==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=29-JUL-2012 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE/OXIDOREDUCTASE INHIBITOR 01-NOV-11 3UFS . 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) . 35533.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 547 66.9 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 . 67 8.2 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 . 224 27.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 19 2.3 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 2 0 1 1 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 . 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 0 215 0, 0.0 2,-0.5 0, 0.0 19,-0.1 0.000 360.0 360.0 360.0 -34.7 20.5 27.8 41.0 2 300 A F - 0 0 147 17,-0.1 2,-0.4 16,-0.0 15,-0.2 -0.919 360.0-157.9 -96.7 131.7 23.6 25.4 40.5 3 301 A L E -A 16 0A 43 13,-2.2 13,-4.5 -2,-0.5 2,-0.4 -0.895 8.7-145.2-124.4 140.0 22.5 22.0 41.7 4 302 A K E -A 15 0A 134 -2,-0.4 2,-0.4 11,-0.3 11,-0.2 -0.806 4.3-161.6-106.6 141.8 24.3 18.9 42.9 5 303 A V E -A 14 0A 0 9,-3.0 9,-3.1 -2,-0.4 2,-0.4 -0.984 12.2-158.2-115.9 133.9 23.6 15.2 42.4 6 304 A K E -A 13 0A 59 -2,-0.4 380,-2.0 7,-0.2 2,-0.6 -0.892 13.9-144.9-111.5 139.8 25.2 12.7 44.7 7 305 A N B > -B 385 0B 4 5,-2.3 4,-2.3 -2,-0.4 378,-0.2 -0.946 13.9-159.6 -96.2 121.9 25.8 9.0 44.1 8 306 A W T 4 S+ 0 0 87 376,-2.6 377,-0.1 -2,-0.6 -1,-0.1 0.522 87.7 52.6 -86.8 -11.4 25.3 7.4 47.5 9 307 A E T 4 S+ 0 0 39 375,-0.3 -1,-0.2 372,-0.2 376,-0.1 0.764 127.3 20.8 -86.0 -35.1 27.2 4.2 46.7 10 308 A T T 4 S- 0 0 80 374,-0.2 -2,-0.2 2,-0.1 3,-0.1 0.555 92.4-130.4-110.4 -11.8 30.3 6.1 45.4 11 309 A D < + 0 0 104 -4,-2.3 2,-0.2 1,-0.3 -3,-0.1 0.445 52.1 154.7 65.6 3.7 30.0 9.6 47.0 12 310 A V - 0 0 64 -5,-0.2 -5,-2.3 -6,-0.1 2,-0.5 -0.457 28.7-158.6 -62.5 123.3 30.6 11.1 43.6 13 311 A V E -A 6 0A 79 -2,-0.2 2,-0.3 -7,-0.2 -7,-0.2 -0.944 8.3-170.4-107.2 122.9 29.0 14.6 43.6 14 312 A L E -A 5 0A 34 -9,-3.1 -9,-3.0 -2,-0.5 2,-0.5 -0.875 15.6-135.2-111.5 150.1 28.2 16.2 40.2 15 313 A T E -A 4 0A 67 -2,-0.3 2,-0.5 -11,-0.2 -11,-0.3 -0.907 14.8-153.9-110.0 124.8 27.1 19.7 39.6 16 314 A D E +A 3 0A 0 -13,-4.5 -13,-2.2 -2,-0.5 347,-0.2 -0.855 34.7 146.2-105.0 125.1 24.2 20.5 37.2 17 315 A T > + 0 0 58 345,-2.8 3,-1.9 -2,-0.5 4,-0.4 0.427 60.0 85.7-120.7 -17.1 23.9 23.8 35.3 