==== 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 4IMW . 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) . 35433.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 531 64.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 15 1.8 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 83 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 . 1 0.1 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 . 62 7.6 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 . 17 2.1 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 1 0 1 1 0 2 0 0 2 0 0 2 2 2 4 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 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 7 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 . 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 1 299 A R 0 0 210 0, 0.0 2,-0.5 0, 0.0 19,-0.1 0.000 360.0 360.0 360.0 -22.4 20.8 27.4 40.7 2 300 A F - 0 0 141 17,-0.1 2,-0.4 18,-0.0 15,-0.2 -0.969 360.0-159.3-111.7 112.2 23.9 25.1 40.6 3 301 A L E -A 16 0A 41 13,-1.8 13,-3.8 -2,-0.5 2,-0.3 -0.732 6.3-143.7-104.5 138.8 22.4 21.8 41.6 4 302 A K E -A 15 0A 129 -2,-0.4 2,-0.4 11,-0.2 11,-0.2 -0.716 7.4-164.0 -99.7 146.0 24.3 18.8 43.0 5 303 A V E -A 14 0A 0 9,-3.2 9,-3.5 -2,-0.3 2,-0.4 -0.996 11.2-158.8-125.7 127.9 23.7 15.1 42.4 6 304 A K E -A 13 0A 55 -2,-0.4 380,-1.9 7,-0.2 2,-0.5 -0.868 13.2-146.0-108.0 137.6 25.2 12.5 44.6 7 305 A N B > -B 385 0B 5 5,-2.9 4,-1.2 -2,-0.4 378,-0.2 -0.870 11.5-157.3 -90.7 130.3 25.9 8.8 44.0 8 306 A W T 4 S+ 0 0 84 376,-2.3 377,-0.1 -2,-0.5 -1,-0.1 0.545 88.5 49.1 -91.3 -3.9 25.4 7.0 47.4 9 307 A E T 4 S+ 0 0 52 375,-0.2 -1,-0.2 372,-0.1 376,-0.1 0.726 127.4 22.4-100.2 -31.9 27.5 4.0 46.5 10 308 A T T 4 S- 0 0 79 2,-0.2 -2,-0.2 374,-0.1 3,-0.1 0.478 90.8-133.7-115.6 -9.5 30.6 5.9 45.3 11 309 A D < + 0 0 105 -4,-1.2 -3,-0.1 1,-0.2 2,-0.1 0.427 52.9 152.3 63.9 -2.5 30.0 9.3 47.0 12 310 A V - 0 0 73 -6,-0.1 -5,-2.9 1,-0.0 2,-0.4 -0.358 32.0-153.3 -54.5 134.6 30.9 10.9 43.7 13 311 A V E -A 6 0A 69 -7,-0.2 2,-0.3 -3,-0.1 -7,-0.2 -0.955 7.5-161.9-119.4 129.5 29.1 14.3 43.5 14 312 A L E -A 5 0A 29 -9,-3.5 -9,-3.2 -2,-0.4 2,-0.5 -0.879 10.6-141.1-116.2 153.6 28.1 15.9 40.2 15 313 A T E -A 4 0A 60 -2,-0.3 2,-0.6 -11,-0.2 -11,-0.2 -0.944 14.0-153.2-117.2 115.0 27.2 19.5 39.5 16 314 A D E +A 3 0A 0 -13,-3.8 -13,-1.8 -2,-0.5 347,-0.2 -0.799 33.2 