==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=7-JAN-2010 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 22-OCT-07 3B3P . COMPND 2 MOLECULE: NITRIC-OXIDE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS; . AUTHOR J.IGARASHI,H.LI,T.L.POULOS . 820 4 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 34773.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 547 66.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 14 1.7 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 84 10.2 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 . 73 8.9 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 27.4 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 2 1 0 2 1 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 . 2 0 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 . 6 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 0 213 0, 0.0 2,-0.5 0, 0.0 19,-0.1 0.000 360.0 360.0 360.0 -34.9 20.8 27.5 40.6 2 300 A F - 0 0 123 17,-0.1 2,-0.2 2,-0.0 15,-0.2 -0.900 360.0-168.4-126.5 96.6 23.8 25.1 40.6 3 301 A L E -A 16 0A 40 13,-1.1 13,-3.0 -2,-0.5 2,-0.4 -0.505 7.9-151.2 -88.7 155.9 22.5 21.7 41.6 4 302 A K E -A 15 0A 123 11,-0.3 2,-0.4 -2,-0.2 11,-0.2 -0.990 1.9-157.7-130.8 135.6 24.6 18.7 42.6 5 303 A V E -A 14 0A 0 9,-2.8 9,-2.5 -2,-0.4 2,-0.3 -0.924 11.5-157.2-113.7 138.0 23.7 15.1 42.3 6 304 A K E -A 13 0A 50 -2,-0.4 382,-2.0 7,-0.2 2,-0.6 -0.869 13.9-140.8-117.0 148.0 25.4 12.4 44.4 7 305 A N B > -B 387 0B 4 5,-2.3 4,-1.2 -2,-0.3 380,-0.2 -0.925 11.7-157.8-103.0 121.2 25.8 8.6 43.9 8 306 A W T 4 S+ 0 0 86 378,-2.8 379,-0.1 -2,-0.6 -1,-0.1 0.425 88.5 54.0 -82.8 5.9 25.3 6.9 47.2 9 307 A E T 4 S+ 0 0 38 377,-0.2 -1,-0.2 374,-0.1 378,-0.1 0.735 124.9 20.1-104.9 -30.3 27.3 3.9 46.2 10 308 A T T 4 S- 0 0 78 -3,-0.2 -2,-0.2 2,-0.1 3,-0.1 0.284 93.9-130.0-120.0 5.3 30.5 5.6 45.1 11 309 A D < + 0 0 109 -4,-1.2 -3,-0.1 1,-0.2 0, 0.0 0.333 56.0 150.4 58.7 -4.1 30.1 8.9 47.0 12 310 A V - 0 0 69 -6,-0.1 -5,-2.3 1,-0.1 2,-0.4 -0.226 31.5-154.4 -59.6 141.9 30.8 10.7 43.7 13 311 A V E -A 6 0A 75 -7,-0.2 2,-0.4 -3,-0.1 -7,-0.2 -0.962 9.0-169.4-124.3 136.6 29.2 14.2 43.1 14 312 A L E -A 5 0A 28 -9,-2.5 -9,-2.8 -2,-0.4 2,-0.5 -0.961 16.9-137.2-123.5 141.0 28.4 15.9 39.8 15 313 A T