18 316 A L G > S+ 0 0 5 344,-2.1 3,-1.6 1,-0.3 345,-0.2 0.817 77.1 72.5 -60.1 -26.3 22.3 22.4 32.2 19 317 A H G > S+ 0 0 19 343,-0.3 3,-2.0 1,-0.3 -1,-0.3 0.728 81.3 68.9 -61.1 -25.6 18.9 22.7 33.9 20 318 A L G < S+ 0 0 69 -3,-1.9 -1,-0.3 1,-0.3 -2,-0.2 0.784 94.4 57.6 -66.1 -25.1 18.9 26.5 33.6 21 319 A K G < S+ 0 0 143 -3,-1.6 -1,-0.3 -4,-0.4 -2,-0.2 0.388 82.6 121.8 -82.5 2.2 18.5 26.0 29.9 22 320 A S < + 0 0 15 -3,-2.0 370,-0.2 1,-0.1 419,-0.0 -0.386 33.6 171.9 -66.3 145.6 15.3 24.0 30.6 23 321 A T + 0 0 63 368,-1.7 -1,-0.1 -2,-0.1 369,-0.1 0.751 45.3 69.4-124.3 -49.6 12.3 25.4 29.0 24 322 A L S S- 0 0 52 367,-0.7 367,-0.5 1,-0.1 2,-0.3 -0.217 83.3 -97.8 -78.4 164.3 9.2 23.2 29.3 25 323 A E - 0 0 143 1,-0.1 415,-0.2 365,-0.1 414,-0.1 -0.640 19.4-153.2 -90.0 140.5 7.2 22.5 32.5 26 324 A T - 0 0 17 413,-2.7 413,-0.1 -2,-0.3 -1,-0.1 0.737 37.1-115.8 -82.1 -26.4 7.7 19.3 34.5 27 325 A G S S+ 0 0 27 1,-0.5 412,-0.1 412,-0.2 413,-0.1 -0.129 82.6 107.7 105.7 -34.0 4.3 18.9 36.2 28 326 A C - 0 0 2 410,-0.3 -1,-0.5 411,-0.1 2,-0.3 -0.318 46.0-172.7 -76.1 155.4 5.8 19.4 39.7 29 327 A T - 0 0 47 3,-2.8 408,-0.4 -3,-0.1 406,-0.1 -0.814 45.5 -94.1-130.2 179.8 5.4 22.4 41.9 30 328 A E S S+ 0 0 69 -2,-0.3 405,-2.8 1,-0.2 406,-0.2 0.680 128.0 43.8 -66.1 -18.4 7.0 23.4 45.2 31 329 A H S S+ 0 0 84 1,-0.2 771,-0.4 403,-0.2 2,-0.4 0.747 119.7 30.7 -97.8 -28.3 3.9 21.9 46.9 32 330 A I - 0 0 10 769,-0.1 -3,-2.8 -5,-0.1 2,-0.5 -0.994 61.5-146.2-141.3 132.4 3.5 18.6 44.9 33 331 A C B -C 800 0C 9 767,-3.2 767,-2.1 -2,-0.4 3,-0.2 -0.869 10.9-178.1 -96.3 127.0 5.8 16.2 43.2 34 332 A M > + 0 0 27 -2,-0.5 3,-2.3 765,-0.2 -1,-0.1 0.013 39.6 129.9-108.6 22.9 4.4 14.4 40.0 35 333 A G T 3 S+ 0 0 19 1,-0.3 -1,-0.1 765,-0.1 334,-0.1 0.735 74.9 43.9 -45.8 -32.8 7.6 12.4 39.5 36 334 A S T 3 S+ 0 0 17 762,-0.5 2,-0.5 -3,-0.2 -1,-0.3 0.233 83.7 109.1-108.4 17.8 5.6 9.1 39.1 37 335 A I < - 0 0 13 -3,-2.3 -3,-0.1 1,-0.2 377,-0.0 -0.796 61.9-146.1 -88.7 129.6 2.7 10.4 36.9 38 336 A M S S+ 0 0 64 -2,-0.5 -1,-0.2 1,-0.3 -4,-0.0 0.934 94.8 21.3 -62.0 -43.0 3.1 8.9 33.4 39 337 A L 0 0 93 -3,-0.1 -1,-0.3 -12,-0.0 -12,-0.0 -0.826 360.0 360.0-127.0 88.5 1.6 12.0 31.7 40 338 A P 0 0 87 0, 0.0 -13,-0.1 0, 0.0 -12,-0.1 -0.338 360.0 360.0 -92.9 360.0 2.0 15.0 34.1 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 