==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-APR-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE/OXIDOREDUCTASE INHIBITOR 03-JAN-13 4IMT . COMPND 2 MOLECULE: NITRIC OXIDE SYNTHASE, BRAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS; . AUTHOR H.LI,T.L.POULOS . 818 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 34748.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 537 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 . 84 10.3 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 . 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 . 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 . 63 7.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 88 10.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 227 27.8 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 6 2 0 1 1 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 . 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 . 8 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 0 210 0, 0.0 2,-0.4 0, 0.0 19,-0.1 0.000 360.0 360.0 360.0 -68.0 20.5 27.2 40.6 2 300 A F - 0 0 142 17,-0.1 2,-0.4 16,-0.0 15,-0.2 -0.791 360.0-156.3 -81.3 137.9 23.7 25.0 40.4 3 301 A L E -A 16 0A 41 13,-1.9 13,-4.3 -2,-0.4 2,-0.3 -0.970 11.9-147.5-133.3 134.2 22.6 21.6 41.5 4 302 A K E -A 15 0A 144 -2,-0.4 2,-0.4 11,-0.3 11,-0.2 -0.694 6.7-164.8 -96.5 145.3 24.5 18.6 42.9 5 303 A V E -A 14 0A 0 9,-2.8 9,-2.7 -2,-0.3 2,-0.4 -1.000 11.2-155.5-127.3 131.7 23.6 14.9 42.3 6 304 A K E -A 13 0A 59 -2,-0.4 380,-2.3 7,-0.2 2,-0.6 -0.873 13.5-144.6-108.1 136.9 25.2 12.2 44.5 7 305 A N B > -B 385 0B 4 5,-3.2 4,-1.8 -2,-0.4 378,-0.2 -0.894 13.0-160.6 -89.4 125.0 25.8 8.6 43.8 8 306 A W T 4 S+ 0 0 85 376,-2.3 -1,-0.1 -2,-0.6 377,-0.1 0.547 88.4 52.6 -85.4 -8.4 25.1 6.8 47.2 9 307 A E T 4 S+ 0 0 31 372,-0.2 -1,-0.2 3,-0.1 376,-0.1 0.744 128.1 18.9 -90.1 -32.7 27.1 3.7 46.3 10 308 A T T 4 S- 0 0 75 2,-0.2 -2,-0.2 374,-0.1 3,-0.1 0.484 90.9-129.1-117.1 -7.1 30.2 5.7 45.2 11 309 A D < + 0 0 111 -4,-1.8 -3,-0.1 1,-0.2 2,-0.0 0.350 54.7 150.4 68.0 -7.5 29.9 9.1 46.9 12 310 A V - 0 0 63 -6,-0.1 -5,-3.2 1,-0.0 2,-0.5 -0.373 30.2-161.1 -56.9 129.2 30.6 10.8 43.5 13 311 A V E -A 6 0A 70 -7,-0.2 2,-0.3 -3,-0.1 -7,-0.2 -0.986 5.9-168.8-115.6 119.0 28.9 14.2 43.4 14 312 A L E -A 5 0A 32 -9,-2.7 -9,-2.8 -2,-0.5 2,-0.5 -0.796 16.5-132.2-106.0 153.6 28.3 15.8 40.0 15 313 A T E -A 4 0A 58 -2,-0.3 2,-0.6 -11,-0.2 -11,-0.3 -0.937 14.1-151.5-112.8 121.1 27.1 19.4 39.4 16 314 A D E +A 3 0A 0 -13,-4.3 -13,-1.9 -2,-0.5 347,-0.2 -0.832 33.5 150.1 -97.5 117.6 24.2 20.0 37.0 17 315 A T > + 0 0 47 345,-2.9 3,-1.0 -2,-0.6 4,-0.2 0.405 60.2 80.5-116.4 -9.1 24.2 23.3 35.2 18 316 A L G > S+ 0 0 2 344,-2.2 3,-1.8 1,-0.3 345,-0.2 0.780 77.6 71.4 -75.3 -28.2 22.5 22.2 32.0 19 317 A H G > S+ 0 0 19 343,-0.3 3,-2.1 1,-0.3 -1,-0.3 0.679 80.6 75.1 -60.3 -19.3 19.1 22.3 33.6 20 318 A L G < S+ 0 0 63 -3,-1.0 -1,-0.3 1,-0.3 -2,-0.2 0.767 91.8 55.0 -67.1 -22.2 19.3 26.1 33.6 21 319 A K G < S+ 0 0 134 -3,-1.8 -1,-0.3 -4,-0.2 -2,-0.2 0.341 81.0 142.0 -80.0 4.4 18.6 25.9 29.9 22 320 A S < + 0 0 17 -3,-2.1 370,-0.2 1,-0.1 -3,-0.1 -0.239 24.3 176.5 -56.8 131.3 15.5 23.9 30.8 23 321 A T + 0 0 43 368,-1.8 369,-0.2 2,-0.1 -1,-0.1 0.843 50.0 48.2 -97.7 -74.1 12.8 25.0 28.4 24 322 A L S S- 0 0 45 367,-0.5 367,-0.5 1,-0.1 2,-0.1 0.143 84.2 -93.7 -76.4 175.3 9.6 23.0 28.9 25 323 A E - 0 0 134 365,-0.1 415,-0.2 1,-0.1 -1,-0.1 -0.396 18.1-151.9 -88.5 163.6 7.6 22.2 32.1 26 324 A T - 0 0 20 413,-2.0 414,-0.1 2,-0.3 3,-0.1 0.666 35.8-115.6-106.9 -25.8 7.8 19.0 34.3 27 325 A G S S+ 0 0 30 1,-0.4 412,-0.1 412,-0.3 2,-0.1 0.002 82.9 105.7 103.2 -28.0 4.4 18.5 35.9 28 326 A C - 0 0 4 410,-0.3 -1,-0.4 411,-0.1 -2,-0.3 -0.390 45.5-174.4 -83.7 159.7 5.8 19.1 39.4 29 327 A T - 0 0 48 3,-2.7 408,-0.4 -3,-0.1 406,-0.1 -0.788 47.4 -94.7-130.3-176.6 5.5 22.2 41.7 30 328 A E S S+ 0 0 82 -2,-0.2 405,-1.2 1,-0.2 406,-0.2 0.747 128.4 45.6 -66.3 -22.9 7.0 23.1 45.0 31 329 A H S S+ 0 0 94 1,-0.2 2,-0.4 403,-0.2 771,-0.4 0.809 120.7 27.2 -89.9 -33.2 3.8 21.6 46.5 32 330 A I - 0 0 10 769,-0.1 -3,-2.7 405,-0.1 2,-0.5 -0.988 62.1-150.3-138.9 127.3 3.5 18.3 44.5 33 331 A C B -C 800 0C 9 767,-2.9 767,-1.8 -2,-0.4 3,-0.3 -0.859 9.2-175.3 -94.6 128.1 6.0 16.1 42.8 34 332 A M > + 0 0 28 -2,-0.5 3,-2.1 1,-0.2 -1,-0.1 0.058 38.5 131.5-111.1 26.2 4.6 14.2 39.8 35 333 A G T 3 S+ 0 0 21 1,-0.3 334,-0.2 765,-0.1 -1,-0.2 0.648 73.4 45.5 -49.8 -26.8 7.8 12.2 39.1 36 334 A S T 3 S+ 0 0 18 762,-0.5 2,-0.5 -3,-0.3 -1,-0.3 0.349 82.6 109.7-107.6 5.5 5.8 8.9 38.8 37 335 A I < - 0 0 14 -3,-2.1 -3,-0.0 760,-0.1 377,-0.0 -0.701 61.3-145.7 -79.2 128.4 2.9 10.1 36.6 38 336 A M S S+ 0 0 55 -2,-0.5 -1,-0.1 1,-0.2 -4,-0.0 0.853 88.8 20.7 -58.0 -41.7 3.2 8.5 33.1 39 337 A L 0 0 77 -3,-0.0 -1,-0.2 -12,-0.0 -12,-0.0 -0.790 360.0 360.0-135.5 85.6 1.7 11.6 31.3 40 338 A P 0 0 100 0, 0.0 -13,-0.1 0, 0.0 -12,-0.0 -0.313 360.0 360.0 -76.0 360.0 1.8 15.0 33.1 41 ! 