==== 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 3NLP . 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) . 35336.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 550 67.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 17 2.1 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 . 70 8.6 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 91 11.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 225 27.5 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 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 . 2 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 . 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 . 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 0 212 0, 0.0 2,-0.4 0, 0.0 19,-0.1 0.000 360.0 360.0 360.0 -46.9 20.7 27.8 40.7 2 300 A F - 0 0 138 17,-0.1 2,-0.4 18,-0.0 15,-0.2 -0.861 360.0-159.4 -99.5 145.2 23.6 25.3 40.6 3 301 A L E -A 16 0A 40 13,-1.7 13,-4.0 -2,-0.4 2,-0.3 -0.974 9.6-146.1-136.9 137.8 22.7 21.8 41.8 4 302 A K E -A 15 0A 133 -2,-0.4 2,-0.4 11,-0.2 11,-0.2 -0.764 5.9-161.4-102.6 143.8 24.6 18.8 43.0 5 303 A V E -A 14 0A 0 9,-2.8 9,-2.8 -2,-0.3 2,-0.4 -0.994 11.8-155.8-120.9 135.7 23.8 15.1 42.5 6 304 A K E -A 13 0A 56 -2,-0.4 380,-2.2 7,-0.2 2,-0.6 -0.896 13.4-146.1-111.5 138.6 25.3 12.5 44.7 7 305 A N B > -B 385 0B 5 5,-2.0 4,-2.0 -2,-0.4 378,-0.2 -0.941 13.9-159.3 -97.1 120.4 25.9 8.8 44.0 8 306 A W T 4 S+ 0 0 93 376,-2.8 377,-0.1 -2,-0.6 -1,-0.1 0.359 87.2 51.6 -87.3 1.7 25.4 7.2 47.4 9 307 A E T 4 S+ 0 0 44 375,-0.3 -1,-0.2 372,-0.1 376,-0.1 0.695 126.7 21.6-101.2 -37.2 27.4 4.0 46.6 10 308 A T T 4 S- 0 0 78 374,-0.2 -2,-0.2 2,-0.1 3,-0.1 0.548 92.0-132.1-108.8 -9.7 30.5 5.8 45.3 11 309 A D < + 0 0 107 -4,-2.0 2,-0.3 1,-0.2 -3,-0.1 0.462 53.4 152.4 63.3 4.5 30.2 9.3 47.0 12 310 A V - 0 0 64 -5,-0.2 -5,-2.0 -6,-0.1 2,-0.4 -0.498 30.0-157.4 -66.5 125.3 30.9 10.8 43.6 13 311 A V E -A 6 0A 77 -2,-0.3 2,-0.4 -7,-0.2 -7,-0.2 -0.885 7.9-168.1-110.2 131.9 29.2 14.3 43.4 14 312 A L E -A 5 0A 29 -9,-2.8 -9,-2.8 -2,-0.4 2,-0.5 -0.934 15.0-136.7-121.5 147.3 28.3 16.1 40.1 15 313 A T E -A 4 0A 57 -2,-0.4 2,-0.5 -11,-0.2 -11,-0.2 -0.902 15.9-152.6-108.0 124.4 27.3 19.7 39.5 16 314 A D E +A 3 0A 0 -13,-4.0 -13,-1.7 -2,-0.5 347,-0.2 -0.856 33.8 149.0-102.6 126.0 24.4 20.4 37.2 17 315 A T > + 0 0 51 345,-2.9 3,-1.8 -2,-0.5 4,-0.2 0.494 60.3 83.7-119.9 -18.5 24.1 23.6 35.3 18 316 A L G >> S+ 0 0 4 344,-1.8 3,-1.9 1,-0.3 4,-0.5 0.793 77.9 72.7 -61.0 -26.2 22.4 22.3 32.1 19 317 A H G >4 S+ 0 0 19 343,-0.3 3,-0.5 1,-0.3 -1,-0.3 0.735 80.4 70.5 -63.1 -25.2 19.0 22.6 34.0 20 318 A L G <4 S+ 0 0 67 -3,-1.8 -1,-0.3 1,-0.2 -2,-0.2 0.595 93.6 59.0 -70.3 -10.0 19.0 26.4 33.8 21 319 A K G <4 S+ 0 0 140 -3,-1.9 -1,-0.2 -4,-0.2 -2,-0.2 0.841 