0 116 0, 0.0 4,-1.2 0, 0.0 42,-0.0 0.000 360.0 360.0 360.0 171.8 1.4 30.5 15.4 43 351 A K H > + 0 0 104 2,-0.2 4,-1.4 1,-0.2 38,-0.1 0.878 360.0 54.5 -62.8 -43.3 4.0 32.8 13.7 44 352 A D H 4 S+ 0 0 145 1,-0.2 -1,-0.2 2,-0.2 0, 0.0 0.859 109.8 44.7 -59.1 -44.4 4.7 34.5 17.1 45 353 A Q H > S+ 0 0 124 1,-0.2 4,-1.0 2,-0.1 -1,-0.2 0.803 108.8 59.1 -71.1 -30.1 5.4 31.3 19.0 46 354 A L H X S+ 0 0 17 -4,-1.2 4,-2.5 1,-0.2 5,-0.2 0.872 92.6 59.8 -78.7 -37.4 7.7 29.9 16.2 47 355 A F H X S+ 0 0 53 -4,-1.4 4,-2.7 1,-0.2 5,-0.2 0.904 104.4 48.6 -63.8 -42.7 10.5 32.4 15.8 48 356 A P H > S+ 0 0 77 0, 0.0 4,-2.8 0, 0.0 -1,-0.2 0.954 114.0 48.4 -56.3 -46.9 11.8 32.2 19.4 49 357 A L H X S+ 0 0 49 -4,-1.0 4,-2.0 1,-0.2 219,-0.2 0.898 112.2 48.5 -59.0 -44.6 11.8 28.4 19.2 50 358 A A H X S+ 0 0 0 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.945 114.3 46.0 -58.5 -50.4 13.6 28.5 15.8 51 359 A K H X S+ 0 0 86 -4,-2.7 4,-2.4 1,-0.2 5,-0.2 0.877 108.6 54.9 -62.5 -43.6 16.2 31.0 17.1 52 360 A E H X S+ 0 0 63 -4,-2.8 4,-1.7 -5,-0.2 -1,-0.2 0.929 113.1 43.5 -56.4 -48.0 16.8 29.1 20.3 53 361 A F H X S+ 0 0 5 -4,-2.0 4,-2.9 2,-0.2 -2,-0.2 0.924 112.5 49.7 -63.6 -47.1 17.6 25.9 18.3 54 362 A L H X S+ 0 0 0 -4,-2.4 4,-3.1 1,-0.2 5,-0.2 0.879 108.8 54.4 -66.3 -36.8 19.8 27.6 15.6 55 363 A D H X S+ 0 0 28 -4,-2.4 4,-1.9 2,-0.2 -1,-0.2 0.919 111.1 44.8 -59.4 -45.6 21.8 29.3 18.3 56 364 A Q H X S+ 0 0 49 -4,-1.7 4,-2.1 -5,-0.2 -2,-0.2 0.915 112.8 52.1 -69.8 -35.1 22.5 25.9 19.9 57 365 A Y H X S+ 0 0 24 -4,-2.9 4,-1.5 1,-0.2 -2,-0.2 0.949 111.5 44.9 -62.2 -48.9 23.3 24.4 16.6 58 366 A Y H <>S+ 0 0 28 -4,-3.1 5,-3.3 1,-0.2 6,-0.3 0.821 111.2 54.6 -67.8 -28.8 25.8 27.0 15.6 59 367 A S H ><5S+ 0 0 69 -4,-1.9 3,-1.8 4,-0.2 5,-0.2 0.936 105.3 52.7 -64.8 -45.6 27.4 26.8 19.1 60 368 A S H 3<5S+ 0 0 50 -4,-2.1 -2,-0.2 1,-0.3 -1,-0.2 0.825 109.5 48.3 -61.3 -34.8 27.9 23.0 18.7 61 369 A I T 3<5S- 0 0 59 -4,-1.5 -1,-0.3 -5,-0.2 -2,-0.2 0.277 118.7-113.3 -88.8 12.4 29.7 23.5 15.4 62 370 A K T < 5S+ 0 0 176 -3,-1.8 -3,-0.2 -5,-0.1 -2,-0.1 0.801 89.8 108.7 61.1 35.0 31.9 26.2 17.0 63 371 A R > < + 0 0 142 -5,-3.3 3,-1.4 -6,-0.1 6,-0.4 -0.061 35.6 152.3-130.8 34.3 30.4 29.0 14.8 64 372 A F T 3 S+ 0 0 125 -6,-0.3 -9,-0.1 1,-0.3 4,-0.0 -0.484 75.3 8.6 -66.5 130.3 28.3 31.0 17.2 65 373 A G T 3 S+ 0 0 49 1,-0.2 -1,-0.3 -2,-0.2 2,-0.2 0.722 99.7 137.3 70.3 24.4 27.9 34.6 16.1 66 374 A S S <> S- 0 0 30 -3,-1.4 4,-2.9 1,-0.1 5,-0.3 -0.543 72.7-100.5 -94.1 163.3 29.6 34.0 12.7 67 375 A K H > S+ 0 0 164 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.927 125.5 47.4 -36.3 -60.2 28.6 35.2 9.3 68 376 A A H > S+ 0 0 37 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.876 111.1 51.3 -59.4 -43.4 27.0 31.8 8.6 69 377 A H H > S+ 0 0 2 -6,-0.4 4,-2.2 2,-0.2 3,-0.3 0.977 113.9 42.4 -53.8 -56.7 25.1 31.8 11.9 70 378 A M H X S+ 0 0 94 -4,-2.9 4,-2.1 1,-0.2 -2,-0.2 0.887 111.2 56.5 -64.0 -39.9 23.7 35.3 11.4 71 379 A D H X S+ 0 0 101 -4,-2.7 4,-2.1 -5,-0.3 -1,-0.2 0.885 109.6 45.7 -53.9 -45.3 22.9 34.6 7.7 72 380 A R H X S+ 0 0 8 -4,-2.0 4,-2.8 -3,-0.3 5,-0.3 0.893 107.8 55.5 -70.2 -40.7 20.8 31.5 8.7 73 381 A L H X S+ 0 0 14 -4,-2.2 4,-2.3 1,-0.2 -1,-0.2 0.915 112.6 44.7 -57.4 -40.6 18.9 33.3 11.5 74 382 A E H X S+ 0 0 117 -4,-2.1 4,-2.8 2,-0.2 -2,-0.2 0.901 111.2 52.8 -68.9 -42.3 17.9 35.9 8.9 75 383 A E H X S+ 0 0 89 -4,-2.1 4,-1.9 2,-0.2 -2,-0.2 0.919 113.6 42.6 -58.8 -48.0 17.0 33.3 6.3 76 384 A V H X S+ 0 0 0 -4,-2.8 4,-2.5 2,-0.2 5,-0.2 0.928 112.5 53.1 -67.7 -47.9 14.7 31.4 8.7 77 385 A N H X S+ 0 0 39 -4,-2.3 4,-2.4 -5,-0.3 -2,-0.2 0.923 110.4 49.2 -48.3 -49.0 13.2 34.6 10.0 78 386 A K H X S+ 0 0 149 -4,-2.8 4,-1.3 1,-0.2 -1,-0.2 0.899 110.8 50.0 -56.2 -43.7 12.4 35.6 6.4 79 387 A E H X>S+ 0 0 46 -4,-1.9 4,-3.3 2,-0.2 6,-0.6 0.848 111.6 46.7 -70.7 -38.2 10.8 32.2 5.7 80 388 A I H X5S+ 0 0 5 -4,-2.5 4,-2.1 3,-0.2 -2,-0.2 0.957 108.9 54.2 -67.0 -53.6 8.6 32.3 8.8 81 389 A E H <5S+ 0 0 143 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.824 123.0 30.6 -47.0 -35.0 7.4 35.9 8.1 82 390 A S H <5S+ 0 0 100 -4,-1.3 -2,-0.2 -5,-0.2 -1,-0.2 0.928 134.4 21.8 -94.3 -55.3 6.4 34.8 4.6 83 391 A T H <5S- 0 0 82 -4,-3.3 -3,-0.2 2,-0.4 -2,-0.2 0.596 93.5-124.4 -94.5 -15.8 5.3 31.1 4.7 84 392 A S S < - 0 0 98 -2,-0.3 4,-2.3 1,-0.1 3,-0.5 -0.475 32.5-108.3 -67.1 152.0 18.8 22.0 6.5 90 398 A D H > S+ 0 0 97 1,-0.3 4,-2.6 2,-0.2 5,-0.2 0.893 121.3 52.8 -49.3 -47.7 19.8 18.3 6.5 91 399 A T H > S+ 0 0 80 1,-0.2 4,-2.3 2,-0.2 -1,-0.3 0.866 110.1 47.7 -58.3 -41.4 22.6 19.0 8.9 92 400 A E H > S+ 0 0 1 -3,-0.5 4,-2.5 2,-0.2 -1,-0.2 0.842 110.9 51.6 -66.2 -40.5 20.1 20.7 11.3 93 401 A L H X S+ 0 0 2 -4,-2.3 