==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=26-JAN-2011 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 21-JUN-10 3NLK . COMPND 2 MOLECULE: NITRIC OXIDE SYNTHASE, BRAIN; . SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS; . AUTHOR H.LI,S.L.DELKER,T.L.POULOS . 818 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 35421.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 549 67.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 19 2.3 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 90 11.0 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 . 68 8.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 90 11.0 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 . 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 . 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 . 11 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 . 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,-0.4 0, 0.0 19,-0.1 0.000 360.0 360.0 360.0 -73.4 21.3 28.1 40.1 2 300 A F - 0 0 145 17,-0.1 2,-0.4 13,-0.0 15,-0.2 -0.674 360.0-163.7 -76.6 129.2 24.1 25.5 40.3 3 301 A L E -A 16 0A 43 13,-1.9 13,-4.4 -2,-0.4 2,-0.3 -0.952 6.5-145.1-122.1 136.7 22.7 22.1 41.4 4 302 A K E -A 15 0A 135 -2,-0.4 2,-0.4 11,-0.2 11,-0.2 -0.754 7.5-164.9-100.2 139.3 24.7 19.1 42.8 5 303 A V E -A 14 0A 0 9,-2.9 9,-2.9 -2,-0.3 2,-0.4 -0.998 11.7-158.2-121.2 134.3 23.9 15.4 42.2 6 304 A K E -A 13 0A 57 -2,-0.4 380,-2.4 7,-0.2 2,-0.6 -0.852 15.5-145.5-112.3 141.4 25.6 12.8 44.4 7 305 A N B > -B 385 0B 2 5,-2.5 4,-1.9 -2,-0.4 378,-0.2 -0.950 13.7-160.2 -97.4 120.1 26.2 9.1 43.8 8 306 A W T 4 S+ 0 0 95 376,-2.7 377,-0.1 -2,-0.6 -1,-0.1 0.615 86.8 50.3 -81.4 -14.9 25.8 7.5 47.3 9 307 A E T 4 S+ 0 0 47 375,-0.3 -1,-0.2 372,-0.2 376,-0.1 0.844 127.1 21.8 -84.4 -41.1 27.8 4.3 46.4 10 308 A T T 4 S- 0 0 76 374,-0.1 -2,-0.2 2,-0.1 3,-0.1 0.575 93.3-130.1-103.9 -14.3 30.9 6.1 44.9 11 309 A D < + 0 0 110 -4,-1.9 2,-0.3 1,-0.3 -3,-0.1 0.543 53.0 152.2 65.5 10.2 30.6 9.6 46.5 12 310 A V - 0 0 59 -5,-0.2 -5,-2.5 -6,-0.0 2,-0.5 -0.576 28.5-161.0 -69.3 128.9 31.1 11.2 43.1 13 311 A V E -A 6 0A 75 -2,-0.3 2,-0.3 -7,-0.2 -7,-0.2 -0.971 6.1-169.5-111.9 127.2 29.4 14.7 43.1 14 312 A L E -A 5 0A 27 -9,-2.9 -9,-2.9 -2,-0.5 2,-0.5 -0.851 15.7-134.8-112.1 153.7 28.5 16.4 39.8 15 313 A T E -A 4 0A 60 -2,-0.3 2,-0.6 -11,-0.2 -11,-0.2 -0.925 14.6-149.5-111.0 126.6 27.3 20.0 39.3 16 314 A D E +A 3 0A 0 -13,-4.4 -13,-1.9 -2,-0.5 347,-0.2 -0.863 35.9 148.2-102.6 117.7 24.3 20.7 36.9 17 315 A T > + 0 0 55 345,-2.7 3,-1.3 -2,-0.6 4,-0.2 0.467 62.0 81.2-110.6 -12.3 24.2 23.9 35.0 18 316 A L G > S+ 0 0 8 344,-1.9 3,-2.0 1,-0.3 345,-0.2 0.815 77.1 70.6 -70.9 -28.1 22.4 22.5 32.0 19 317 A H G > S+ 0 0 23 343,-0.3 3,-2.0 1,-0.3 -1,-0.3 0.759 83.4 71.9 -58.5 -26.5 19.0 