79.5 110.8 -79.4 -38.0 18.4 26.0 30.0 22 320 A S << + 0 0 13 -4,-0.5 370,-0.2 -3,-0.5 418,-0.0 0.081 33.9 169.9 -42.5 140.6 15.1 24.1 30.4 23 321 A T + 0 0 86 368,-0.9 -1,-0.1 2,-0.1 369,-0.1 0.711 50.0 82.2-117.5 -50.7 11.9 25.9 29.3 24 322 A L S S- 0 0 51 367,-0.4 367,-0.4 1,-0.1 2,-0.2 -0.014 83.0-104.6 -54.4 159.2 9.1 23.3 29.3 25 323 A E - 0 0 137 1,-0.1 415,-0.2 365,-0.1 -1,-0.1 -0.651 13.3-150.3-100.6 148.7 7.4 22.4 32.6 26 324 A T - 0 0 20 413,-3.2 414,-0.1 -2,-0.2 413,-0.1 0.676 37.8-117.9 -87.5 -22.0 7.8 19.2 34.7 27 325 A G S S+ 0 0 30 1,-0.4 412,-0.1 412,-0.3 2,-0.1 0.061 81.4 110.3 95.9 -23.3 4.3 18.9 36.3 28 326 A C - 0 0 4 410,-0.4 -1,-0.4 411,-0.1 2,-0.2 -0.434 45.6-172.4 -79.0 157.2 5.9 19.3 39.8 29 327 A T - 0 0 51 3,-2.6 408,-0.4 -2,-0.1 3,-0.2 -0.777 44.3 -95.1-129.9-177.5 5.5 22.4 42.1 30 328 A E S S+ 0 0 67 -2,-0.2 405,-2.6 1,-0.2 406,-0.2 0.763 127.7 46.1 -65.3 -26.2 7.1 23.5 45.4 31 329 A H S S+ 0 0 89 403,-0.2 771,-0.3 1,-0.2 2,-0.3 0.671 119.6 27.0 -90.0 -20.4 4.0 21.9 47.0 32 330 A I - 0 0 8 -3,-0.2 -3,-2.6 769,-0.1 2,-0.6 -0.990 59.1-142.3-153.5 134.2 3.9 18.5 45.2 33 331 A C B +C 800 0C 11 767,-3.5 767,-2.1 -2,-0.3 3,-0.2 -0.871 13.5 178.7 -99.9 125.7 6.0 16.0 43.4 34 332 A M > + 0 0 26 -2,-0.6 3,-2.2 765,-0.2 -1,-0.1 0.041 38.5 129.3-110.0 25.3 4.5 14.4 40.3 35 333 A G T 3 S+ 0 0 20 1,-0.3 334,-0.2 765,-0.1 -1,-0.1 0.663 73.1 46.7 -52.8 -27.2 7.7 12.3 39.5 36 334 A S T 3 S+ 0 0 14 762,-0.5 2,-0.4 -3,-0.2 -1,-0.3 0.323 81.6 110.8-103.7 8.5 5.7 9.1 39.3 37 335 A I < - 0 0 14 -3,-2.2 -3,-0.1 1,-0.1 377,-0.0 -0.671 61.1-147.0 -78.7 131.8 2.8 10.3 37.0 38 336 A V S S+ 0 0 31 -2,-0.4 -1,-0.1 1,-0.3 -4,-0.0 0.928 88.7 17.2 -66.0 -43.9 3.2 8.7 33.5 39 337 A L 0 0 102 -3,-0.1 -1,-0.3 -12,-0.0 -12,-0.0 -0.836 360.0 360.0-130.8 93.7 1.7 11.8 31.7 40 338 A P 0 0 102 0, 0.0 -13,-0.1 0, 0.0 -12,-0.0 -0.365 360.0 360.0 -88.0 360.0 1.6 15.1 33.6 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,-1.2 0, 0.0 42,-0.0 0.000 360.0 360.0 360.0 175.9 1.3 30.5 15.8 43 351 A K H > + 0 0 107 1,-0.2 4,-1.1 2,-0.2 41,-0.0 0.846 360.0 52.3 -64.9 -37.5 3.7 32.7 13.8 44 352 A D H 4 S+ 0 0 145 1,-0.2 -1,-0.2 2,-0.2 0, 0.0 0.747 107.9 51.2 -71.0 -28.7 4.6 34.5 17.0 45 353 A Q H > S+ 0 0 120 1,-0.1 4,-0.9 2,-0.1 -1,-0.2 0.818 103.9 59.1 -76.0 -33.3 5.4 31.3 18.8 46 354 A L H X S+ 0 0 17 -4,-1.2 4,-2.7 1,-0.2 5,-0.2 0.871 92.5 59.7 -74.3 -41.4 7.7 29.9 16.2 47 355 A F H X S+ 0 0 51 -4,-1.1 4,-3.0 1,-0.2 5,-0.2 0.901 104.4 47.6 -63.3 -42.7 10.5 32.4 15.8 48 356 A P H > S+ 0 0 78 0, 0.0 4,-2.6 0, 0.0 -1,-0.2 0.918 115.1 49.3 -61.0 -37.0 11.8 32.3 19.4 49 357 A L H X S+ 0 0 58 -4,-0.9 4,-2.3 2,-0.2 219,-0.2 0.918 112.3 46.8 -62.1 -44.7 11.8 28.5 19.2 50 358 A A H X S+ 0 0 0 -4,-2.7 4,-2.8 1,-0.2 