E -A 4 0A 61 -2,-0.4 2,-0.6 -11,-0.2 -11,-0.3 -0.881 15.3-147.3-103.4 125.1 27.3 19.5 39.4 16 314 A D E +A 3 0A 0 -13,-3.0 -13,-1.1 -2,-0.5 349,-0.2 -0.778 35.0 151.2 -96.5 120.8 24.5 20.3 37.0 17 315 A T > + 0 0 53 347,-2.8 3,-1.4 -2,-0.6 348,-0.2 0.576 63.4 77.6-115.7 -19.0 24.5 23.5 35.1 18 316 A L G > S+ 0 0 7 346,-2.2 3,-2.1 1,-0.3 347,-0.1 0.766 78.1 72.6 -63.9 -27.9 22.6 22.3 32.0 19 317 A H G > S+ 0 0 19 345,-0.3 3,-1.3 1,-0.3 -1,-0.3 0.698 83.0 72.2 -63.0 -16.8 19.2 22.4 33.8 20 318 A L G < S+ 0 0 66 -3,-1.4 -1,-0.3 1,-0.3 -2,-0.2 0.547 91.5 55.8 -75.1 -8.1 19.4 26.2 33.6 21 319 A K G < S+ 0 0 143 -3,-2.1 2,-0.3 -4,-0.1 -1,-0.3 0.260 79.1 137.9-103.2 7.3 18.7 26.1 29.9 22 320 A S < + 0 0 13 -3,-1.3 372,-0.2 1,-0.1 -3,-0.1 -0.377 26.8 176.6 -60.5 116.7 15.5 24.1 30.6 23 321 A T + 0 0 50 370,-0.9 -1,-0.1 -2,-0.3 371,-0.1 0.953 52.0 54.8 -84.5 -75.5 12.8 25.4 28.4 24 322 A L S S- 0 0 35 369,-0.4 369,-0.4 1,-0.1 2,-0.1 0.108 83.7-100.3 -58.6 168.9 9.6 23.3 29.0 25 323 A E - 0 0 136 367,-0.1 417,-0.2 1,-0.1 -1,-0.1 -0.447 15.4-147.6 -89.7 164.1 7.7 22.6 32.2 26 324 A T - 0 0 24 415,-2.7 416,-0.1 2,-0.3 3,-0.1 0.635 34.6-116.9-107.3 -22.4 7.9 19.4 34.4 27 325 A G S S+ 0 0 31 1,-0.5 2,-0.2 414,-0.3 414,-0.1 0.478 82.8 107.2 95.1 -0.2 4.4 19.0 36.0 28 326 A C - 0 0 3 412,-0.4 -1,-0.5 413,-0.2 -2,-0.3 -0.683 46.2-173.8-107.7 164.4 6.0 19.4 39.4 29 327 A T - 0 0 48 3,-2.6 410,-0.3 -2,-0.2 408,-0.1 -0.766 46.1 -93.5-141.8-175.3 5.7 22.4 41.8 30 328 A E S S+ 0 0 68 -2,-0.2 407,-1.4 1,-0.2 408,-0.2 0.721 127.8 44.3 -78.3 -17.5 7.3 23.3 45.1 31 329 A H S S+ 0 0 83 1,-0.2 2,-0.4 405,-0.2 773,-0.3 0.666 119.7 31.3 -98.3 -19.1 4.3 21.7 46.7 32 330 A I - 0 0 10 771,-0.1 -3,-2.6 407,-0.0 2,-0.5 -0.973 58.8-153.0-149.2 131.2 3.9 18.6 44.7 33 331 A C B -C 802 0C 9 769,-2.4 769,-1.9 -2,-0.4 3,-0.2 -0.883 10.0-179.8-100.9 126.0 6.2 16.2 42.9 34 332 A M > + 0 0 26 -2,-0.5 3,-3.2 767,-0.2 -1,-0.1 0.120 35.7 132.9-110.9 20.0 4.7 14.3 40.0 35 333 A G T 3 S+ 0 0 21 1,-0.3 336,-0.2 767,-0.1 -1,-0.1 0.592 73.8 47.6 -45.4 -20.1 7.8 12.3 39.2 36 334 A S T 3 S+ 0 0 16 764,-0.6 2,-0.6 -3,-0.2 -1,-0.3 0.243 81.4 109.7-110.1 13.5 5.8 9.1 38.9 37 335 A I < - 0 0 12 -3,-3.2 -3,-0.1 762,-0.2 379,-0.0 -0.802 63.6-144.1 -88.6 124.2 