22.7 33.7 20 318 A L G < S+ 0 0 70 -3,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.717 91.3 58.3 -66.1 -18.4 19.1 26.5 33.4 21 319 A K G < S+ 0 0 154 -3,-2.0 -1,-0.3 -4,-0.2 2,-0.2 0.197 82.2 117.2 -91.7 13.4 18.6 26.2 29.7 22 320 A S < + 0 0 14 -3,-2.0 370,-0.2 1,-0.1 -3,-0.0 -0.600 32.3 170.1 -82.5 141.6 15.3 24.3 30.2 23 321 A T + 0 0 82 368,-1.0 -1,-0.1 -2,-0.2 369,-0.1 0.751 50.0 79.3-114.4 -46.2 12.0 25.9 28.9 24 322 A L B S-C 391 0C 55 367,-0.6 367,-0.5 1,-0.1 2,-0.2 -0.187 80.9-107.4 -64.8 153.4 9.2 23.3 29.1 25 323 A E - 0 0 131 1,-0.1 415,-0.2 365,-0.1 -1,-0.1 -0.522 13.9-149.7 -86.9 150.4 7.4 22.5 32.4 26 324 A T - 0 0 17 413,-2.6 414,-0.1 2,-0.2 3,-0.1 0.609 37.1-115.4 -93.6 -17.9 7.8 19.2 34.5 27 325 A G S S+ 0 0 27 1,-0.4 412,-0.1 412,-0.4 413,-0.1 -0.010 83.9 106.8 97.8 -28.7 4.4 18.8 36.2 28 326 A C - 0 0 4 410,-0.3 -1,-0.4 411,-0.1 2,-0.3 -0.315 48.5-169.0 -74.1 162.9 6.0 19.3 39.6 29 327 A T B > -D 32 0D 47 3,-2.7 3,-0.6 -3,-0.1 408,-0.3 -0.853 43.5 -95.7-136.1 175.6 5.6 22.4 41.8 30 328 A E T 3 S+ 0 0 57 -2,-0.3 405,-2.3 1,-0.2 406,-0.3 0.693 127.4 45.4 -65.7 -16.5 7.3 23.6 45.0 31 329 A H T 3 S+ 0 0 97 1,-0.2 771,-0.3 403,-0.2 2,-0.3 0.572 119.2 30.7-103.1 -9.3 4.4 22.0 46.9 32 330 A I B < -D 29 0D 10 -3,-0.6 -3,-2.7 769,-0.1 2,-0.6 -0.980 61.3-143.5-154.9 133.9 4.0 18.7 45.0 33 331 A C B +E 800 0E 11 767,-3.2 767,-2.0 -2,-0.3 3,-0.2 -0.889 14.2 177.1-100.5 124.0 6.2 16.1 43.2 34 332 A M > + 0 0 24 -2,-0.6 3,-2.5 765,-0.2 -1,-0.1 0.064 37.5 130.1-107.4 23.7 4.7 14.4 40.2 35 333 A G T 3 S+ 0 0 22 1,-0.3 334,-0.2 765,-0.1 -1,-0.1 0.630 73.7 45.9 -58.2 -18.6 7.9 12.4 39.4 36 334 A S T 3 S+ 0 0 17 762,-0.5 2,-0.4 -3,-0.2 -1,-0.3 0.284 82.1 111.1-109.3 11.1 6.0 9.1 39.1 37 335 A I < - 0 0 14 -3,-2.5 -3,-0.1 1,-0.2 377,-0.0 -0.720 60.6-148.1 -79.1 128.6 3.1 10.3 37.0 38 336 A M S S+ 0 0 60 -2,-0.4 -1,-0.2 1,-0.3 -4,-0.0 0.936 91.0 20.8 -65.1 -44.4 3.4 8.7 33.5 39 337 A L 0 0 104 -3,-0.1 -1,-0.3 -12,-0.0 -12,-0.0 -0.727 360.0 360.0-124.0 81.0 1.8 11.7 31.6 40 338 A P 0 0 97 0, 0.0 -13,-0.1 0, 0.0 -12,-0.1 -0.132 360.0 360.0 -79.1 360.0 2.1 14.8 33.8 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 0 112 0, 0.0 4,-1.7 0, 0.0 5,-0.1 0.000 360.0 360.0 360.0 170.6 1.3 30.7 15.2 43 351 A K H > + 0 0 76 1,-0.2 4,-1.2 2,-0.2 37,-0.0 0.867 360.0 52.2 -53.4 -40.8 3.8 33.0 13.5 44 352 A D H 4 S+ 0 0 135 1,-0.2 -1,-0.2 2,-0.2 3,-0.1 0.883 111.3 43.5 -64.2 -46.5 4.4 34.6 16.9 45 353 A Q H > S+ 0 0 119 1,-0.2 4,-0.9 2,-0.1 -1,-0.2 0.779 109.6 59.0 -71.8 -28.1 5.1 31.3 18.7 46 354 A L H X S+ 0 0 18 -4,-1.7 4,-2.2 1,-0.2 -1,-0.2 0.833 95.3 58.2 -78.0 -35.0 7.3 29.9 16.0 47 355 A F H X S+ 0 0 53 -4,-1.2 4,-2.9 2,-0.2 5,-0.2 0.927 104.3 46.6 -71.1 -45.5 10.1 32.5 15.7 48 356 A P H > S+ 0 0 79 0, 0.0 4,-2.7 0, 0.0 5,-0.2 