5,-0.2 0.937 113.8 48.7 -63.3 -47.4 13.6 28.6 15.8 51 359 A K H X S+ 0 0 87 -4,-3.0 4,-2.4 2,-0.2 -2,-0.2 0.895 109.3 51.2 -59.5 -46.4 16.2 31.1 17.2 52 360 A E H X S+ 0 0 64 -4,-2.6 4,-1.8 -5,-0.2 -1,-0.2 0.940 113.3 45.6 -61.9 -47.9 16.8 29.1 20.3 53 361 A F H X S+ 0 0 4 -4,-2.3 4,-2.7 2,-0.2 -2,-0.2 0.951 113.4 47.9 -56.7 -51.7 17.4 25.9 18.3 54 362 A L H X S+ 0 0 0 -4,-2.8 4,-2.9 1,-0.2 5,-0.2 0.838 108.8 56.5 -62.4 -34.1 19.7 27.6 15.6 55 363 A D H X S+ 0 0 31 -4,-2.4 4,-1.5 -5,-0.2 -1,-0.2 0.907 110.1 42.8 -60.5 -46.8 21.7 29.2 18.4 56 364 A Q H X S+ 0 0 47 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.926 114.7 52.5 -70.0 -39.4 22.4 25.8 20.0 57 365 A Y H X S+ 0 0 24 -4,-2.7 4,-1.0 1,-0.2 -2,-0.2 0.940 111.7 43.4 -55.0 -55.4 23.2 24.3 16.6 58 366 A Y H <>S+ 0 0 28 -4,-2.9 5,-3.4 1,-0.2 6,-0.4 0.762 113.4 52.6 -66.2 -27.9 25.7 27.0 15.5 59 367 A S H ><5S+ 0 0 68 -4,-1.5 3,-1.3 4,-0.2 -1,-0.2 0.856 105.5 55.1 -71.6 -37.8 27.3 26.9 19.0 60 368 A S H 3<5S+ 0 0 57 -4,-2.2 -2,-0.2 1,-0.2 -1,-0.2 0.743 109.3 46.7 -66.4 -24.6 27.7 23.2 18.6 61 369 A I T 3<5S- 0 0 66 -4,-1.0 -1,-0.2 -5,-0.1 -2,-0.2 0.194 118.7-111.9-103.1 17.0 29.6 23.6 15.3 62 370 A K T < 5S+ 0 0 189 -3,-1.3 -3,-0.2 -5,-0.1 -2,-0.1 0.832 91.6 106.7 56.8 42.2 31.8 26.4 16.9 63 371 A R > < + 0 0 136 -5,-3.4 3,-2.0 -6,-0.1 6,-0.4 0.012 36.6 151.4-134.5 24.0 30.3 29.1 14.7 64 372 A F T 3 S+ 0 0 127 -6,-0.4 3,-0.1 1,-0.3 -9,-0.1 -0.393 77.2 8.9 -59.9 134.2 28.1 31.0 17.3 65 373 A G T 3 S+ 0 0 48 1,-0.2 -1,-0.3 -2,-0.1 2,-0.1 0.591 98.1 135.1 68.2 10.5 27.8 34.7 16.2 66 374 A S S <> S- 0 0 31 -3,-2.0 4,-2.3 1,-0.1 3,-0.4 -0.477 72.4-107.4 -84.7 161.9 29.5 34.0 12.8 67 375 A K H > S+ 0 0 152 1,-0.2 4,-2.9 2,-0.2 5,-0.2 0.911 122.6 55.5 -56.5 -42.9 28.1 35.5 9.6 68 376 A A H > S+ 0 0 51 2,-0.2 4,-1.5 1,-0.2 -1,-0.2 0.855 109.1 48.9 -57.1 -36.9 26.8 32.0 8.6 69 377 A H H > S+ 0 0 1 -3,-0.4 4,-1.8 -6,-0.4 -2,-0.2 0.983 114.1 43.7 -61.6 -56.3 24.9 31.8 11.9 70 378 A M H X S+ 0 0 83 -4,-2.3 4,-2.3 1,-0.2 -2,-0.2 0.828 111.1 54.4 -59.4 -43.5 23.3 35.3 11.5 71 379 A D H X S+ 0 0 81 -4,-2.9 4,-2.6 -5,-0.2 -1,-0.2 0.918 107.9 49.8 -58.3 -45.5 22.4 34.8 7.9 72 380 A R H X S+ 0 0 7 -4,-1.5 4,-1.9 -5,-0.2 -2,-0.2 0.870 107.2 55.2 -63.4 -37.5 20.6 31.6 8.7 73 381 A L H X S+ 0 0 21 -4,-1.8 4,-2.7 2,-0.2 -1,-0.2 0.938 111.8 43.2 -60.4 -46.7 18.6 33.4 11.5 74 382 A E H X S+ 0 0 98 -4,-2.3 4,-2.8 2,-0.2 5,-0.2 0.924 111.2 53.9 -62.8 -46.7 17.4 36.0 9.0 75 383 A E H X S+ 0 0 97 -4,-2.6 4,-1.3 2,-0.2 -1,-0.2 0.823 114.1 43.1 -56.8 -35.5 16.6 33.4 6.2 76 384 A V H X S+ 0 0 0 -4,-1.9 4,-2.5 2,-0.2 -1,-0.2 0.915 112.4 52.4 -78.2 -43.8 14.4 31.5 8.7 77 385 A N H X S+ 0 0 38 -4,-2.7 4,-2.2 1,-0.2 -2,-0.2 0.860 113.0 45.5 -53.3 -40.2 12.9 34.7 10.1 