149.1 -98.5 121.8 24.4 20.2 37.1 17 315 A T > + 0 0 41 345,-2.8 3,-1.1 -2,-0.6 4,-0.3 0.448 60.6 80.1-118.0 -10.1 24.3 23.5 35.2 18 316 A L G > S+ 0 0 9 344,-2.1 3,-1.3 1,-0.3 345,-0.1 0.740 77.0 74.7 -72.7 -21.9 22.6 22.3 32.1 19 317 A H G > S+ 0 0 18 343,-0.3 3,-1.0 1,-0.3 -1,-0.3 0.674 84.3 64.4 -66.6 -19.2 19.2 22.5 33.7 20 318 A L G < S+ 0 0 65 -3,-1.1 -1,-0.3 1,-0.3 -2,-0.2 0.719 95.0 58.2 -78.6 -20.2 19.1 26.4 33.5 21 319 A K G < S+ 0 0 151 -3,-1.3 -1,-0.3 -4,-0.3 2,-0.2 0.098 88.4 130.9 -85.0 19.7 19.1 26.1 29.7 22 320 A S < + 0 0 19 -3,-1.0 370,-0.2 1,-0.1 -3,-0.1 -0.523 34.7 179.5 -83.3 143.2 15.9 24.1 30.5 23 321 A T + 0 0 48 368,-1.7 369,-0.2 -2,-0.2 -1,-0.1 0.842 44.8 47.2-109.9 -79.8 12.8 25.0 28.6 24 322 A L S S- 0 0 52 367,-0.5 367,-0.3 1,-0.1 2,-0.2 0.276 82.3 -85.9 -67.3-174.4 9.4 23.2 29.0 25 323 A E - 0 0 135 1,-0.1 415,-0.2 365,-0.1 -1,-0.1 -0.647 20.0-151.6-101.4 155.2 7.5 22.2 32.2 26 324 A T - 0 0 19 413,-2.6 414,-0.1 2,-0.3 413,-0.1 0.762 37.7-114.7 -92.8 -30.5 7.9 19.1 34.4 27 325 A G S S+ 0 0 29 1,-0.4 2,-0.1 412,-0.2 412,-0.1 -0.112 82.6 106.9 109.1 -33.1 4.5 18.5 36.0 28 326 A C - 0 0 3 410,-0.3 -1,-0.4 411,-0.1 -2,-0.3 -0.453 46.6-169.8 -84.9 150.5 5.8 19.2 39.5 29 327 A T - 0 0 46 3,-2.8 408,-0.3 -2,-0.1 409,-0.1 -0.817 44.8-101.8-119.0 169.9 5.3 22.3 41.8 30 328 A E S S+ 0 0 71 -2,-0.3 405,-1.9 1,-0.2 406,-0.2 0.614 127.1 47.7 -67.8 -5.8 7.2 23.0 45.0 31 329 A H S S+ 0 0 80 1,-0.3 771,-0.4 403,-0.2 2,-0.4 0.802 119.4 29.0 -96.1 -39.3 4.0 21.7 46.6 32 330 A I - 0 0 13 769,-0.1 -3,-2.8 -5,-0.1 2,-0.5 -0.985 65.2-147.4-132.7 128.5 3.4 18.5 44.7 33 331 A C B -C 800 0C 10 767,-3.0 767,-1.7 -2,-0.4 3,-0.2 -0.813 10.7-176.7 -92.6 130.1 5.9 16.1 43.0 34 332 A M > + 0 0 30 -2,-0.5 3,-2.5 765,-0.2 -1,-0.1 0.159 41.8 125.0-112.0 17.0 4.6 14.4 39.8 35 333 A G T 3 S+ 0 0 19 1,-0.3 -1,-0.2 765,-0.1 334,-0.1 0.808 73.0 50.5 -42.9 -43.9 7.7 12.2 39.2 36 334 A S T 3 S+ 0 0 17 762,-0.4 2,-0.5 -3,-0.2 -1,-0.3 0.415 84.5 109.2 -85.4 8.7 5.7 9.0 39.2 37 335 A I < - 0 0 11 -3,-2.5 -3,-0.1 1,-0.1 377,-0.0 -0.736 59.7-149.5 -88.3 126.8 3.0 10.2 36.6 38 336 A M S S+ 0 0 53 -2,-0.5 -1,-0.1 1,-0.3 -4,-0.0 0.895 90.4 16.6 -53.6 -50.0 3.2 8.6 33.2 39 337 A L 0 0 79 -12,-0.0 -1,-0.3 359,-0.0 -12,-0.1 -0.863 360.0 360.0-130.1 94.8 1.8 11.7 31.4 40 338 A P 0 0 96 0, 0.0 -13,-0.1 0, 0.0 -12,-0.0 -0.054 