2.9 10.3 36.8 38 336 A M S S+ 0 0 60 -2,-0.6 -1,-0.1 1,-0.3 -3,-0.0 0.814 91.1 17.6 -57.0 -35.9 3.3 8.7 33.3 39 337 A L 0 0 93 -3,-0.0 -1,-0.3 -12,-0.0 -12,-0.0 -0.647 360.0 360.0-139.5 79.6 2.0 11.8 31.4 40 338 A P 0 0 101 0, 0.0 -13,-0.1 0, 0.0 -12,-0.1 0.260 360.0 360.0 -59.9 360.0 2.1 15.0 33.5 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 42 348 A V 0 0 138 0, 0.0 2,-0.1 0, 0.0 119,-0.1 0.000 360.0 360.0 360.0 144.7 -0.8 24.6 15.9 43 349 A R - 0 0 75 227,-0.1 2,-0.3 1,-0.0 228,-0.0 -0.358 360.0-135.5 -86.3 168.1 1.9 27.2 16.4 44 350 A T > - 0 0 69 -2,-0.1 4,-2.4 1,-0.1 3,-0.0 -0.803 27.0-105.7-120.3 162.6 2.0 30.9 15.3 45 351 A K H > S+ 0 0 71 -2,-0.3 4,-1.8 1,-0.2 -1,-0.1 0.855 121.1 49.4 -54.5 -41.2 4.7 33.0 13.6 46 352 A D H 4 S+ 0 0 141 1,-0.2 -1,-0.2 2,-0.2 37,-0.0 0.903 112.8 48.1 -65.9 -41.9 5.4 34.9 16.9 47 353 A Q H > S+ 0 0 97 1,-0.2 4,-0.9 2,-0.1 -2,-0.2 0.865 112.5 51.9 -65.1 -36.9 5.7 31.6 18.8 48 354 A L H X S+ 0 0 9 -4,-2.4 4,-2.4 1,-0.2 5,-0.2 0.848 94.6 59.7 -76.0 -41.6 8.0 30.1 16.2 49 355 A F H X S+ 0 0 50 -4,-1.8 4,-2.8 1,-0.2 5,-0.2 0.901 105.9 52.0 -59.3 -38.1 10.9 32.5 15.5 50 356 A P H > S+ 0 0 66 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.939 110.2 47.8 -62.5 -43.1 12.0 32.3 19.2 51 357 A L H X S+ 0 0 35 -4,-0.9 4,-2.5 1,-0.2 219,-0.3 0.935 113.8 48.1 -59.8 -47.1 12.0 28.5 19.1 52 358 A A H X S+ 0 0 0 -4,-2.4 4,-3.5 217,-0.3 5,-0.2 0.894 110.3 51.7 -59.2 -45.8 14.0 28.5 15.9 53 359 A K H X S+ 0 0 87 -4,-2.8 4,-2.5 2,-0.2 -1,-0.2 0.894 109.6 49.4 -60.8 -42.6 16.5 31.0 17.2 54 360 A E H X S+ 0 0 61 -4,-2.3 4,-2.1 -5,-0.2 5,-0.2 0.959 115.2 44.3 -61.6 -51.1 17.1 29.0 20.3 55 361 A F H X S+ 0 0 3 -4,-2.5 4,-2.8 1,-0.2 -2,-0.2 0.964 114.7 47.9 -57.7 -54.7 17.6 25.9 18.2 56 362 A L H X S+ 0 0 0 -4,-3.5 4,-2.8 1,-0.2 5,-0.3 0.849 108.5 54.9 -57.1 -38.0 19.8 27.6 15.6 57 363 A D H X S+ 0 0 33 -4,-2.5 4,-2.2 -5,-0.2 -1,-0.2 0.947 112.8 42.5 -62.4 -48.1 22.0 29.3 18.3 58 364 A Q H X S+ 0 0 49 -4,-2.1 4,-2.7 2,-0.2 -2,-0.2 0.878 112.1 54.4 -69.1 -33.7 22.8 25.9 19.9 59 365 A Y H X S+ 0 0 25 -4,-2.8 4,-1.1 1,-0.2 -2,-0.2 0.959 113.1 41.7 -62.6 -48.8 23.3 24.3 16.5 60 366 A Y H <>S+ 0 0 26 -4,-2.8 5,-2.7 1,-0.2 6,-0.3 0.859 111.4 57.4 -65.7 -32.4 25.9 26.8 15.5 