78 386 A K H X S+ 0 0 136 -4,-2.8 4,-1.2 2,-0.2 -1,-0.2 0.807 111.1 52.1 -75.4 -31.4 11.9 35.7 6.5 79 387 A E H X S+ 0 0 49 -4,-1.3 4,-2.7 -5,-0.2 6,-0.6 0.854 112.7 45.5 -73.7 -35.4 10.6 32.2 5.7 80 388 A I H X S+ 0 0 5 -4,-2.5 4,-2.3 3,-0.2 -2,-0.2 0.941 108.1 56.7 -69.8 -50.6 8.4 32.3 8.8 81 389 A E H < S+ 0 0 138 -4,-2.2 -1,-0.2 -5,-0.2 -2,-0.2 0.805 123.7 24.2 -49.6 -35.3 7.1 35.9 8.2 82 390 A S H < S+ 0 0 95 -4,-1.2 -2,-0.2 3,-0.2 -1,-0.2 0.772 133.6 32.1-105.7 -32.4 5.9 34.8 4.7 83 391 A T H < S- 0 0 68 -4,-2.7 -3,-0.2 2,-0.3 -2,-0.2 0.492 91.3-131.8-102.4 -4.6 5.3 31.0 4.8 84 392 A S S < S+ 0 0 65 -4,-2.3 2,-0.2 -5,-0.3 -4,-0.2 0.410 86.8 43.0 61.8 -0.9 4.2 30.8 8.5 85 393 A T S S- 0 0 35 -6,-0.6 -2,-0.3 -9,-0.0 2,-0.3 -0.747 74.2-142.0-143.2-164.8 6.6 27.9 8.9 86 394 A Y - 0 0 0 -2,-0.2 2,-0.4 -3,-0.1 -10,-0.1 -0.981 13.5-116.6-160.7 167.5 10.2 26.9 7.7 87 395 A Q - 0 0 94 -2,-0.3 2,-0.3 182,-0.0 -8,-0.1 -0.911 25.0-129.6-113.0 137.1 12.3 24.0 6.5 88 396 A L - 0 0 7 -2,-0.4 2,-0.1 1,-0.1 179,-0.0 -0.642 22.1-119.4 -80.1 138.5 15.3 22.5 8.3 89 397 A K >> - 0 0 98 -2,-0.3 4,-2.1 1,-0.1 3,-0.6 -0.457 32.0-110.7 -62.7 147.4 18.6 22.0 6.5 90 398 A D H 3> S+ 0 0 94 1,-0.2 4,-2.6 2,-0.2 5,-0.2 0.904 120.5 54.9 -45.3 -49.9 19.6 18.4 6.5 91 399 A T H 3> S+ 0 0 80 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.857 109.8 46.3 -55.7 -37.5 22.4 19.1 8.9 92 400 A E H <> S+ 0 0 1 -3,-0.6 4,-2.8 2,-0.2 -1,-0.2 0.820 110.2 53.9 -73.4 -35.6 20.0 20.7 11.4 93 401 A L H X S+ 0 0 2 -4,-2.1 4,-2.8 2,-0.2 5,-0.2 0.965 110.9 44.9 -62.8 -52.5 17.6 17.8 11.0 94 402 A I H X S+ 0 0 69 -4,-2.6 4,-2.0 1,-0.2 5,-0.2 0.918 115.8 47.0 -57.7 -51.6 20.2 15.3 11.9 95 403 A Y H X S+ 0 0 29 -4,-2.1 4,-2.1 -5,-0.2 -1,-0.2 0.909 112.6 50.6 -56.4 -46.7 21.5 17.4 14.8 96 404 A G H X S+ 0 0 0 -4,-2.8 4,-2.3 1,-0.2 -2,-0.2 0.927 111.6 46.8 -59.3 -47.7 17.9 17.9 16.0 97 405 A A H X S+ 0 0 0 -4,-2.8 4,-1.6 2,-0.2 -1,-0.2 0.888 112.5 49.1 -61.4 -42.3 17.0 14.2 16.0 98 406 A K H X S+ 0 0 50 -4,-2.0 4,-2.2 -5,-0.2 -1,-0.2 0.874 113.2 47.9 -68.0 -38.2 20.2 13.2 17.7 99 407 A H H X S+ 0 0 10 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.820 102.8 60.3 -74.2 -30.1 19.7 15.8 20.4 100 408 A A H < S+ 0 0 0 -4,-2.3 296,-0.5 2,-0.2 4,-0.4 0.916 111.5 42.4 -60.7 -38.3 16.0 14.7 20.9 101 409 A W H >< S+ 0 0 37 -4,-1.6 3,-1.6 2,-0.2 -2,-0.2 0.942 111.3 55.1 -68.9 -47.3 17.4 11.3 21.9 102 410 A R H 3< S+ 0 0 32 -4,-2.2 -2,-0.2 1,-0.3 -1,-0.2 0.828 111.5 45.8 -53.3 -33.0 20.2 12.9 23.9 103 411 A N T 3< S+ 0 0 9 -4,-2.1 2,-1.1 291,-0.2 289,-0.4 0.451 77.5 117.8 -92.4 -5.6 17.5 14.8 25.8 104 412 A A X - 0 0 27 -3,-1.6 3,-2.1 -4,-0.4 6,-0.1 -0.495 46.3-167.8 -68.4 96.3 15.2 11.8 26.4 105 413 A S T 3 S+ 0 0 21 -2,-1.1 262,-2.6 