360.0 360.0 -92.9 360.0 1.9 15.0 33.3 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 0 126 0, 0.0 4,-0.5 0, 0.0 3,-0.2 0.000 360.0 360.0 360.0 172.2 1.2 31.1 15.3 43 351 A K H > + 0 0 92 2,-0.2 4,-1.2 1,-0.2 38,-0.1 0.541 360.0 74.6 -93.0 -18.3 4.4 32.7 13.9 44 352 A D H 4 S+ 0 0 149 1,-0.2 -1,-0.2 2,-0.1 0, 0.0 0.539 109.3 30.6 -68.2 -11.8 4.7 34.9 17.1 45 353 A Q H > S+ 0 0 109 -3,-0.2 4,-1.2 2,-0.1 -1,-0.2 0.561 109.1 66.5-122.5 -23.4 5.9 31.8 18.9 46 354 A L H X S+ 0 0 15 -4,-0.5 4,-2.6 1,-0.2 5,-0.2 0.860 93.9 59.0 -74.0 -35.1 7.7 29.8 16.2 47 355 A F H X S+ 0 0 41 -4,-1.2 4,-2.8 2,-0.2 5,-0.2 0.927 103.8 49.0 -65.6 -43.9 10.5 32.3 15.6 48 356 A P H > S+ 0 0 75 0, 0.0 4,-2.9 0, 0.0 -1,-0.2 0.940 113.1 49.8 -56.7 -44.4 11.8 32.2 19.2 49 357 A L H X S+ 0 0 55 -4,-1.2 4,-2.0 2,-0.2 219,-0.2 0.917 111.5 47.8 -57.1 -46.5 11.8 28.4 19.0 50 358 A A H X S+ 0 0 0 -4,-2.6 4,-2.7 2,-0.2 5,-0.2 0.943 113.9 47.1 -59.1 -48.5 13.6 28.4 15.7 51 359 A K H X S+ 0 0 88 -4,-2.8 4,-2.6 2,-0.2 5,-0.2 0.902 107.5 55.3 -62.6 -48.1 16.2 30.9 17.0 52 360 A E H X S+ 0 0 59 -4,-2.9 4,-1.5 -5,-0.2 -1,-0.2 0.928 114.0 43.0 -47.7 -49.5 16.8 29.0 20.3 53 361 A F H X S+ 0 0 4 -4,-2.0 4,-2.7 2,-0.2 -2,-0.2 0.932 112.6 49.3 -64.5 -49.0 17.5 25.9 18.2 54 362 A L H X S+ 0 0 0 -4,-2.7 4,-2.6 1,-0.3 5,-0.2 0.828 108.2 56.4 -66.8 -32.1 19.7 27.5 15.5 55 363 A D H X S+ 0 0 34 -4,-2.6 4,-1.6 -5,-0.2 -1,-0.3 0.895 109.5 44.3 -61.9 -43.5 21.8 29.2 18.3 56 364 A Q H X S+ 0 0 55 -4,-1.5 4,-2.3 -5,-0.2 -2,-0.2 0.916 113.2 52.6 -73.4 -33.8 22.5 25.8 19.8 57 365 A Y H X S+ 0 0 23 -4,-2.7 4,-1.8 2,-0.2 -2,-0.2 0.944 111.6 43.6 -59.1 -51.8 23.3 24.3 16.4 58 366 A Y H <>S+ 0 0 27 -4,-2.6 5,-3.2 1,-0.2 6,-0.3 0.774 113.0 54.3 -69.7 -25.6 25.8 27.0 15.4 59 367 A S H ><5S+ 0 0 67 -4,-1.6 3,-1.4 4,-0.2 -1,-0.2 0.887 104.9 52.9 -69.6 -41.5 27.3 26.8 18.9 60 368 A S H 3<5S+ 0 0 60 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.874 109.0 49.4 -65.2 -35.7 27.9 23.1 18.6 61 369 A I T 3<5S- 0 0 65 -4,-1.8 -1,-0.3 -5,-0.1 -2,-0.2 0.248 116.5-114.7 -86.0 16.2 29.7 23.5 15.3 62 370 A K T < 5S+ 0 0 184 -3,-1.4 -3,-0.2 -5,-0.1 -2,-0.1 0.871 90.4 109.0 57.0 41.9 31.9 26.3 16.9 63 371 A R > < + 0 0 134 -5,-3.2 3,-1.1 -6,-0.1 6,-0.4 0.012 39.4 151.0-137.5 23.8 30.4 28.9 14.5 64 372 A F T 3 + 0 0 133 -6,-0.3 3,-0.1 1,-0.2 -9,-0.1 -0.365 69.6 9.4 -61.6 