0.944 114.4 52.3 -57.2 -41.0 11.5 32.4 19.3 49 357 A L H X S+ 0 0 58 -4,-0.9 4,-2.1 1,-0.2 -2,-0.2 0.908 111.5 44.7 -57.3 -45.3 11.4 28.6 19.0 50 358 A A H X S+ 0 0 0 -4,-2.2 4,-3.2 2,-0.2 5,-0.2 0.920 113.7 50.1 -66.3 -45.5 13.4 28.7 15.7 51 359 A K H X S+ 0 0 89 -4,-2.9 4,-2.2 1,-0.2 -2,-0.2 0.873 109.9 50.5 -62.3 -39.9 15.9 31.3 17.0 52 360 A E H X S+ 0 0 58 -4,-2.7 4,-1.8 -5,-0.2 -1,-0.2 0.937 114.2 44.8 -64.3 -45.1 16.5 29.3 20.2 53 361 A F H X S+ 0 0 3 -4,-2.1 4,-2.4 -5,-0.2 -2,-0.2 0.945 114.2 47.7 -62.9 -49.7 17.1 26.1 18.1 54 362 A L H X S+ 0 0 0 -4,-3.2 4,-2.9 1,-0.2 5,-0.2 0.860 109.1 54.8 -62.0 -37.3 19.4 27.9 15.5 55 363 A D H X S+ 0 0 27 -4,-2.2 4,-2.0 -5,-0.2 -1,-0.2 0.928 111.3 44.1 -60.9 -45.5 21.4 29.6 18.3 56 364 A Q H X S+ 0 0 49 -4,-1.8 4,-1.8 2,-0.2 -2,-0.2 0.883 114.8 50.5 -70.9 -34.8 22.1 26.2 19.9 57 365 A Y H X S+ 0 0 23 -4,-2.4 4,-1.4 2,-0.2 -2,-0.2 0.965 111.9 44.9 -61.7 -52.6 22.9 24.7 16.5 58 366 A Y H <>S+ 0 0 29 -4,-2.9 5,-3.3 1,-0.3 6,-0.4 0.831 113.6 50.9 -68.0 -32.6 25.3 27.4 15.4 59 367 A S H ><5S+ 0 0 63 -4,-2.0 3,-1.5 4,-0.3 -1,-0.3 0.848 103.8 58.9 -65.9 -37.3 27.0 27.3 18.8 60 368 A S H 3<5S+ 0 0 59 -4,-1.8 -2,-0.2 1,-0.3 -1,-0.2 0.816 109.7 43.0 -64.7 -31.1 27.4 23.5 18.5 61 369 A I T 3<5S- 0 0 72 -4,-1.4 -1,-0.3 -5,-0.1 -2,-0.2 0.164 120.0-111.6 -96.7 16.3 29.4 23.9 15.3 62 370 A K T < 5S+ 0 0 192 -3,-1.5 -3,-0.2 -5,-0.1 -2,-0.1 0.837 90.9 108.6 56.8 43.8 31.4 26.8 16.8 63 371 A R > < + 0 0 142 -5,-3.3 3,-2.4 -6,-0.1 6,-0.4 0.031 38.7 157.7-132.5 22.8 29.9 29.5 14.6 64 372 A F T 3 S+ 0 0 138 -6,-0.4 3,-0.1 1,-0.3 -9,-0.1 -0.315 76.7 0.6 -54.2 122.8 27.7 31.3 17.1 65 373 A G T 3 S+ 0 0 42 1,-0.2 -1,-0.3 -2,-0.1 -10,-0.0 0.561 100.1 138.3 74.0 8.9 27.0 34.8 15.9 66 374 A S S <> S- 0 0 36 -3,-2.4 4,-2.0 -8,-0.1 5,-0.2 -0.047 73.7 -94.1 -71.0-177.8 29.0 34.3 12.7 67 375 A K H > S+ 0 0 158 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.985 127.1 50.6 -63.4 -49.1 27.9 35.6 9.3 68 376 A A H > S+ 0 0 41 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.801 109.1 52.6 -53.0 -44.6 26.3 32.2 8.4 69 377 A H H > S+ 0 0 0 -6,-0.4 4,-2.3 2,-0.2 3,-0.3 0.990 112.7 41.2 -57.8 -60.2 24.4 32.1 11.8 70 378 A M H X S+ 0 0 90 -4,-2.0 4,-2.4 1,-0.2 -2,-0.2 0.829 114.1 54.7 -59.1 -39.2 22.8 35.6 11.4 71 379 A D H X S+ 0 0 83 -4,-2.7 4,-2.1 2,-0.2 -1,-0.2 0.888 108.0 48.1 -58.6 -45.4 22.1 34.9 7.7 72 380 A R H X S+ 0 0 8 -4,-2.2 4,-2.9 -3,-0.3 5,-0.3 0.911 109.6 53.9 -65.6 -40.7 20.2 31.7 8.5 73 381 A L H X S+ 0 0 21 -4,-2.3 4,-2.8 1,-0.2 -2,-0.2 0.937 110.1 45.8 -59.0 -48.3 18.2 33.5 11.2 74 382 A E H X S+ 0 0 107 -4,-2.4 4,-2.5 2,-0.2 -1,-0.2 0.919 113.7 50.9 -61.4 -39.8 17.1 36.3 8.7 75 383 A E H X S+ 0 0 97 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.917 114.0 42.1 -63.7 -47.8 16.2 