1,-0.3 -1,-0.2 0.746 81.8 54.0 -67.3 -18.9 15.3 11.8 30.2 106 414 A R T 3 S+ 0 0 62 260,-0.2 2,-0.6 264,-0.1 -1,-0.3 0.382 86.8 98.7 -90.4 0.8 13.6 8.4 30.4 107 415 A C X - 0 0 41 -3,-2.1 3,-0.7 -6,-0.2 264,-0.1 -0.840 46.7-173.7-102.9 118.7 16.0 6.6 28.1 108 416 A V T 3 S+ 0 0 24 -2,-0.6 3,-0.5 1,-0.2 -1,-0.1 0.611 80.2 67.7 -77.6 -16.4 18.8 4.5 29.7 109 417 A G T > + 0 0 29 1,-0.2 3,-1.4 2,-0.1 -1,-0.2 0.211 60.3 115.1 -94.9 19.4 20.4 3.8 26.3 110 418 A R G X + 0 0 0 -3,-0.7 3,-2.7 1,-0.3 4,-0.2 0.610 49.3 87.7 -71.3 -7.0 21.6 7.4 25.6 111 419 A I G 3 S+ 0 0 51 -3,-0.5 3,-0.4 1,-0.3 -1,-0.3 0.830 93.6 52.0 -55.1 -22.8 25.4 6.6 25.6 112 420 A Q G X S+ 0 0 57 -3,-1.4 3,-2.1 1,-0.2 -1,-0.3 0.279 74.9 115.0 -92.1 2.0 24.6 5.8 22.0 113 421 A W T < S+ 0 0 42 -3,-2.7 -1,-0.2 1,-0.3 -11,-0.2 0.782 70.5 54.9 -57.0 -34.2 22.9 9.0 21.1 114 422 A S T 3 S+ 0 0 59 -3,-0.4 2,-0.9 -4,-0.2 -1,-0.3 0.642 97.5 67.2 -76.7 -13.7 25.6 10.3 18.6 115 423 A K < + 0 0 147 -3,-2.1 2,-0.4 -17,-0.1 34,-0.3 -0.808 67.1 133.3-107.6 84.7 25.4 7.2 16.5 116 424 A L - 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0 0 25 -5,-1.9 2,-0.8 1,-0.1 -1,-0.2 -0.325 49.9 -96.3 -71.1 156.7 26.7 -19.8 39.0 720 617 B D + 0 0 60 1,-0.1 8,-0.3 6,-0.1 3,-0.2 -0.702 48.7 172.3 -71.5 111.1 28.3 -18.6 35.8 721 618 B M + 0 0 51 -2,-0.8 -1,-0.1 1,-0.1 3,-0.1 0.409 54.0 87.4-103.9 -1.6 30.1 -15.4 37.0 722 619 B R S S+ 0 0 216 1,-0.2 2,-0.3 2,-0.0 -1,-0.1 0.537 94.9 38.0 -78.2 -6.9 32.1 -14.5 33.8 723 620 B K > - 0 0 100 -3,-0.2 3,-2.2 1,-0.1 5,-0.4 -0.945 66.9-144.7-145.7 129.0 29.2 -12.6 32.3 724 621 B T G > S+ 0 0 58 -2,-0.3 3,-2.0 1,-0.3 5,-0.2 0.763 97.5 74.6 -57.5 -23.4 26.6 -10.3 34.0 725 622 B S G 3 S+ 0 0 15 1,-0.3 -1,-0.3 2,-0.1 -394,-0.1 0.504 78.1 69.6 -75.6 -5.6 24.1 -11.6 31.4 726 623 B S G < S- 0 0 17 -3,-2.2 -1,-0.3 -6,-0.2 -2,-0.2 0.579 103.7-133.5 -76.5 -11.6 23.9 -15.0 33.2 727 624 B L <> + 0 0 0 -3,-2.0 4,-2.4 -4,-0.2 5,-0.2 0.831 52.6 153.5 60.9 36.3 22.0 -12.8 35.8 728 625 B W H > + 0 0 14 -5,-0.4 4,-2.7 -8,-0.3 5,-0.2 0.914 69.3 53.3 -62.6 -39.0 24.1 -14.5 38.5 729 626 B K H > S+ 0 0 51 1,-0.2 4,-2.5 2,-0.2 -1,-0.2 0.915 110.1 47.6 -61.2 -43.9 23.7 -11.5 40.7 730 627 B D H > S+ 0 0 1 2,-0.2 4,-1.7 1,-0.2 -1,-0.2 0.866 111.3 51.4 -64.5 -38.3 20.0 -11.6 40.3 731 628 B Q H X S+ 0 0 23 -4,-2.4 4,-1.6 2,-0.2 -2,-0.2 0.907 112.5 44.7 -65.0 -46.2 19.9 -15.4 41.1 732 629 B A H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 5,-0.2 0.891 108.7 58.4 -64.6 -41.5 22.0 -15.0 44.3 733 630 B L H X S+ 0 0 1 -4,-2.5 4,-2.0 -5,-0.2 -1,-0.2 0.894 106.5 47.2 -55.6 -47.3 19.9 -12.0 45.4 734 631 B V H X S+ 0 0 6 -4,-1.7 4,-1.7 1,-0.2 -1,-0.2 0.920 111.1 51.2 -63.2 -42.2 16.7 -14.0 45.3 735 632 B E H X S+ 0 0 21 -4,-1.6 4,-2.1 1,-0.2 -2,-0.2 0.891 109.7 50.2 -63.5 -38.3 18.2 -16.9 47.2 736 633 B I H X S+ 0 0 0 -4,-2.4 4,-2.3 1,-0.2 -1,-0.2 0.905 110.6 49.7 -66.2 -42.8 19.6 -14.6 49.9 737 634 B N H X S+ 0 0 1 -4,-2.0 4,-1.7 2,-0.2 -1,-0.2 0.778 108.8 52.2 -65.8 -28.3 16.1 -13.0 50.3 738 635 B I H X S+ 0 0 12 -4,-1.7 4,-2.7 2,-0.2 -1,-0.2 0.915 109.0 51.4 -69.9 -45.6 14.5 -16.4 50.6 739 636 B A H X S+ 0 0 0 -4,-2.1 4,-2.5 1,-0.2 -89,-0.5 0.895 108.2 51.1 -58.9 -43.6 17.0 -17.3 53.3 740 637 B V H X S+ 0 0 0 -4,-2.3 4,-2.2 2,-0.2 -1,-0.2 0.952 113.9 42.8 -62.9 -48.0 16.2 -14.1 55.3 741 638 B L H X S+ 0 0 2 -4,-1.7 4,-2.7 1,-0.2 5,-0.2 0.928 115.1 50.0 -66.3 -43.4 12.5 -14.6 55.3 742 639 B Y H X S+ 0 0 93 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.876 110.5 50.4 -58.6 -42.2 12.8 -18.4 56.0 743 640 B S H X S+ 0 0 0 -4,-2.5 4,-1.6 -93,-0.3 -1,-0.2 0.926 112.9 44.6 -67.4 -46.5 15.1 -17.7 58.9 744 641 B F H <>S+ 0 0 0 -4,-2.2 5,-2.5 2,-0.2 4,-0.3 0.941 115.2 47.9 -63.0 -50.6 12.8 -15.1 60.6 745 642 B Q H ><5S+ 0 0 77 -4,-2.7 3,-1.1 1,-0.2 -2,-0.2 0.889 110.3 52.8 -54.7 -43.4 9.7 -17.2 60.0 746 643 B S H 3<5S+ 0 0 48 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.805 113.3 42.9 -64.2 -34.7 11.4 -20.3 61.5 747 644 B D T 3<5S- 0 0 64 -4,-1.6 -1,-0.3 -3,-0.3 -2,-0.2 0.297 114.1-117.6 -94.2 5.6 12.5 -18.4 64.6 748 645 B K T < 5 + 0 0 171 -3,-1.1 2,-0.5 -4,-0.3 -3,-0.2 0.860 63.6 146.2 61.1 40.4 9.0 -16.8 64.9 749 646 B V < - 0 0 5 -5,-2.5 -1,-0.2 -6,-0.1 -192,-0.2 -0.935 56.4-107.3-107.2 125.5 10.3 -13.2 64.5 750 647 B T + 0 0 37 -194,-2.7 -59,-0.5 -2,-0.5 2,-0.3 -0.223 53.8 151.3 -54.2 130.7 7.9 -11.0 62.7 751 648 B I E -f 691 0V 22 -61,-0.1 2,-0.4 -193,-0.0 -59,-0.2 -0.961 30.1-145.5-151.3 157.9 9.0 -10.1 59.2 752 649 B V E -f 692 0V 32 -61,-2.0 -59,-2.9 -2,-0.3 -58,-0.3 -0.993 14.0-132.0-130.1 138.4 7.0 -9.2 56.0 753 650 B D > - 0 0 11 -2,-0.4 4,-2.5 -61,-0.2 5,-0.2 -0.473 28.4-112.4 -80.1 160.8 7.9 -10.1 52.4 754 651 B H H > S+ 0 0 1 2,-0.2 4,-1.7 1,-0.2 5,-0.2 0.749 113.7 55.3 -70.1 -25.6 7.8 -7.3 49.8 755 652 B H H > S+ 0 0 13 2,-0.2 4,-2.2 3,-0.1 5,-0.2 0.972 112.7 41.4 -67.2 -50.4 4.8 -8.8 47.9 756 653 B S H > S+ 0 0 41 1,-0.2 4,-2.3 2,-0.2 -2,-0.2 0.925 115.8 50.3 -65.1 -42.3 2.7 -8.9 51.0 757 654 B A H X S+ 0 0 8 -4,-2.5 4,-2.4 1,-0.2 -1,-0.2 0.870 112.0 46.2 -66.3 -39.0 3.9 -5.4 52.2 758 655 B T H X S+ 0 0 0 -4,-1.7 4,-2.0 2,-0.2 -1,-0.2 0.880 110.3 52.2 -73.5 -37.0 3.2 -3.7 48.9 759 656 B E H X S+ 0 0 105 -4,-2.2 4,-1.8 2,-0.2 -2,-0.2 0.926 111.8 49.4 -61.8 -42.9 -0.2 -5.3 48.4 760 657 B S H X S+ 0 0 40 -4,-2.3 4,-2.8 1,-0.2 -2,-0.2 0.933 107.9 52.7 -60.1 -46.8 -1.0 -4.0 51.9 761 658 B F H X S+ 0 0 0 -4,-2.4 4,-3.1 1,-0.2 -1,-0.2 0.881 106.9 52.3 -55.4 -42.5 0.3 -0.5 51.1 762 659 B I H X S+ 0 0 18 -4,-2.0 