 23.1 8.8 20.9 115 422 A S T 3 S+ 0 0 59 -3,-0.4 2,-1.0 -4,-0.2 -1,-0.3 0.644 99.1 68.4 -81.2 -10.0 25.7 10.1 18.4 116 423 A K < + 0 0 138 -3,-2.7 2,-0.4 -17,-0.1 34,-0.3 -0.805 69.1 131.1-108.5 81.5 25.5 6.9 16.3 117 424 A L - 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