61 367 A S H ><5S+ 0 0 66 -4,-2.2 3,-2.2 -5,-0.3 5,-0.3 0.961 103.3 53.4 -60.4 -49.1 27.3 26.7 18.9 62 368 A S H 3<5S+ 0 0 62 -4,-2.7 -1,-0.2 1,-0.3 -2,-0.2 0.772 109.8 47.1 -57.4 -30.8 27.9 23.0 18.5 63 369 A I T 3<5S- 0 0 60 -4,-1.1 -1,-0.3 -3,-0.2 -2,-0.2 0.222 116.6-113.7 -97.4 15.0 29.8 23.5 15.3 64 370 A K T < 5S+ 0 0 188 -3,-2.2 -3,-0.2 -5,-0.1 -2,-0.1 0.796 89.7 107.3 59.4 36.1 31.9 26.3 16.8 65 371 A R > < + 0 0 148 -5,-2.7 3,-1.4 -6,-0.1 6,-0.4 -0.186 39.9 155.3-133.2 40.5 30.5 29.0 14.6 66 372 A F T 3 S+ 0 0 127 -6,-0.3 3,-0.1 1,-0.3 -9,-0.1 -0.515 74.9 3.4 -71.2 130.1 28.4 30.8 17.2 67 373 A G T 3 S+ 0 0 47 -2,-0.3 -1,-0.3 1,-0.2 2,-0.0 0.611 100.2 135.4 70.4 9.6 27.8 34.4 16.3 68 374 A S S <> S- 0 0 34 -3,-1.4 4,-2.2 1,-0.1 -1,-0.2 -0.232 73.2-103.2 -79.7 176.5 29.7 33.9 13.0 69 375 A K H > S+ 0 0 150 2,-0.2 4,-4.0 1,-0.2 5,-0.3 0.965 123.0 55.7 -66.1 -50.5 28.3 35.3 9.7 70 376 A A H > S+ 0 0 46 1,-0.2 4,-2.4 2,-0.2 5,-0.2 0.895 109.7 48.4 -45.3 -47.6 27.1 31.9 8.6 71 377 A H H > S+ 0 0 2 -6,-0.4 4,-3.0 2,-0.2 -1,-0.2 0.977 115.8 40.7 -57.6 -61.0 25.2 31.7 11.9 72 378 A M H X S+ 0 0 82 -4,-2.2 4,-2.1 1,-0.2 5,-0.2 0.904 112.8 56.3 -55.3 -47.0 23.6 35.2 11.5 73 379 A D H X S+ 0 0 85 -4,-4.0 4,-2.9 1,-0.2 3,-0.4 0.944 112.8 40.1 -50.8 -54.5 23.0 34.7 7.8 74 380 A R H X S+ 0 0 9 -4,-2.4 4,-2.8 -5,-0.3 5,-0.4 0.902 110.0 60.4 -62.3 -43.0 21.0 31.5 8.4 75 381 A L H X S+ 0 0 20 -4,-3.0 4,-1.0 -5,-0.2 -1,-0.2 0.828 112.7 38.5 -56.1 -32.7 19.3 33.1 11.4 76 382 A E H X S+ 0 0 85 -4,-2.1 4,-3.1 -3,-0.4 5,-0.3 0.895 110.5 58.0 -84.1 -44.0 18.0 35.8 9.0 77 383 A E H X S+ 0 0 92 -4,-2.9 4,-2.1 1,-0.2 -2,-0.2 0.918 113.4 40.9 -48.8 -48.0 17.2 33.4 6.2 78 384 A V H X S+ 0 0 0 -4,-2.8 4,-2.5 2,-0.2 -1,-0.2 0.866 111.8 57.0 -68.4 -39.6 15.0 31.4 8.5 79 385 A N H X S+ 0 0 54 -4,-1.0 4,-1.8 -5,-0.4 -2,-0.2 0.915 110.6 42.3 -58.5 -47.9 13.6 34.6 10.0 80 386 A K H X S+ 0 0 136 -4,-3.1 4,-2.4 1,-0.2 5,-0.3 0.910 112.4 54.6 -66.4 -43.1 12.4 35.9 6.6 81 387 A E H X>S+ 0 0 48 -4,-2.1 4,-3.5 -5,-0.3 5,-0.7 0.895 108.6 48.9 -59.1 -39.5 11.1 32.5 5.6 82 388 A I H X5S+ 0 0 4 -4,-2.5 4,-1.2 3,-0.2 -1,-0.2 0.895 111.2 49.2 -66.7 -40.5 9.0 32.3 8.8 83 389 A E H <5S+ 0 0 121 -4,-1.8 -2,-0.2 -5,-0.2 -1,-0.2 0.858 123.0 