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 42 350 A T > 0 0 110 0, 0.0 4,-2.2 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 173.4 2.1 30.6 15.4 43 351 A K H > + 0 0 80 2,-0.2 4,-1.6 1,-0.2 38,-0.1 0.820 360.0 50.2 -59.9 -38.8 4.7 32.8 13.8 44 352 A D H 4 S+ 0 0 130 1,-0.2 -1,-0.2 2,-0.2 3,-0.1 0.941 112.9 45.5 -68.0 -48.3 5.3 34.6 17.0 45 353 A Q H > S+ 0 0 116 1,-0.2 4,-1.2 2,-0.1 -2,-0.2 0.870 111.4 56.0 -61.7 -36.5 5.8 31.3 18.9 46 354 A L H X S+ 0 0 16 -4,-2.2 4,-3.3 1,-0.2 5,-0.2 0.856 94.0 58.8 -76.9 -40.3 8.1 29.9 16.2 47 355 A F H X S+ 0 0 43 -4,-1.6 4,-3.2 2,-0.2 5,-0.2 0.910 106.8 48.4 -62.5 -38.1 11.0 32.4 15.7 48 356 A P H > S+ 0 0 75 0, 0.0 4,-3.3 0, 0.0 5,-0.2 0.972 114.9 45.8 -61.6 -45.9 12.1 32.1 19.3 49 357 A L H X S+ 0 0 53 -4,-1.2 4,-2.3 2,-0.2 -2,-0.2 0.916 114.3 48.6 -61.3 -42.2 12.0 28.3 19.1 50 358 A A H X S+ 0 0 0 -4,-3.3 4,-3.2 1,-0.2 5,-0.2 0.955 114.7 45.6 -60.5 -48.5 13.8 28.5 15.7 51 359 A K H X S+ 0 0 88 -4,-3.2 4,-3.0 2,-0.2 -2,-0.2 0.878 109.6 53.1 -63.5 -45.5 16.5 30.8 17.1 52 360 A E H X S+ 0 0 58 -4,-3.3 4,-2.1 -5,-0.2 -1,-0.2 0.959 115.1 43.2 -52.9 -51.0 17.0 28.9 20.3 53 361 A F H X S+ 0 0 3 -4,-2.3 4,-3.0 -5,-0.2 -2,-0.2 0.966 114.9 46.7 -61.1 -52.6 17.6 25.8 18.1 54 362 A L H X S+ 0 0 0 -4,-3.2 4,-2.7 1,-0.3 5,-0.3 0.854 109.7 56.1 -64.5 -32.5 19.8 27.4 15.5 55 363 A D H X S+ 0 0 32 -4,-3.0 4,-1.7 -5,-0.2 -1,-0.3 0.933 110.4 44.0 -61.0 -45.6 21.8 29.1 18.3 56 364 A Q H X S+ 0 0 46 -4,-2.1 4,-3.3 -5,-0.2 -2,-0.2 0.927 113.1 53.1 -70.8 -36.8 22.5 25.7 19.8 57 365 A Y H X S+ 0 0 25 -4,-3.0 4,-1.7 2,-0.2 -2,-0.2 0.973 111.9 42.2 -55.5 -57.3 23.3 24.2 16.4 58 366 A Y H <>S+ 0 0 30 -4,-2.7 5,-2.8 1,-0.2 -1,-0.2 0.787 115.0 52.4 -68.0 -26.3 25.8 26.8 15.4 59 367 A S H ><5S+ 0 0 67 -4,-1.7 3,-1.9 -5,-0.3 -1,-0.2 0.927 103.5 56.7 -68.7 -46.1 27.2 26.6 18.8 60 368 A S H 3<5S+ 0 0 58 -4,-3.3 -2,-0.2 1,-0.3 -1,-0.2 0.855 108.5 49.3 -51.1 -35.8 27.5 22.8 18.5 61 369 A I T 3<5S- 0 0 54 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.1 -0.015 117.2-109.8-100.2 32.1 29.7 23.4 15.4 62 370 A K T < 5S+ 0 0 184 -3,-1.9 -3,-0.2 1,-0.1 -2,-0.1 0.773 93.8 103.3 51.5 35.2 32.1 25.9 17.0 63 371 A R > < + 0 0 139 -5,-2.8 3,-1.4 -6,-0.1 6,-0.3 -0.061 39.5 156.1-139.0 35.1 30.6 28.8 14.8 64 372 A F T 3 S+ 0 0 127 1,-0.3 -9,-0.1 -5,-0.2 4,-0.1 -0.420 74.3 8.4 -63.2 133.6 28.3 30.7 17.2 65 373 A G T 3 S+ 0 0 47 1,-0.2 -1,-0.3 -2,-0.1 2,-0.2 0.704 95.7 138.8 65.6 23.0 27.8 34.3 16.1 66 374 A S S <> S- 0 0 31 -3,-1.4 4,-2.7 1,-0.1 5,-0.3 -0.553 70.9-104.0 -92.2 161.0 29.5 33.8 12.7 