4,-2.5 2,-0.2 -1,-0.2 0.900 111.3 46.6 -63.3 -43.4 -2.0 -0.3 48.0 763 660 B K H X S+ 0 0 126 -4,-1.8 4,-2.2 2,-0.2 -2,-0.2 0.911 114.1 49.0 -64.7 -39.2 -5.0 -1.2 50.1 764 661 B H H X S+ 0 0 6 -4,-2.8 4,-2.7 2,-0.2 -2,-0.2 0.954 111.9 49.3 -60.8 -47.9 -3.9 1.3 52.8 765 662 B M H X S+ 0 0 1 -4,-3.1 4,-2.1 1,-0.2 -2,-0.2 0.892 110.9 47.3 -63.2 -45.8 -3.5 4.0 50.1 766 663 B E H X S+ 0 0 43 -4,-2.5 4,-1.9 2,-0.2 -1,-0.2 0.909 112.7 51.2 -61.9 -40.9 -6.9 3.4 48.5 767 664 B N H X S+ 0 0 96 -4,-2.2 4,-2.8 1,-0.2 5,-0.3 0.908 109.6 50.7 -57.8 -47.1 -8.5 3.5 52.0 768 665 B E H X>S+ 0 0 2 -4,-2.7 4,-2.4 2,-0.2 6,-1.1 0.843 106.9 52.2 -61.4 -43.5 -6.7 6.8 52.7 769 666 B Y H X5S+ 0 0 12 -4,-2.1 4,-1.2 4,-0.3 -1,-0.2 0.930 114.4 44.8 -55.7 -45.8 -7.9 8.4 49.5 770 667 B R H <5S+ 0 0 169 -4,-1.9 -2,-0.2 1,-0.2 -1,-0.1 0.923 126.5 27.6 -69.0 -46.5 -11.5 7.4 50.4 771 668 B C H <5S+ 0 0 83 -4,-2.8 -3,-0.2 -5,-0.1 -1,-0.2 0.673 137.2 23.7 -88.2 -22.6 -11.4 8.5 54.1 772 669 B R H <5S- 0 0 46 -4,-2.4 -3,-0.2 -5,-0.3 -2,-0.2 0.607 97.5-115.5-123.8 -17.6 -8.8 11.2 54.0 773 670 B G S <> - 0 0 8 -262,-2.3 4,-2.7 -2,-0.3 3,-1.3 -0.868 11.8-165.7-107.3 101.1 7.3 8.7 47.5 779 676 B W H 3> S+ 0 0 18 -2,-0.8 4,-2.2 1,-0.3 -1,-0.2 0.865 85.6 62.4 -53.5 -45.0 7.5 6.1 44.6 780 677 B V H 34 S+ 0 0 17 1,-0.2 -1,-0.3 -336,-0.2 -335,-0.1 0.847 117.2 31.9 -52.7 -30.5 11.3 6.1 44.6 781 678 B W H <4 S+ 0 0 109 -3,-1.3 -2,-0.2 -265,-0.1 -1,-0.2 0.809 114.4 55.8 -98.6 -38.2 11.2 4.8 48.1 782 679 B I H < S+ 0 0 2 -4,-2.7 -3,-0.2 -266,-0.1 -2,-0.2 0.864 88.0 85.1 -65.1 -39.7 8.0 2.7 48.2 783 680 B V S < S- 0 0 16 -4,-2.2 5,-0.1 -5,-0.2 6,-0.1 -0.519 90.0-115.4 -69.4 127.7 9.0 0.5 45.3 784 681 B P - 0 0 7 0, 0.0 -407,-0.2 0, 0.0 4,-0.2 -0.208 18.4-116.3 -64.1 152.9 11.1 -2.4 46.7 785 682 B P S S+ 0 0 12 0, 0.0 -407,-2.1 0, 0.0 -406,-0.4 0.323 97.3 42.5 -81.4 5.7 14.8 -2.7 45.6 786 683 B M S S+ 0 0 2 -410,-0.2 -411,-0.1 -409,-0.2 -92,-0.1 -0.966 118.5 9.6-138.6 153.4 14.3 -6.0 43.9 787 684 B S S > S+ 0 0 5 -2,-0.3 3,-1.2 1,-0.1 4,-0.3 0.763 73.0 170.9 55.7 30.9 11.5 -7.3 41.6 788 685 B G G > + 0 0 5 1,-0.2 3,-1.8 -415,-0.2 6,-0.6 0.869 66.3 45.5 -37.2 -63.6 10.0 -3.8 41.4 789 686 B S G 3 S+ 0 0 1 -415,-2.5 -1,-0.2 1,-0.3 -414,-0.1 0.606 101.9 62.6 -75.7 -8.0 7.4 -4.4 38.7 790 687 B I G < S+ 0 0 12 -3,-1.2 -1,-0.3 -416,-0.4 -2,-0.2 0.414 92.3 81.5 -90.4 5.7 5.9 -7.6 40.0 791 688 B T S X S- 0 0 0 -3,-1.8 3,-0.8 -4,-0.3 4,-0.4 -0.840 88.5-128.2-101.1 143.5 4.8 -5.6 43.1 792 689 B P G > S+ 0 0 33 0, 0.0 3,-0.7 0, 0.0 4,-0.2 0.750 101.4 69.4 -70.5 -20.8 1.6 -3.6 42.6 793 690 B V G > S+ 0 0 0 1,-0.2 3,-1.7 2,-0.2 -10,-0.1 0.829 86.9 65.5 -61.1 -38.6 3.2 -0.3 43.8 794 691 B F G < S+ 0 0 31 -3,-0.8 -1,-0.2 -6,-0.6 -5,-0.1 0.836 104.1 46.8 -48.4 -38.2 5.4 -0.1 40.7 795 692 B H G < S+ 0 0 9 -3,-0.7 -378,-2.8 -4,-0.4 2,-0.6 0.421 95.0 99.2 -90.1 -3.2 2.2 0.4 38.6 796 693 B Q B < -S 416 0N 3 -3,-1.7 -380,-0.2 -380,-0.2 2,-0.2 -0.815 67.1-141.1 -94.3 115.6 0.8 2.9 41.0 797 694 B E - 0 0 11 -382,-1.8 2,-0.3 -2,-0.6 -760,-0.1 -0.529 29.1-170.6 -62.7 138.3 1.0 6.7 40.3 798 695 B M - 0 0 2 -2,-0.2 -762,-0.5 -21,-0.1 2,-0.5 -0.914 19.5-139.2-138.0 153.9 1.7 8.5 43.6 799 696 B L - 0 0 0 -24,-0.5 -22,-2.3 -2,-0.3 2,-0.5 -0.985 16.2-152.9-120.9 128.6 1.7 12.1 44.7 800 697 B N B +C 33 0C 33 -767,-2.1 -767,-3.5 -2,-0.5 2,-0.3 -0.916 30.3 139.9-110.1 125.9 4.4 13.2 47.0 801 698 B Y - 0 0 1 -2,-0.5 2,-0.6 -769,-0.2 -285,-0.2 -0.965 47.7-102.7-157.1 162.6 3.9 16.2 49.4 802 699 B R + 0 0 92 -369,-0.4 -370,-0.8 -771,-0.3 -369,-0.4 -0.795 33.8 176.6-102.5 114.8 4.7 17.2 53.0 803 700 B L - 0 0 11 -2,-0.6 -372,-0.1 -289,-0.4 -289,-0.0 -0.824 28.9-101.2-104.6 151.8 2.1 17.0 55.8 804 701 B T S S+ 0 0 22 -2,-0.3 2,-0.2 2,-0.1 -127,-0.1 -0.933 96.1 61.3-114.0 151.9 2.7 17.8 59.5 805 702 B P S S+ 0 0 1 0, 0.0 2,-0.3 0, 0.0 -128,-0.2 0.542 87.4 161.3 -56.6 156.6 3.1 16.2 62.0 806 703 B S E -D 676 0U 9 -130,-1.6 -130,-3.0 -2,-0.2 2,-0.4 -0.988 46.1-124.5-150.3 154.1 6.2 14.8 60.3 807 704 B F E -D 675 0U 30 -296,-0.5 2,-0.3 -2,-0.3 -132,-0.2 -0.913 38.3-174.6 -94.8 137.4 9.5 13.0 60.9 808 705 B E E -D 674 0U 52 -134,-2.7 -134,-2.4 -2,-0.4 2,-0.1 -0.864 26.4-106.4-131.4 158.5 12.5 14.9 59.4 809 706 B Y - 0 0 103 -2,-0.3 -136,-0.1 -136,-0.2 -1,-0.0 -0.419 34.5-169.7 -73.8 158.9 16.1 14.4 58.9 810 707 B Q - 0 0 26 -138,-0.3 2,-0.0 -2,-0.1 -138,-0.0 -0.966 31.5 -90.3-144.6 157.0 18.6 16.2 61.1 811 708 B P - 0 0 80 0, 0.0 5,-0.1 0, 0.0 0, 0.0 -0.387 53.0 -93.3 -66.8 148.0 22.3 16.6 61.0 812 709 B D >> - 0 0 56 1,-0.1 3,-1.7 2,-0.1 4,-0.5 -0.393 36.1-126.0 -58.1 136.6 24.3 14.1 62.8 813 710 B P H >> S+ 0 0 3 0, 0.0 4,-3.3 0, 0.0 3,-0.8 0.754 104.8 67.1 -67.3 -24.3 25.0 15.5 66.3 814 711 B W H 34 S+ 0 0 51 1,-0.2 -2,-0.1 2,-0.2 -236,-0.0 0.711 100.2 54.3 -67.5 -17.0 28.8 15.1 66.1 815 712 B N H <4 S+ 0 0 113 -3,-1.7 -1,-0.2 1,-0.1 -3,-0.1 0.734 122.8 23.6 -82.4 -24.1 28.7 17.7 63.4 816 713 B T H << S+ 0 0 86 -3,-0.8 -2,-0.2 -4,-0.5 -1,-0.1 0.696 89.7 117.6-115.2 -28.6 26.8 20.3 65.5 817 714 B H < - 0 0 27 -4,-3.3 2,-0.8 -5,-0.1 -245,-0.0 -0.128 55.9-140.2 -55.1 133.2 27.5 19.4 69.1 818 715 B V - 0 0 112 -187,-0.1 2,-0.2 -246,-0.1 -1,-0.1 -0.863 24.6-135.2 -91.7 107.6 29.3 21.9 71.3 819 716 B W - 0 0 114 -2,-0.8 -187,-0.1 1,-0.2 0, 0.0 -0.491 20.3-171.9 -68.3 128.0 31.6 19.8 73.4 820 717 B K 0 0 113 -2,-0.2 -1,-0.2 1,-0.0 -188,-0.0 0.793 360.0 360.0 -93.3 -31.7 31.5 20.8 77.1 821 718 B G 0 0 127 0, 0.0 -2,-0.0 0, 0.0 -1,-0.0 -0.451 360.0 360.0 124.0 360.0 34.4 18.6 78.2