32.8 -67.0 -36.5 7.6 35.8 8.2 84 390 A S H <5S+ 0 0 101 -4,-2.4 -2,-0.2 -5,-0.1 -3,-0.2 0.922 134.6 24.4 -86.1 -50.0 6.7 35.1 4.6 85 391 A T H <5S- 0 0 67 -4,-3.5 -3,-0.2 -5,-0.3 -2,-0.2 0.762 92.4-132.0 -88.6 -28.8 5.9 31.3 4.7 86 392 A S S <> - 0 0 97 -2,-0.3 4,-2.2 1,-0.1 3,-0.5 -0.415 34.4-104.8 -70.0 151.3 18.8 22.1 6.4 92 398 A D H 3> S+ 0 0 103 1,-0.2 4,-2.2 2,-0.2 5,-0.1 0.888 122.6 52.0 -46.1 -47.1 19.9 18.5 6.3 93 399 A T H 3> S+ 0 0 76 1,-0.2 4,-2.1 2,-0.2 5,-0.3 0.903 109.2 49.6 -57.6 -42.9 22.7 19.2 8.9 94 400 A E H <> S+ 0 0 1 -3,-0.5 4,-2.5 1,-0.2 -1,-0.2 0.859 108.0 54.6 -64.9 -35.7 20.1 20.7 11.2 95 401 A L H X S+ 0 0 3 -4,-2.2 4,-2.5 2,-0.2 5,-0.2 0.939 111.9 42.9 -63.5 -49.2 17.8 17.7 10.8 96 402 A I H >X S+ 0 0 67 -4,-2.2 4,-2.7 2,-0.2 3,-0.7 0.999 115.6 46.9 -59.1 -69.1 20.5 15.2 11.8 97 403 A Y H 3X S+ 0 0 30 -4,-2.1 4,-2.3 1,-0.3 -2,-0.2 0.880 114.3 52.2 -37.5 -49.7 21.8 17.3 14.7 98 404 A G H 3X S+ 0 0 0 -4,-2.5 4,-1.7 -5,-0.3 -1,-0.3 0.910 111.9 41.6 -57.4 -48.3 18.2 17.8 15.8 99 405 A A H < S+ 0 0 35 -4,-1.7 3,-1.0 2,-0.2 -2,-0.2 0.885 107.4 57.4 -71.8 -40.6 17.6 11.3 21.7 104 410 A R H 3< S+ 0 0 38 -4,-1.7 -1,-0.2 1,-0.3 -2,-0.2 0.873 111.7 44.0 -58.5 -34.8 20.4 12.9 23.7 105 411 A N T 3< S+ 0 0 10 -4,-1.9 2,-2.1 291,-0.3 289,-0.3 0.532 76.6 120.5 -88.6 -6.3 17.7 14.7 25.7 106 412 A A X - 0 0 24 -3,-1.0 3,-2.6 -4,-0.4 6,-0.2 -0.355 44.9-170.1 -61.3 85.3 15.4 11.6 26.1 107 413 A S T 3 S+ 0 0 24 -2,-2.1 262,-3.8 1,-0.3 -1,-0.2 0.500 80.7 52.5 -57.4 -8.7 15.5 11.6 29.9 108 414 A R T 3 S+ 0 0 51 260,-0.2 2,-0.6 264,-0.1 -1,-0.3 0.400 86.6 98.0-107.5 -1.5 13.7 8.3 30.1 109 415 A C X - 0 0 42 -3,-2.6 3,-0.5 -6,-0.2 264,-0.1 -0.792 50.3-170.4 -92.6 123.4 16.1 6.5 27.8 110 416 A V T 3 S+ 0 0 23 -2,-0.6 3,-0.4 1,-0.2 -1,-0.1 0.668 80.3 62.0 -83.7 -17.2 18.8 4.5 29.6 111 417 A G T > + 0 0 27 1,-0.2 3,-1.9 2,-0.1 -1,-0.2 0.158 61.2 120.1 -99.6 23.6 20.8 3.7 26.4 112 418 A R G X + 0 0 0 -3,-0.5 3,-2.5 1,-0.3 4,-0.2 0.599 49.8 87.9 -62.7 -12.0 21.7 7.3 25.4 113 419 A I G 3 S+ 0 0 45 -3,-0.4 3,-0.3 1,-0.3 -1,-0.3 0.793 92.2 53.0 -57.6 -18.4 25.4 6.6 25.6 114 420 A Q G X S+ 0 0 56 -3,-1.9 3,-2.3 1,-0.2 -1,-0.3 0.503 76.5 112.8 -89.5 -10.4 24.7 5.6 22.0 115 421 A W T < + 0 0 34 -3,-2.5 -1,-0.2 1,-0.3 -11,-0.2 0.671 68.7 55.4 -38.7 -40.4 23.0 8.9 21.0 116 422 A S T 3 S+ 0 0 50 -3,-0.3 2,-1.2 -4,-0.2 -1,-0.3 0.745 95.3 70.9 -72.4 -21.5 25.5 10.2 18.6 117 423 A K < + 0 0 122 -3,-2.3 2,-0.4 -17,-0.1 34,-0.3 -0.680 67.2 135.4 -99.0 80.3 25.4 7.1 16.4 118 424 A L - 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0 0 7 -5,-2.9 -1,-0.2 -6,-0.1 -192,-0.2 -0.955 56.0-106.0-111.3 121.3 10.1 -13.3 64.3 752 647 B T + 0 0 39 -194,-2.5 -59,-0.5 -2,-0.5 2,-0.3 -0.146 56.5 143.7 -51.2 136.6 7.7 -11.0 62.5 753 648 B I - 0 0 24 -61,-0.2 2,-0.3 -193,-0.1 -59,-0.2 -0.936 32.2-144.6-165.0 159.7 8.7 -10.0 59.0 754 649 B V B -d 694 0T 33 -61,-1.8 -59,-2.5 -2,-0.3 2,-0.1 -0.997 14.6-127.4-138.3 141.2 6.8 -9.4 55.7 755 650 B D > - 0 0 10 -2,-0.3 4,-2.7 -61,-0.2 5,-0.2 -0.459 28.5-112.6 -82.5 161.2 7.8 -10.1 52.1 756 651 B H H > S+ 0 0 1 2,-0.2 4,-1.6 1,-0.2 5,-0.2 0.695 114.4 55.0 -68.8 -22.2 7.6 -7.4 49.4 757 652 B H H > S+ 0 0 12 2,-0.2 4,-2.3 3,-0.1 5,-0.2 0.973 114.2 41.4 -71.5 -53.1 4.8 -8.9 47.5 758 653 B S H > S+ 0 0 38 1,-0.2 4,-1.8 2,-0.2 -2,-0.2 0.894 116.4 49.4 -57.0 -46.9 2.7 -9.0 50.6 759 654 B A H X S+ 0 0 11 -4,-2.7 4,-1.5 2,-0.2 -1,-0.2 0.876 113.2 43.9 -64.8 -43.1 3.8 -5.5 51.8 760 655 B T H X S+ 0 0 0 -4,-1.6 4,-2.1 2,-0.2 -1,-0.2 0.888 110.6 56.0 -71.9 -36.4 3.2 -3.6 48.5 761 656 B E H X S+ 0 0 98 -4,-2.3 4,-1.7 1,-0.2 -2,-0.2 0.900 109.8 46.2 -60.6 -41.7 -0.2 -5.3 48.0 762 657 B S H X S+ 0 0 43 -4,-1.8 4,-3.3 1,-0.2 -1,-0.2 0.848 108.4 56.2 -70.3 -34.3 -1.3 -4.1 51.4 763 658 B F H X S+ 0 0 0 -4,-1.5 4,-3.9 2,-0.2 -2,-0.2 0.905 104.9 51.6 -65.4 -40.3 0.0 -0.6 50.7 764 659 B I H X S+ 0 0 17 -4,-2.1 4,-2.6 2,-0.2 -1,-0.2 0.940 113.4 45.1 -60.5 -46.3 -2.1 -0.3 47.6 765 660 B K H X S+ 0 0 128 -4,-1.7 4,-2.4 2,-0.2 -2,-0.2 0.945 115.7 46.9 -60.1 -49.4 -5.1 -1.3 49.6 766 661 B H H X S+ 0 0 7 -4,-3.3 4,-2.4 1,-0.2 -2,-0.2 0.941 112.5 50.7 -55.6 -50.1 -4.2 1.1 52.4 767 662 B M H X S+ 0 0 1 -4,-3.9 4,-1.3 1,-0.2 -1,-0.2 0.878 109.1 49.6 -56.2 -45.6 -3.5 3.8 49.9 768 663 B E H >X S+ 0 0 40 -4,-2.6 4,-2.2 1,-0.2 3,-0.6 0.933 110.8 50.0 -60.9 -46.9 -6.9 3.4 48.2 769 664 B N H 3X S+ 0 0 98 -4,-2.4 4,-3.0 1,-0.3 5,-0.3 0.896 107.5 55.3 -58.2 -41.1 -8.6 3.5 51.5 770 665 B E H 3X>S+ 0 0 2 -4,-2.4 6,-1.6 