67 375 A K H > S+ 0 0 157 1,-0.2 4,-3.4 2,-0.2 5,-0.3 0.958 124.5 52.9 -44.7 -58.0 28.3 35.3 9.4 68 376 A A H > S+ 0 0 47 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.881 110.6 48.9 -48.1 -44.7 27.0 31.8 8.4 69 377 A H H > S+ 0 0 1 -6,-0.3 4,-2.3 2,-0.2 3,-0.4 0.991 114.4 42.8 -55.7 -60.1 25.1 31.6 11.8 70 378 A M H X S+ 0 0 85 -4,-2.7 4,-2.8 1,-0.3 -2,-0.2 0.853 112.0 54.9 -60.7 -37.8 23.5 35.1 11.4 71 379 A D H X S+ 0 0 73 -4,-3.4 4,-3.1 -5,-0.3 -1,-0.3 0.898 110.2 45.9 -60.5 -44.2 22.7 34.5 7.7 72 380 A R H X S+ 0 0 9 -4,-2.0 4,-2.5 -3,-0.4 5,-0.3 0.884 110.3 53.4 -68.5 -36.6 20.8 31.4 8.6 73 381 A L H X S+ 0 0 18 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.933 113.4 44.3 -63.9 -44.3 19.0 33.1 11.4 74 382 A E H X S+ 0 0 99 -4,-2.8 4,-3.2 2,-0.2 -2,-0.2 0.962 111.5 52.6 -59.2 -54.2 18.0 35.8 9.0 75 383 A E H X S+ 0 0 90 -4,-3.1 4,-2.2 1,-0.2 -2,-0.2 0.872 112.2 44.4 -53.0 -44.3 17.0 33.3 6.3 76 384 A V H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.906 112.1 53.3 -70.7 -40.1 14.7 31.4 8.6 77 385 A N H X S+ 0 0 55 -4,-2.0 4,-2.0 -5,-0.3 -2,-0.2 0.910 110.7 47.3 -55.5 -46.0 13.3 34.6 10.0 78 386 A K H X S+ 0 0 137 -4,-3.2 4,-1.4 1,-0.2 -2,-0.2 0.912 112.7 49.2 -61.2 -42.1 12.5 35.6 6.4 79 387 A E H X S+ 0 0 49 -4,-2.2 4,-3.9 -5,-0.2 6,-0.5 0.832 110.9 48.4 -71.7 -35.1 10.9 32.2 5.6 80 388 A I H X S+ 0 0 5 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.930 111.2 48.9 -69.2 -50.8 8.7 32.1 8.7 81 389 A E H < S+ 0 0 127 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.815 123.6 35.3 -55.2 -32.4 7.4 35.7 8.2 82 390 A S H < S+ 0 0 100 -4,-1.4 -2,-0.2 -5,-0.2 -3,-0.2 0.902 133.4 21.6 -90.8 -47.6 6.7 34.7 4.6 83 391 A T H < S- 0 0 72 -4,-3.9 -3,-0.2 2,-0.4 -2,-0.2 0.652 90.2-128.5-100.5 -18.0 5.6 31.0 4.8 84 392 A S S < S+ 0 0 73 -4,-2.2 2,-0.2 -5,-0.4 -4,-0.2 0.311 90.1 44.4 79.4 -6.8 4.5 30.7 8.4 85 393 A T S S- 0 0 28 -6,-0.5 -2,-0.4 -9,-0.0 -1,-0.3 -0.734 74.1-148.6-135.4-168.2 6.8 27.6 8.8 86 394 A Y - 0 0 0 -2,-0.2 2,-0.4 -3,-0.1 -10,-0.1 -0.970 13.3-115.0-156.5 174.7 10.3 26.8 7.7 87 395 A Q - 0 0 90 -2,-0.3 2,-0.3 182,-0.0 -8,-0.1 -0.928 21.9-128.4-118.9 136.2 12.5 23.9 6.6 88 396 A L - 0 0 7 -2,-0.4 2,-0.2 1,-0.1 179,-0.0 -0.589 23.7-119.9 -75.1 138.3 15.5 22.4 8.3 89 397 A K >> - 0 0 105 -2,-0.3 4,-2.6 1,-0.1 3,-0.7 -0.525 33.8-108.9 -63.6 144.2 18.7 21.9 6.5 90 398 A D H 3> S+ 0 0 99 1,-0.3 4,-3.0 2,-0.2 5,-0.2 0.876 122.0 53.3 -40.9 -50.8 19.7 18.2 6.4 91 399 A T H 3> S+ 0 0 73 1,-0.2 4,-2.8 2,-0.2 -1,-0.3 0.890 109.3 48.3 -56.2 -42.1 22.5 18.9 8.8 92 400 A E H <> S+ 0 0 0 -3,-0.7 4,-3.1 2,-0.2 -1,-0.2 0.886 110.3 52.4 -65.1 -41.7 20.0 20.6 11.2 93 401 A L H X S+ 0 0 2 -4,-2.6 4,-2.8 2,-0.2 5,-0.2 0.956 111.5 46.0 -56.4 -51.1 17.6 17.6 10.9 94 402 A I H X S+ 0 0 71 -4,-3.0 4,-2.3 1,-0.2 5,-0.2 0.954 116.0 44.7 -58.5 -53.1 20.5 15.2 11.7 95 403 A Y H X S+ 0 0 27 -4,-2.8 4,-2.0 1,-0.2 -1,-0.2 0.906 114.4 50.9 -57.7 -45.3 21.6 17.3 14.7 96 404 A G H X S+ 0 0 0 -4,-3.1 4,-2.1 2,-0.2 -1,-0.2 0.915 110.9 46.4 -58.4 -47.0 18.0 17.8 15.8 97 405 A A H X S+ 0 0 0 -4,-2.8 4,-1.5 1,-0.2 -2,-0.2 0.950 112.1 49.6 -65.8 -48.0 17.1 14.1 15.7 98 406 A K H X S+ 0 0 49 -4,-2.3 4,-2.9 1,-0.2 -1,-0.2 0.863 112.3 49.6 -60.7 -37.5 20.2 13.0 17.5 99 407 A H H X S+ 0 0 9 -4,-2.0 4,-3.0 -5,-0.2 -1,-0.2 0.827 100.7 60.8 -74.4 -30.3 19.6 15.6 20.2 100 408 A A H < S+ 0 0 0 -4,-2.1 296,-0.5 2,-0.2 -1,-0.2 0.899 112.9 41.2 -56.1 -38.2 16.0 14.6 20.7 101 409 A W H >< S+ 0 0 35 -4,-1.5 3,-2.0 2,-0.2 -2,-0.2 0.949 111.5 54.3 -75.4 -49.2 17.5 11.2 21.7 102 410 A R H 3< S+ 0 0 35 -4,-2.9 -2,-0.2 1,-0.3 -1,-0.2 0.869 112.6 45.8 -49.2 -39.5 20.3 12.8 23.7 103 411 A N T 3< S+ 0 0 10 -4,-3.0 2,-0.9 291,-0.3 289,-0.4 0.402 79.5 116.3 -87.3 3.7 17.6 14.7 25.6 104 412 A A X - 0 0 25 -3,-2.0 3,-1.7 1,-0.2 6,-0.1 -0.603 47.1-167.1 -80.3 105.6 15.3 11.7 26.3 105 413 A S T 3 S+ 0 0 22 -2,-0.9 262,-3.1 1,-0.3 -1,-0.2 0.684 81.5 55.1 -77.1 -13.8 15.4 11.5 30.0 106 414 A R T 3 S+ 0 0 89 260,-0.2 2,-0.7 264,-0.1 -1,-0.3 0.449 84.1 100.7 -92.6 -1.8 13.7 8.1 30.2 107 415 A C X - 0 0 40 -3,-1.7 3,-0.7 -6,-0.2 264,-0.1 -0.769 44.5-176.6 -95.3 115.7 16.2 6.4 27.8 108 416 A V T 3 S+ 0 0 24 -2,-0.7 3,-0.4 1,-0.2 -1,-0.2 0.667 80.3 67.7 -73.3 -18.5 18.8 4.3 29.5 109 417 A G T > + 0 0 28 1,-0.2 3,-1.5 2,-0.1 -1,-0.2 0.208 61.9 113.4 -90.5 16.3 20.4 3.6 26.2 110 418 A R G X + 0 0 0 -3,-0.7 3,-2.8 1,-0.3 -1,-0.2 0.564 47.4 89.3 -75.8 -5.5 21.7 7.1 25.4 111 419 A I G 3 S+ 0 0 55 -3,-0.4 3,-0.4 1,-0.3 -1,-0.3 0.864 94.0 51.4 -53.6 -26.6 25.4 6.4 25.5 112 420 A Q G X S+ 0 0 50 -3,-1.5 3,-2.1 1,-0.2 -1,-0.3 0.294 74.2 119.2 -87.6 5.3 24.7 5.6 21.8 113 421 A W T < S+ 0 0 39 -3,-2.8 -11,-0.2 1,-0.3 -1,-0.2 0.710 71.6 50.3 -58.0 -26.7 22.9 8.9 21.0 114 422 A S T 3 S+ 0 0 52 -3,-0.4 2,-1.2 -4,-0.2 -1,-0.3 0.622 93.9 73.2 -89.4 -13.8 25.3 10.1 18.4 115 423 A K < + 0 0 127 -3,-2.1 2,-0.4 -17,-0.1 34,-0.3 -0.715 68.5 135.3 -95.5 77.1 25.4 6.9 16.3 116 424 A L - 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