134.6 28.4 30.9 17.0 65 373 A G T 3 S+ 0 0 50 1,-0.2 -1,-0.2 -2,-0.1 2,-0.2 0.788 102.4 129.3 65.3 31.5 27.8 34.6 16.2 66 374 A S S <> S- 0 0 37 -3,-1.1 4,-2.9 1,-0.1 5,-0.3 -0.556 74.7 -93.6-112.9 175.9 29.3 34.2 12.7 67 375 A K H > S+ 0 0 152 1,-0.2 4,-3.2 2,-0.2 5,-0.3 0.964 124.0 45.0 -51.8 -69.5 28.3 35.2 9.2 68 376 A A H > S+ 0 0 44 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.829 114.3 53.2 -41.2 -43.1 26.7 31.8 8.3 69 377 A H H > S+ 0 0 2 -6,-0.4 4,-2.1 2,-0.2 -1,-0.2 0.983 113.3 39.1 -58.7 -59.5 25.0 31.9 11.7 70 378 A M H X S+ 0 0 91 -4,-2.9 4,-1.9 1,-0.2 -2,-0.2 0.863 114.2 56.6 -61.9 -38.4 23.4 35.4 11.2 71 379 A D H X S+ 0 0 82 -4,-3.2 4,-2.2 -5,-0.3 -1,-0.2 0.930 109.0 46.1 -55.7 -48.5 22.7 34.6 7.6 72 380 A R H X S+ 0 0 12 -4,-2.3 4,-2.4 -5,-0.3 5,-0.3 0.883 108.7 54.1 -64.3 -42.2 20.7 31.5 8.6 73 381 A L H X S+ 0 0 24 -4,-2.1 4,-1.8 1,-0.2 -1,-0.2 0.885 111.4 46.7 -63.2 -37.4 18.7 33.3 11.3 74 382 A E H X S+ 0 0 106 -4,-1.9 4,-2.7 2,-0.2 -2,-0.2 0.937 110.4 52.2 -66.3 -49.7 17.6 35.9 8.8 75 383 A E H X S+ 0 0 90 -4,-2.2 4,-2.1 1,-0.2 -2,-0.2 0.880 111.7 45.8 -54.0 -45.6 16.7 33.3 6.2 76 384 A V H X S+ 0 0 0 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.869 110.5 54.2 -69.9 -38.8 14.5 31.4 8.6 77 385 A N H X S+ 0 0 54 -4,-1.8 4,-2.4 -5,-0.3 -2,-0.2 0.940 109.3 47.5 -57.2 -48.3 12.9 34.6 9.8 78 386 A K H X S+ 0 0 135 -4,-2.7 4,-1.7 1,-0.2 -2,-0.2 0.922 111.9 50.4 -56.9 -45.3 12.0 35.6 6.2 79 387 A E H X>S+ 0 0 48 -4,-2.1 4,-2.8 1,-0.2 6,-0.7 0.833 111.4 48.5 -65.4 -35.9 10.5 32.1 5.6 80 388 A I H X5S+ 0 0 3 -4,-2.1 4,-1.6 3,-0.2 -1,-0.2 0.932 109.8 50.7 -68.5 -49.4 8.4 32.2 8.7 81 389 A E H <5S+ 0 0 128 -4,-2.4 -2,-0.2 -5,-0.2 -1,-0.2 0.800 123.1 32.4 -58.2 -33.0 7.0 35.7 8.0 82 390 A S H <5S+ 0 0 94 -4,-1.7 -2,-0.2 -5,-0.2 -3,-0.2 0.919 133.1 23.2 -89.2 -55.9 6.0 34.6 4.5 83 391 A T H <5S- 0 0 72 -4,-2.8 -3,-0.2 2,-0.3 -2,-0.1 0.722 93.9-124.8 -89.7 -23.5 5.1 30.9 4.7 84 392 A S S < - 0 0 104 -2,-0.3 4,-2.5 1,-0.1 3,-0.3 -0.407 31.7-109.6 -60.5 152.4 18.6 21.9 6.4 90 398 A D H > S+ 0 0 100 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.912 120.2 52.7 -49.5 -51.8 19.7 18.3 6.4 91 399 A T H > S+ 0 0 75 1,-0.2 4,-1.9 2,-0.2 -1,-0.2 0.856 110.5 46.9 -55.8 -39.5 22.5 19.0 8.8 92 400 A E H > S+ 0 0 1 -3,-0.3 4,-3.4 2,-0.2 -1,-0.2 0.865 109.9 55.2 -72.2 -38.9 20.1 20.6 