4,-2.0 2,-0.2 -2,-0.2 0.905 111.0 47.2 -64.6 -44.6 17.7 17.8 11.0 94 402 A I H X S+ 0 0 70 -4,-2.6 4,-2.2 2,-0.2 -2,-0.2 0.941 115.6 45.0 -62.1 -51.7 20.5 15.2 11.9 95 403 A Y H X S+ 0 0 31 -4,-2.3 4,-2.1 1,-0.2 -2,-0.2 0.903 112.5 52.6 -57.2 -44.7 21.7 17.3 14.8 96 404 A G H X S+ 0 0 0 -4,-2.5 4,-2.1 1,-0.2 -2,-0.2 0.896 110.5 46.1 -60.9 -41.5 18.1 17.9 16.0 97 405 A A H X S+ 0 0 0 -4,-2.0 4,-1.9 2,-0.2 -1,-0.2 0.910 111.6 50.7 -70.0 -44.5 17.2 14.2 16.0 98 406 A K H X S+ 0 0 50 -4,-2.2 4,-2.4 1,-0.2 -1,-0.2 0.884 112.6 48.7 -60.0 -39.6 20.3 13.1 17.7 99 407 A H H X S+ 0 0 10 -4,-2.1 4,-2.9 2,-0.2 -2,-0.2 0.843 102.2 59.3 -72.2 -32.5 19.6 15.7 20.4 100 408 A A H < S+ 0 0 0 -4,-2.1 296,-0.5 2,-0.2 4,-0.3 0.947 111.8 43.4 -57.9 -44.6 16.0 14.7 20.9 101 409 A W H >< S+ 0 0 35 -4,-1.9 3,-2.0 1,-0.2 -2,-0.2 0.958 111.6 53.3 -60.6 -51.3 17.5 11.3 21.8 102 410 A R H 3< S+ 0 0 33 -4,-2.4 -2,-0.2 1,-0.3 -1,-0.2 0.858 112.2 46.1 -51.6 -40.3 20.3 12.9 23.9 103 411 A N T 3< S+ 0 0 9 -4,-2.9 2,-1.3 291,-0.2 289,-0.4 0.443 78.2 118.5 -84.0 -0.6 17.6 14.9 25.9 104 412 A A X - 0 0 26 -3,-2.0 3,-2.2 -4,-0.3 6,-0.1 -0.503 45.9-169.0 -74.7 94.6 15.3 11.9 26.4 105 413 A S T 3 S+ 0 0 20 -2,-1.3 262,-2.7 1,-0.3 -1,-0.2 0.711 80.9 54.4 -66.2 -19.1 15.3 11.8 30.2 106 414 A R T 3 S+ 0 0 85 260,-0.2 2,-0.6 264,-0.1 -1,-0.3 0.392 86.7 99.2 -89.1 2.2 13.6 8.4 30.4 107 415 A C X - 0 0 39 -3,-2.2 3,-0.7 -6,-0.2 264,-0.1 -0.833 46.1-174.6-104.0 116.9 16.1 6.6 28.1 108 416 A V T 3 S+ 0 0 24 -2,-0.6 3,-0.4 1,-0.2 -1,-0.1 0.590 79.8 66.8 -74.4 -14.6 18.8 4.5 29.7 109 417 A G T > + 0 0 27 1,-0.2 3,-1.7 2,-0.1 -1,-0.2 0.247 60.8 117.0 -97.3 16.7 20.5 3.8 26.4 110 418 A R G X + 0 0 0 -3,-0.7 3,-2.2 1,-0.3 4,-0.2 0.512 48.5 87.0 -72.5 -2.7 21.7 7.3 25.6 111 419 A I G 3 S+ 0 0 55 -3,-0.4 3,-0.3 1,-0.3 -1,-0.3 0.761 93.9 53.1 -61.3 -18.7 25.5 6.6 25.7 112 420 A Q G X S+ 0 0 48 -3,-1.7 3,-2.7 1,-0.2 -1,-0.3 0.490 74.9 113.8 -90.5 -1.9 24.7 5.7 22.1 113 421 A W T < S+ 0 0 43 -3,-2.2 -1,-0.2 1,-0.3 -11,-0.2 0.720 72.9 51.9 -52.4 -34.2 23.0 9.0 21.2 114 422 A S T 3 S+ 0 0 60 -3,-0.3 2,-1.0 -4,-0.2 -1,-0.3 0.635 96.6 70.0 -84.0 -10.4 25.5 10.2 18.7 115 423 A K < + 0 0 121 -3,-2.7 2,-0.4 -17,-0.1 34,-0.3 -0.808 68.9 131.2-102.9 86.6 25.5 7.0 16.6 116 424 A L - 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