1,-0.2 4,-1.6 0.780 107.3 49.8 -64.1 -29.0 -6.7 6.7 52.3 771 666 B Y H > - 0 0 7 -262,-2.5 4,-2.7 -2,-0.4 3,-1.0 -0.843 13.5-164.1 -96.9 102.2 7.3 8.6 47.2 781 676 B W H 3> S+ 0 0 15 -2,-0.9 4,-2.6 1,-0.2 -1,-0.2 0.917 85.5 62.4 -53.0 -47.4 7.4 6.1 44.4 782 677 B V H 34 S+ 0 0 19 1,-0.2 -1,-0.2 2,-0.2 -263,-0.1 0.814 116.9 30.5 -50.1 -33.9 11.2 6.0 44.4 783 678 B W H <4 S+ 0 0 117 -3,-1.0 -1,-0.2 -265,-0.1 -2,-0.2 0.765 115.1 57.2 -96.8 -33.2 11.1 4.7 47.9 784 679 B I H < S+ 0 0 2 -4,-2.7 -2,-0.2 -266,-0.1 -3,-0.2 0.900 88.6 85.3 -66.4 -41.9 7.8 2.7 47.9 785 680 B V S < S- 0 0 15 -4,-2.6 5,-0.1 -5,-0.2 6,-0.1 -0.432 91.3-113.2 -64.3 125.1 8.9 0.5 45.0 786 681 B P - 0 0 5 0, 0.0 4,-0.3 0, 0.0 -407,-0.2 -0.254 18.8-116.9 -60.1 149.4 10.9 -2.5 46.4 787 682 B P S S+ 0 0 13 0, 0.0 -407,-1.9 0, 0.0 -406,-0.3 0.275 98.8 38.6 -70.7 8.6 14.7 -2.7 45.5 788 683 B M S S+ 0 0 4 -409,-0.2 -411,-0.1 -410,-0.2 -92,-0.1 -0.966 119.1 11.0-156.7 143.5 14.1 -6.0 43.6 789 684 B S S > S+ 0 0 5 -2,-0.3 3,-2.0 -468,-0.1 4,-0.2 0.731 70.4 168.4 60.9 23.3 11.3 -7.2 41.3 790 685 B G G > + 0 0 5 -4,-0.3 3,-1.5 1,-0.3 6,-0.5 0.816 68.4 47.4 -33.2 -59.1 9.8 -3.8 41.1 791 686 B S G 3 S+ 0 0 3 -415,-2.0 -1,-0.3 1,-0.3 -414,-0.1 0.690 102.5 62.2 -67.6 -17.0 7.4 -4.4 38.2 792 687 B I G < S+ 0 0 17 -3,-2.0 -1,-0.3 -416,-0.4 -2,-0.2 0.258 93.2 78.5 -91.1 16.9 6.0 -7.7 39.7 793 688 B T S X S- 0 0 1 -3,-1.5 3,-1.7 -4,-0.2 4,-0.5 -0.988 87.5-126.4-122.2 131.7 4.7 -5.7 42.7 794 689 B P G > S+ 0 0 34 0, 0.0 3,-0.6 0, 0.0 -374,-0.1 0.680 102.5 68.4 -49.6 -26.4 1.5 -3.6 42.3 795 690 B V G > S+ 0 0 0 1,-0.2 3,-1.7 2,-0.2 -10,-0.1 0.825 89.1 64.8 -66.7 -31.4 3.1 -0.4 43.5 796 691 B F G < S+ 0 0 31 -3,-1.7 -1,-0.2 -6,-0.5 -5,-0.1 0.833 103.3 46.7 -59.3 -35.1 5.3 -0.1 40.4 797 692 B H G < S+ 0 0 11 -3,-0.6 -378,-2.6 -4,-0.5 2,-0.5 0.312 96.3 98.2 -91.2 9.7 2.2 0.3 38.3 798 693 B Q B < -R 418 0M 5 -3,-1.7 -380,-0.2 -380,-0.2 2,-0.1 -0.884 67.8-140.0-106.9 118.1 0.7 2.9 40.6 799 694 B E - 0 0 13 -382,-1.8 2,-0.3 -2,-0.5 -762,-0.2 -0.444 27.7-164.0 -69.7 145.5 1.1 6.6 40.0 800 695 B M - 0 0 1 -2,-0.1 -764,-0.6 -766,-0.1 2,-0.5 -0.969 19.8-141.8-137.7 151.8 1.8 8.6 43.2 801 696 B L - 0 0 0 -24,-0.4 -22,-2.2 -2,-0.3 2,-0.6 -0.942 18.4-155.9-112.5 