33.5 6.1 76 384 A V H X S+ 0 0 0 -4,-2.9 4,-2.7 2,-0.2 5,-0.2 0.929 114.1 53.4 -62.7 -45.1 14.1 31.5 8.5 77 385 A N H X S+ 0 0 39 -4,-2.8 4,-2.3 -5,-0.3 -2,-0.2 0.872 110.6 46.8 -56.8 -45.2 12.5 34.7 9.8 78 386 A K H X S+ 0 0 144 -4,-2.5 4,-1.2 2,-0.2 -1,-0.2 0.925 112.4 48.7 -63.4 -46.0 11.6 35.7 6.3 79 387 A E H X S+ 0 0 51 -4,-2.1 4,-3.3 1,-0.2 6,-0.5 0.828 112.8 48.0 -65.4 -36.5 10.1 32.3 5.5 80 388 A I H X S+ 0 0 4 -4,-2.7 4,-1.5 3,-0.2 -1,-0.2 0.902 110.1 52.9 -66.4 -44.4 8.1 32.3 8.7 81 389 A E H < S+ 0 0 125 -4,-2.3 -2,-0.2 -5,-0.2 -1,-0.2 0.734 122.8 29.4 -62.6 -24.0 6.9 35.8 7.9 82 390 A S H < S+ 0 0 95 -4,-1.2 -2,-0.2 3,-0.2 -3,-0.2 0.838 132.5 25.8-106.0 -47.4 5.7 34.6 4.5 83 391 A T H < S- 0 0 68 -4,-3.3 -3,-0.2 2,-0.4 -2,-0.1 0.572 92.0-126.9 -98.4 -11.5 4.7 30.9 4.7 84 392 A S S < S+ 0 0 68 -4,-1.5 2,-0.2 -5,-0.5 -4,-0.2 0.304 89.1 46.2 75.6 -7.3 3.9 30.7 8.4 85 393 A T S S- 0 0 38 -6,-0.5 -2,-0.4 -9,-0.0 2,-0.3 -0.772 73.9-143.2-137.6-171.9 6.3 27.8 8.7 86 394 A Y - 0 0 0 -2,-0.2 2,-0.4 -3,-0.1 -10,-0.1 -0.967 13.3-115.7-151.8 171.1 9.8 26.9 7.6 87 395 A Q - 0 0 89 -2,-0.3 2,-0.2 182,-0.0 -8,-0.1 -0.930 24.2-131.0-114.8 133.4 12.0 24.1 6.4 88 396 A L - 0 0 7 -2,-0.4 2,-0.1 1,-0.1 179,-0.0 -0.563 22.5-121.5 -75.5 141.1 15.0 22.6 8.2 89 397 A K > - 0 0 98 -2,-0.2 4,-2.3 1,-0.1 3,-0.3 -0.470 31.6-108.0 -71.4 159.0 18.3 22.1 6.3 90 398 A D H > S+ 0 0 98 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.890 120.8 54.2 -58.9 -43.1 19.5 18.5 6.3 91 399 A T H > S+ 0 0 78 1,-0.2 4,-2.3 2,-0.2 -1,-0.2 0.884 110.7 46.7 -57.1 -40.0 22.3 19.3 8.7 92 400 A E H > S+ 0 0 1 -3,-0.3 4,-2.6 2,-0.2 -2,-0.2 0.843 109.6 53.0 -71.5 -39.6 19.7 20.8 11.2 93 401 A L H X S+ 0 0 2 -4,-2.3 4,-2.2 2,-0.2 -2,-0.2 0.912 112.0 46.2 -60.4 -45.4 17.3 17.9 10.9 94 402 A I H X S+ 0 0 68 -4,-2.4 4,-2.0 2,-0.2 -2,-0.2 0.918 115.2 45.7 -63.7 -47.3 20.2 15.5 11.7 95 403 A Y H X S+ 0 0 29 -4,-2.3 4,-2.3 2,-0.2 -2,-0.2 0.898 112.7 51.7 -61.1 -43.0 21.4 17.6 14.7 96 404 A G H X S+ 0 0 0 -4,-2.6 4,-1.9 1,-0.2 -2,-0.2 0.890 111.2 46.3 -67.3 -40.6 17.8 18.0 15.9 97 405 A A H X S+ 0 0 0 -4,-2.2 4,-1.5 2,-0.2 -1,-0.2 0.882 112.6 49.3 -67.0 -39.8 17.1 14.3 15.8 98 406 A K H X S+ 0 0 53 -4,-2.0 4,-2.6 1,-0.2 -2,-0.2 0.909 114.1 47.6 -67.3 -37.9 20.4 13.4 17.6 99 407 A H H X S+ 0 0 13 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.845 103.3 58.4 -74.4 -31.0 19.7 15.9 20.2 100 408 A A H < S+ 0 0 0 -4,-1.9 296,-0.5 2,-0.2 4,-0.2 0.881 112.8 42.7 -63.9 -37.9 16.1 14.9 20.9 101 409 A W H >< S+ 0 0 36 -4,-1.5 3,-1.9 2,-0.2 -2,-0.2 0.945 111.7 53.8 -67.9 -49.1 17.5 11.4 21.7 102 410 A R H 3< S+ 0 0 33 -4,-2.6 -2,-0.2 1,-0.3 -1,-0.2 0.873 112.9 45.7 -49.5 -36.5 20.3 13.1 23.7 103 411 A N T 3< S+ 0 0 9 -4,-2.4 2,-1.0 291,-0.2 289,-0.4 0.453 78.8 118.0 -90.5 -2.2 