11.2 93 401 A L H X S+ 0 0 2 -4,-2.5 4,-2.1 2,-0.2 -2,-0.2 0.905 109.2 45.4 -54.5 -49.5 17.7 17.7 10.8 94 402 A I H X S+ 0 0 70 -4,-2.4 4,-2.1 2,-0.2 5,-0.2 0.896 115.3 48.3 -65.2 -40.5 20.5 15.2 11.8 95 403 A Y H X S+ 0 0 29 -4,-1.9 4,-2.6 -5,-0.2 5,-0.2 0.951 110.6 50.4 -67.8 -47.6 21.5 17.3 14.7 96 404 A G H X S+ 0 0 0 -4,-3.4 4,-2.2 1,-0.2 -2,-0.2 0.899 112.4 45.8 -57.0 -41.9 17.9 17.8 15.9 97 405 A A H X S+ 0 0 0 -4,-2.1 4,-2.0 2,-0.2 5,-0.2 0.947 111.7 50.7 -70.7 -45.6 17.1 14.1 15.9 98 406 A K H X S+ 0 0 54 -4,-2.1 4,-1.9 1,-0.2 -1,-0.2 0.909 114.1 46.6 -56.6 -46.6 20.3 13.0 17.6 99 407 A H H X S+ 0 0 11 -4,-2.6 4,-2.9 2,-0.2 -1,-0.2 0.832 101.7 61.5 -66.9 -32.3 19.7 15.6 20.3 100 408 A A H < S+ 0 0 1 -4,-2.2 296,-0.4 1,-0.2 4,-0.2 0.954 111.8 42.3 -60.7 -38.8 16.0 14.6 20.8 101 409 A W H >< S+ 0 0 36 -4,-2.0 3,-1.2 2,-0.2 -2,-0.2 0.883 110.7 55.5 -66.4 -39.4 17.5 11.2 21.8 102 410 A R H 3< S+ 0 0 36 -4,-1.9 -2,-0.2 1,-0.3 -1,-0.2 0.892 111.6 45.4 -64.1 -33.0 20.3 13.0 23.8 103 411 A N T 3< S+ 0 0 10 -4,-2.9 2,-0.8 291,-0.2 289,-0.4 0.462 78.9 120.4 -89.6 -0.3 17.6 14.8 25.7 104 412 A A X - 0 0 27 -3,-1.2 3,-1.6 -4,-0.2 6,-0.1 -0.508 43.5-170.5 -71.8 104.9 15.4 11.7 26.3 105 413 A S T 3 S+ 0 0 23 -2,-0.8 262,-3.1 1,-0.3 -1,-0.2 0.715 80.7 55.2 -78.4 -14.7 15.3 11.6 30.1 106 414 A R T 3 S+ 0 0 81 260,-0.2 2,-0.5 264,-0.1 -1,-0.3 0.355 86.0 99.2 -96.6 4.9 13.7 8.3 30.2 107 415 A C X - 0 0 40 -3,-1.6 3,-0.8 -6,-0.2 264,-0.1 -0.855 43.7-175.8-108.5 117.7 16.3 6.4 28.1 108 416 A V T 3 S+ 0 0 25 -2,-0.5 3,-0.5 1,-0.2 -1,-0.1 0.673 82.3 68.6 -76.5 -16.7 19.0 4.3 29.7 109 417 A G T > + 0 0 31 1,-0.2 3,-1.7 2,-0.1 -1,-0.2 0.248 61.0 113.0 -90.3 12.1 20.4 3.8 26.3 110 418 A R G X + 0 0 0 -3,-0.8 3,-2.5 1,-0.3 4,-0.2 0.561 48.6 86.5 -77.3 -4.7 21.6 7.2 25.5 111 419 A I G 3 S+ 0 0 50 -3,-0.5 3,-0.3 1,-0.3 -1,-0.3 0.744 93.0 55.6 -58.4 -16.4 25.4 6.5 25.6 112 420 A Q G X S+ 0 0 48 -3,-1.7 3,-2.4 1,-0.2 -1,-0.3 0.514 73.8 113.4 -91.0 -6.8 24.6 5.7 22.0 113 421 A W T < S+ 0 0 44 -3,-2.5 -1,-0.2 1,-0.3 -11,-0.1 0.726 72.1 52.1 -39.6 -44.1 23.0 9.0 21.2 114 422 A S T 3 S+ 0 0 56 -3,-0.3 2,-1.1 -4,-0.2 -1,-0.3 0.724 97.7 68.1 -75.6 -18.1 25.6 10.2 18.7 115 423 A K < + 0 0 128 -3,-2.4 2,-0.4 -17,-0.1 34,-0.3 -0.686 69.4 135.0-101.2 75.3 25.5 7.1 16.5 116 424 A L - 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