125.7 1.7 12.1 44.4 802 697 B N B +C 33 0C 30 -769,-1.9 -769,-2.4 -2,-0.5 2,-0.3 -0.899 30.5 136.3-108.7 121.6 4.4 13.2 46.7 803 698 B Y - 0 0 0 -2,-0.6 2,-0.4 -771,-0.2 -285,-0.1 -0.978 45.4-105.6-154.7 161.3 3.8 16.1 49.1 804 699 B R + 0 0 83 -369,-0.4 -370,-1.0 -773,-0.3 -369,-0.3 -0.795 30.9 170.5-104.6 133.9 4.5 17.0 52.7 805 700 B L - 0 0 10 -2,-0.4 -372,-0.1 -289,-0.3 -289,-0.0 -0.849 29.5 -96.0-126.3 160.5 2.1 17.2 55.6 806 701 B T S S+ 0 0 18 -2,-0.3 2,-0.2 2,-0.1 -127,-0.1 -0.922 94.5 65.0-123.2 155.5 2.7 17.6 59.4 807 702 B P S S+ 0 0 1 0, 0.0 2,-0.3 0, 0.0 -128,-0.2 0.535 89.2 164.0 -54.4 159.5 2.9 16.1 61.8 808 703 B S E -B 678 0S 7 -130,-1.9 -130,-3.1 -2,-0.2 2,-0.6 -0.996 46.6-122.6-155.7 161.4 6.1 14.7 60.2 809 704 B F E -B 677 0S 29 -296,-0.4 2,-0.3 -2,-0.3 -132,-0.2 -0.927 40.3-178.6-104.9 122.3 9.3 12.8 60.5 810 705 B E E -B 676 0S 35 -134,-3.2 -134,-2.6 -2,-0.6 2,-0.2 -0.740 27.2-109.2-118.5 168.5 12.3 14.9 59.2 811 706 B Y - 0 0 97 -2,-0.3 -136,-0.1 -136,-0.2 -1,-0.0 -0.584 30.8-170.9 -90.4 156.6 16.0 14.5 58.7 812 707 B Q - 0 0 25 -138,-0.4 0, 0.0 -2,-0.2 0, 0.0 -0.988 34.8 -89.2-145.5 147.2 18.4 16.4 60.9 813 708 B P - 0 0 82 0, 0.0 5,-0.1 0, 0.0 0, 0.0 -0.262 56.2 -90.1 -58.5 147.3 22.1 16.7 60.6 814 709 B D >> - 0 0 58 1,-0.1 3,-1.2 3,-0.1 4,-0.6 -0.293 37.2-126.1 -53.2 138.3 24.1 14.1 62.4 815 710 B P H >> S+ 0 0 2 0, 0.0 4,-3.6 0, 0.0 3,-0.6 0.779 103.2 66.4 -63.7 -26.6 24.8 15.4 65.9 816 711 B W H 34 S+ 0 0 49 1,-0.3 -2,-0.1 2,-0.2 -236,-0.0 0.759 100.9 52.9 -68.1 -19.6 28.6 14.9 65.8 817 712 B N H <4 S+ 0 0 112 -3,-1.2 -1,-0.3 1,-0.1 -3,-0.1 0.724 123.7 24.5 -83.7 -24.2 28.7 17.6 63.1 818 713 B T H << S+ 0 0 83 -4,-0.6 -2,-0.2 -3,-0.6 -1,-0.1 0.753 87.7 115.7-112.3 -31.1 26.7 20.1 65.2 819 714 B H < - 0 0 25 -4,-3.6 2,-1.0 -5,-0.1 -245,-0.0 -0.108 57.3-141.0 -48.4 128.3 27.2 19.2 68.9 820 715 B V - 0 0 112 -187,-0.1 -1,-0.1 -246,-0.1 -3,-0.0 -0.817 27.9-136.4 -92.1 100.6 29.0 21.8 70.9 821 716 B W - 0 0 110 -2,-1.0 -187,-0.0 1,-0.1 -1,-0.0 -0.207 20.4-168.1 -59.8 148.4 31.2 19.6 73.2 822 717 B K 0 0 109 1,-0.0 -1,-0.1 0, 0.0 -188,-0.0 0.418 360.0 360.0-117.5 -3.9 31.4 20.4 76.8 823 718 B G 0 0 125 0, 0.0 -2,-0.0 0, 0.0 -1,-0.0 -0.259 360.0 360.0 77.3 360.0 34.3 18.1 77.8