17.6 14.9 25.6 104 412 A A X - 0 0 27 -3,-1.9 3,-2.0 -4,-0.2 6,-0.1 -0.522 45.7-168.0 -72.7 98.2 15.3 11.9 26.2 105 413 A S T 3 S+ 0 0 22 -2,-1.0 262,-2.7 1,-0.3 -1,-0.2 0.741 81.6 53.9 -68.3 -19.2 15.3 11.8 30.0 106 414 A R T 3 S+ 0 0 52 260,-0.2 2,-0.6 264,-0.1 -1,-0.3 0.356 87.1 100.2 -92.6 3.1 13.7 8.3 30.3 107 415 A C X - 0 0 37 -3,-2.0 3,-0.7 -6,-0.2 264,-0.1 -0.832 44.9-176.6-100.8 117.1 16.2 6.6 28.0 108 416 A V T 3 S+ 0 0 23 -2,-0.6 3,-0.4 1,-0.2 -1,-0.1 0.652 79.5 68.9 -76.5 -15.5 19.0 4.6 29.6 109 417 A G T > + 0 0 29 1,-0.2 3,-1.3 2,-0.1 -1,-0.2 0.194 61.1 114.1 -92.3 18.5 20.6 3.9 26.2 110 418 A R G X + 0 0 0 -3,-0.7 3,-2.8 1,-0.3 4,-0.2 0.624 48.4 86.9 -74.4 -11.1 21.8 7.5 25.4 111 419 A I G 3 S+ 0 0 47 -3,-0.4 3,-0.3 1,-0.3 -1,-0.3 0.803 93.6 52.4 -51.1 -24.7 25.6 6.8 25.5 112 420 A Q G X S+ 0 0 50 -3,-1.3 3,-2.6 1,-0.2 -1,-0.3 0.346 75.5 117.7 -89.2 -0.6 24.9 5.9 21.8 113 421 A W T < S+ 0 0 39 -3,-2.8 -1,-0.2 1,-0.3 -11,-0.2 0.717 70.4 51.8 -53.5 -34.0 23.1 9.2 21.0 114 422 A S T 3 S+ 0 0 57 -3,-0.3 2,-0.9 -4,-0.2 -1,-0.3 0.624 97.2 71.7 -82.2 -7.9 25.6 10.6 18.4 115 423 A K < + 0 0 120 -3,-2.6 2,-0.4 -17,-0.1 34,-0.3 -0.816 67.0 130.2-106.0 86.8 25.5 7.3 16.3 116 424 A L - 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0 0 26 -5,-2.4 2,-0.8 1,-0.1 -1,-0.2 -0.366 44.9 -99.2 -74.2 156.9 27.6 -19.5 39.2 720 617 B D + 0 0 58 1,-0.1 8,-0.4 6,-0.1 3,-0.3 -0.697 46.4 171.8 -75.4 108.9 29.2 -18.3 35.9 721 618 B M + 0 0 51 -2,-0.8 -1,-0.1 1,-0.2 3,-0.1 0.395 51.1 93.8-104.2 0.5 30.8 -15.1 37.0 722 619 B R S S+ 0 0 217 1,-0.1 2,-0.3 2,-0.0 -1,-0.2 0.760 93.7 27.2 -64.2 -30.0 32.8 -14.3 33.9 723 620 B K > - 0 0 89 -3,-0.3 3,-1.5 1,-0.1 5,-0.4 -0.999 68.2-134.6-139.5 141.8 30.1 -12.1 32.4 724 621 B T G > S+ 0 0 60 -2,-0.3 3,-2.5 1,-0.2 5,-0.3 0.833 99.8 72.2 -58.5 -32.2 27.3 -9.9 33.8 725 622 B S G 3 S+ 0 0 13 1,-0.3 -1,-0.2 2,-0.1 -394,-0.1 0.518 80.5 71.0 -71.0 -6.3 24.8 -11.3 31.3 726 623 B S G < S- 0 0 16 -3,-1.5 -1,-0.3 -6,-0.2 -2,-0.2 0.568 101.8-135.9 -75.6 -11.4 24.7 -14.7 33.1 727 624 B L <> + 0 0 0 -3,-2.5 4,-2.4 -4,-0.2 5,-0.2 0.785 51.8 151.3 56.4 32.7 22.8 -12.7 35.8 728 625 B W H > S+ 0 0 15 -5,-0.4 4,-2.4 -8,-0.4 5,-0.2 0.860 70.1 54.1 -57.4 -36.5 24.8 -14.3 38.5 729 626 B K H > S+ 0 0 54 -5,-0.3 4,-1.7 1,-0.2 -1,-0.2 0.938 110.0 46.0 -62.8 -44.0 24.3 -11.2 40.6 730 627 B D H > S+ 0 0 0 2,-0.2 4,-1.8 1,-0.2 -2,-0.2 0.860 112.6 51.7 -66.3 -38.6 20.6 -11.4 40.3 731 628 B Q H X S+ 0 0 22 -4,-2.4 4,-1.5 1,-0.2 -2,-0.2 0.935 111.8 44.1 -64.4 -49.8 20.6 -15.2 41.0 732 629 B A H X S+ 0 0 0 -4,-2.4 4,-2.0 1,-0.2 -1,-0.2 0.810 109.3 60.2 -64.1 -30.5 22.6 -14.9 44.2 733 630 B L H X S+ 0 0 0 -4,-1.7 4,-1.7 -5,-0.2 -1,-0.2 0.931 104.2 47.0 -66.1 -48.1 20.5 -11.9 45.2 734 631 B V H X S+ 0 0 5 -4,-1.8 4,-2.1 1,-0.2 -1,-0.2 0.888 111.2 52.9 -60.1 -39.7 17.2 -13.9 45.2 735 632 B E H X S+ 0 0 22 -4,-1.5 4,-2.3 1,-0.2 -1,-0.2 0.902 107.4 50.2 -65.4 -41.1 18.8 -16.8 47.2 736 633 B I H X S+ 0 0 0 -4,-2.0 4,-2.0 1,-0.2 -1,-0.2 0.872 111.4 50.1 -63.1 -37.8 20.1 -14.5 50.0 737 634 B N H X S+ 0 0 1 -4,-1.7 4,-1.9 2,-0.2 -2,-0.2 0.827 108.1 51.0 -74.3 -33.3 16.6 -13.0 50.3 738 635 B I H X S+ 0 0 12 -4,-2.1 4,-2.9 2,-0.2 5,-0.2 0.919 111.1 51.7 -59.8 -48.1 14.9 -16.4 50.5 739 636 B A H X S+ 0 0 0 -4,-2.3 4,-2.4 2,-0.2 -89,-0.5 0.888 107.8 50.1 -56.6 -44.7 17.4 -17.2 53.2 740 637 B V H X S+ 0 0 0 -4,-2.0 4,-2.1 2,-0.2 5,-0.2 0.955 115.1 42.8 -62.5 -47.7 16.6 -14.0 55.2 741 638 B L H X S+ 0 0 1 -4,-1.9 4,-2.7 1,-0.2 5,-0.2 0.943 114.6 50.2 -65.7 -47.5 12.9 -14.6 55.1 742 639 B Y H X S+ 0 0 90 -4,-2.9 4,-2.3 1,-0.2 -1,-0.2 0.878 110.8 49.7 -55.1 -43.1 13.2 -18.4 55.9 743 640 B S H X S+ 0 0 0 -4,-2.4 4,-1.3 -93,-0.3 -1,-0.2 0.910 112.4 45.8 -68.4 -45.3 15.5 -17.7 58.9 744 641 B F H <>S+ 0 0 0 -4,-2.1 5,-2.5 2,-0.2 4,-0.2 0.925 114.6 48.3 -59.8 -48.6 13.2 -15.1 60.5 745 642 B Q H ><5S+ 0 0 71 -4,-2.7 3,-1.0 1,-0.2 -2,-0.2 0.887 109.3 52.3 -61.5 -42.4 10.1 -17.3 59.9 746 643 B S H 3<5S+ 0 0 53 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.811 113.2 44.6 -61.7 -34.8 11.7 -20.4 61.4 747 644 B D T 3<5S- 0 0 64 -4,-1.3 -1,-0.2 -3,-0.2 -2,-0.2 0.345 113.6-119.5 -94.1 5.3 12.7 -18.5 64.5 748 645 B K T < 5 + 0 0 175 -3,-1.0 2,-0.5 -4,-0.2 -3,-0.2 0.867 62.0 146.8 61.2 39.9 9.3 -16.8 64.8 749 646 B V < - 0 0 7 -5,-2.5 -1,-0.2 -6,-0.1 -192,-0.2 -0.934 56.7-104.7-106.5 125.4 10.6 -13.3 64.5 750 647 B T + 0 0 38 -194,-2.7 -59,-0.6 -2,-0.5 2,-0.3 -0.235 54.5 152.3 -54.9 130.4 8.2 -11.0 62.7 751 648 B I E -h 691 0X 25 -61,-0.1 2,-0.4 -193,-0.0 -59,-0.2 -0.965 29.1-148.7-150.7 155.6 9.2 -10.1 59.1 752 649 B V E -h 692 0X 32 -61,-2.0 -59,-2.7 -2,-0.3 2,-0.2 -0.986 15.6-133.3-127.4 138.6 7.3 -9.2 55.9 753 650 B D > - 0 0 12 -2,-0.4 4,-2.5 -61,-0.2 5,-0.2 -0.492 28.6-110.3 -83.6 164.6 8.3 -10.0 52.3 754 651 B H H > S+ 0 0 1 2,-0.2 4,-1.6 1,-0.2 5,-0.2 0.759 114.6 55.8 -69.6 -25.3 8.2 -7.3 49.6 755 652 B H H > S+ 0 0 13 2,-0.2 4,-1.9 1,-0.1 -1,-0.2 0.957 113.3 39.6 -68.3 -49.8 5.2 -8.8 47.8 756 653 B S H > S+ 0 0 37 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.907 115.6 51.7 -68.0 -41.2 3.0 -8.8 50.8 757 654 B A H X S+ 0 0 9 -4,-2.5 4,-1.8 1,-0.2 -1,-0.2 0.884 112.5 45.3 -65.4 -37.7 4.2 -5.4 52.1 758 655 B T H X S+ 0 0 0 -4,-1.6 4,-1.9 2,-0.2 -1,-0.2 0.883 110.4 53.0 -74.8 -38.7 3.6 -3.7 48.8 759 656 B E H X S+ 0 0 99 -4,-1.9 4,-1.8 2,-0.2 -2,-0.2 0.921 110.8 48.8 -58.9 -47.3 0.2 -5.3 48.3 760 657 B S H X S+ 0 0 35 -4,-2.3 4,-2.8 1,-0.2 -2,-0.2 0.874 107.8 55.1 -58.5 -41.9 -0.8 -4.0 51.8 761 658 B F H X S+ 0 0 1 -4,-1.8 4,-2.8 2,-0.2 -1,-0.2 0.881 105.0 51.2 -60.6 -40.8 0.5 -0.6 50.9 762 659 B I H X S+ 0 0 17 -4,-1.9 4,-2.6 2,-0.2 5,-0.2 0.941 112.1 47.5 -62.6 -47.2 -1.8 -0.3 47.8 763 660 B K H X S+ 0 0 117 -4,-1.8 4,-2.3 1,-0.2 -2,-0.2 0.932 113.1 49.5 -56.7 -44.8 -4.8 -1.3 50.0 764 661 B H H X S+ 0 0 7 -4,-2.8 4,-2.7 1,-0.2 -2,-0.2 0.919 111.1 49.5 -60.6 -42.1 -3.7 1.3 52.6 765 662 B M H X S+ 0 0 0 -4,-2.8 4,-2.2 2,-0.2 -2,-0.2 0.903 110.0 49.1 -67.7 -43.0 -3.3 3.9 49.9 766 663 B E H X S+ 0 0 41 -4,-2.6 4,-2.1 2,-0.2 -1,-0.2 0.930 113.0 48.2 -58.7 -48.8 -6.8 3.3 48.3 767 664 B N H X S+ 0 0 95 -4,-2.3 4,-3.0 1,-0.2 5,-0.3 0.917 110.8 51.1 -58.3 -48.1 -8.3 3.5 51.8 768 665 B E H X>S+ 0 0 3 -4,-2.7 4,-2.3 2,-0.2 6,-1.4 0.852 108.1 52.1 -55.8 -41.4 -6.4 6.7 52.6 769 666 B Y H X5S+ 0 0 12 -4,-2.2 4,-1.2 4,-0.3 -2,-0.2 0.941 114.3 44.0 -61.7 -45.1 -7.6 8.3 49.4 770 667 B R H <5S+ 0 0 165 -4,-2.1 -2,-0.2 1,-0.2 -3,-0.1 0.944 126.4 27.8 -65.0 -52.8 -11.3 7.4 50.2 771 668 B C H <5S+ 0 0 84 -4,-3.0 -3,-0.2 -5,-0.1 -2,-0.2 0.758 135.3 26.8 -81.8 -28.4 -11.3 8.4 53.9 772 669 B R H <5S- 0 0 47 -4,-2.3 -3,-0.2 -5,-0.3 -2,-0.2 0.553 99.5-114.9-114.4 -14.2 -8.6 11.2 54.0 773 670 B G S <> - 0 0 9 -262,-2.5 4,-2.5 -2,-0.3 3,-1.4 -0.855 12.4-165.9-108.2 100.7 7.5 8.7 47.4 779 676 B W H 3> S+ 0 0 19 -2,-0.8 4,-2.3 1,-0.3 -1,-0.2 0.837 85.1 61.8 -60.1 -39.3 7.7 6.2 44.6 780 677 B V H 34 S+ 0 0 19 1,-0.2 -1,-0.3 -336,-0.2 -335,-0.1 0.817 116.9 32.3 -54.6 -35.2 11.5 6.2 44.5 781 678 B W H <4 S+ 0 0 102 -3,-1.4 -2,-0.2 -265,-0.1 -1,-0.2 0.799 114.7 56.0 -93.8 -34.4 11.5 4.9 48.1 782 679 B I H < S+ 0 0 2 -4,-2.5 -2,-0.2 -266,-0.1 -3,-0.2 0.886 88.1 83.5 -70.0 -43.1 8.3 2.8 48.1 783 680 B V S < S- 0 0 15 -4,-2.3 5,-0.1 -5,-0.2 6,-0.1 -0.484 91.3-114.4 -63.3 124.3 9.3 0.5 45.2 784 681 B P - 0 0 7 0, 0.0 -407,-0.2 0, 0.0 4,-0.2 -0.147 17.8-115.2 -62.8 155.4 11.5 -2.3 46.6 785 682 B P S S+ 0 0 12 0, 0.0 -407,-2.0 0, 0.0 -406,-0.4 0.430 98.6 43.8 -78.7 1.4 15.2 -2.6 45.6 786 683 B M S S+ 0 0 3 -410,-0.2 -411,-0.1 -409,-0.2 -92,-0.1 -0.981 116.8 9.1-133.2 155.5 14.6 -5.9 43.9 787 684 B S S > S+ 0 0 5 -2,-0.3 3,-1.6 -468,-0.1 4,-0.4 0.752 71.7 172.7 56.8 30.6 11.9 -7.2 41.5 788 685 B G G > + 0 0 6 1,-0.2 3,-1.9 -415,-0.2 6,-0.6 0.847 69.1 42.4 -32.5 -68.0 10.3 -3.7 41.2 789 686 B S G 3 S+ 0 0 2 -415,-1.8 -1,-0.2 1,-0.3 -414,-0.1 0.564 103.1 66.2 -75.7 -5.9 7.7 -4.3 38.5 790 687 B I G < S+ 0 0 21 -3,-1.6 -1,-0.3 -416,-0.4 -2,-0.2 0.418 92.5 76.5 -87.3 3.3 6.5 -7.7 39.9 791 688 B T S X S- 0 0 0 -3,-1.9 3,-1.0 -4,-0.4 4,-0.5 -0.859 89.2-125.8-107.5 146.7 5.2 -5.7 42.9 792 689 B P G > S+ 0 0 34 0, 0.0 3,-0.6 0, 0.0 4,-0.2 0.749 103.2 68.6 -70.6 -19.3 1.9 -3.7 42.5 793 690 B V G > S+ 0 0 0 1,-0.2 3,-1.5 2,-0.2 -10,-0.1 0.818 87.0 66.9 -66.0 -31.7 3.5 -0.4 43.7 794 691 B F G < S+ 0 0 33 -3,-1.0 -1,-0.2 -6,-0.6 -5,-0.1 0.863 105.6 43.7 -52.4 -39.4 5.7 -0.2 40.5 795 692 B H G < S+ 0 0 14 -3,-0.6 -378,-2.6 -4,-0.5 2,-0.6 0.357 95.5 98.5 -90.7 1.6 2.5 0.3 38.5 796 693 B Q B < -U 416 0P 4 -3,-1.5 -380,-0.2 -380,-0.2 2,-0.2 -0.829 67.9-138.5 -97.1 119.2 0.9 2.8 40.9 797 694 B E - 0 0 12 -382,-2.0 2,-0.3 -2,-0.6 -760,-0.1 -0.532 29.3-171.3 -66.8 142.4 1.1 6.5 40.2 798 695 B M - 0 0 1 -2,-0.2 -762,-0.5 -21,-0.1 2,-0.4 -0.915 19.3-139.9-135.7 157.1 1.9 8.4 43.5 799 696 B L B -i 776 0Y 0 -24,-0.5 -22,-2.6 -2,-0.3 2,-0.5 -0.989 15.5-152.3-120.8 131.2 1.9 12.1 44.6 800 697 B N B +E 33 0E 32 -767,-2.0 -767,-3.2 -2,-0.4 2,-0.3 -0.923 30.2 140.8-111.6 128.9 4.6 13.3 47.0 801 698 B Y - 0 0 1 -2,-0.5 2,-0.6 -769,-0.2 -285,-0.1 -0.962 46.7-105.3-159.6 161.0 4.0 16.2 49.3 802 699 B R + 0 0 90 -369,-0.4 -370,-0.8 -771,-0.3 -369,-0.6 -0.853 33.6 177.0-105.7 118.9 4.9 17.2 52.9 803 700 B L - 0 0 13 -2,-0.6 -372,-0.1 -289,-0.4 -289,-0.1 -0.849 28.3 -96.6-113.2 152.2 2.3 17.1 55.6 804 701 B T S S+ 0 0 20 -2,-0.3 2,-0.2 2,-0.1 -127,-0.1 -0.918 96.7 57.6-115.5 149.5 2.8 17.9 59.4 805 702 B P S S+ 0 0 1 0, 0.0 2,-0.3 0, 0.0 -128,-0.2 0.487 88.7 164.2 -56.2 155.2 3.2 16.3 61.9 806 703 B S E -F 676 0W 11 -130,-1.7 -130,-2.8 -2,-0.2 2,-0.5 -0.978 45.8-122.6-148.4 157.4 6.3 14.9 60.3 807 704 B F E -F 675 0W 29 -296,-0.5 2,-0.3 -2,-0.3 -132,-0.2 -0.924 38.9-176.5 -94.8 131.6 9.6 13.0 60.7 808 705 B E E -F 674 0W 44 -134,-3.0 -134,-3.1 -2,-0.5 2,-0.1 -0.883 26.1-110.5-126.2 156.4 12.6 15.0 59.3 809 706 B Y - 0 0 105 -2,-0.3 -136,-0.1 -136,-0.2 -361,-0.0 -0.419 32.3-169.4 -73.6 157.5 16.3 14.5 58.9 810 707 B Q - 0 0 25 -138,-0.4 -138,-0.0 -2,-0.1 0, 0.0 -0.963 32.5 -85.5-143.9 158.4 18.7 16.4 61.1 811 708 B P - 0 0 80 0, 0.0 5,-0.1 0, 0.0 0, 0.0 -0.311 54.4 -92.8 -64.1 150.3 22.5 16.8 60.9 812 709 B D >> - 0 0 58 1,-0.1 3,-1.3 2,-0.1 4,-0.6 -0.411 36.5-128.3 -58.5 137.2 24.6 14.1 62.6 813 710 B P H >> S+ 0 0 3 0, 0.0 4,-3.0 0, 0.0 3,-0.9 0.815 103.4 66.2 -67.2 -30.5 25.3 15.4 66.1 814 711 B W H 34 S+ 0 0 46 1,-0.2 -2,-0.1 2,-0.2 -236,-0.0 0.760 101.8 53.7 -61.3 -21.2 29.1 15.0 66.0 815 712 B N H <4 S+ 0 0 119 -3,-1.3 -1,-0.2 1,-0.1 -3,-0.1 0.782 121.9 24.4 -78.5 -28.0 29.0 17.7 63.4 816 713 B T H << S+ 0 0 84 -3,-0.9 -2,-0.2 -4,-0.6 -1,-0.1 0.683 89.9 117.0-110.4 -26.6 27.1 20.3 65.4 817 714 B H < - 0 0 24 -4,-3.0 2,-0.8 -5,-0.1 -245,-0.0 -0.171 57.6-137.4 -59.3 133.8 27.7 19.4 69.1 818 715 B V - 0 0 116 -187,-0.1 2,-0.3 -246,-0.1 -1,-0.1 -0.818 24.3-136.7 -87.9 106.3 29.5 21.9 71.4 819 716 B W - 0 0 113 -2,-0.8 -187,-0.1 1,-0.1 -1,-0.0 -0.480 21.0-174.2 -68.3 124.8 31.9 19.8 73.4 820 717 B K 0 0 117 -2,-0.3 -1,-0.1 0, 0.0 -188,-0.0 0.759 360.0 360.0 -92.5 -26.0 31.9 20.8 77.1 821 718 B G 0 0 127 0, 0.0 -2,-0.1 0, 0.0 0, 0.0 0.603 360.0 360.0 81.6 360.0 34.8 18.5 78.3