==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=5-DEC-2009 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER OXIDOREDUCTASE 28-SEP-01 1K2S . COMPND 2 MOLECULE: NITRIC-OXIDE SYNTHASE; . SOURCE 2 ORGANISM_SCIENTIFIC: RATTUS NORVEGICUS; . AUTHOR H.LI,P.MARTASEK,B.S.S.MASTERS,T.L.POULOS,C.S.RAMAN . 819 6 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 35286.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 534 65.2 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 10.3 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 . 2 0.2 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 . 94 11.5 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 222 27.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 1.8 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 3 2 1 0 2 1 0 0 0 2 0 0 2 2 1 5 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 0 191 0, 0.0 2,-0.4 0, 0.0 19,-0.1 0.000 360.0 360.0 360.0 144.0 23.0 28.2 39.6 2 300 A F - 0 0 148 17,-0.1 2,-0.5 16,-0.0 15,-0.2 -0.983 360.0-171.0-139.7 125.9 24.5 24.9 40.8 3 301 A L E -A 16 0A 29 13,-1.5 13,-3.1 -2,-0.4 2,-0.3 -0.963 17.5-138.3-118.2 130.7 22.6 21.7 41.8 4 302 A K E -A 15 0A 123 -2,-0.5 2,-0.4 11,-0.2 11,-0.2 -0.628 14.0-169.8 -92.1 147.4 24.4 18.8 43.4 5 303 A V E -A 14 0A 0 9,-2.1 9,-2.6 -2,-0.3 2,-0.3 -0.984 9.3-164.1-136.4 120.0 23.8 15.1 42.7 6 304 A K E -A 13 0A 51 -2,-0.4 380,-1.5 7,-0.2 2,-0.7 -0.824 16.7-146.7-111.5 145.3 25.3 12.4 44.8 7 305 A N B >> -B 385 0B 5 5,-2.1 4,-1.9 -2,-0.3 3,-0.8 -0.936 11.5-158.1-106.0 115.1 25.8 8.7 44.3 8 306 A W T 34 S+ 0 0 86 376,-2.1 377,-0.1 -2,-0.7 -1,-0.1 0.397 88.0 55.5 -76.2 5.7 25.4 7.0 47.7 9 307 A E T 34 S+ 0 0 43 375,-0.3 -1,-0.2 372,-0.1 376,-0.1 0.626 126.4 16.7-108.1 -20.3 27.3 3.9 46.6 10 308 A T T <4 S- 0 0 80 -3,-0.8 -2,-0.2 374,-0.2 3,-0.1 0.310 93.2-130.7-130.3 0.2 30.5 5.7 45.5 11 309 A D < + 0 0 111 -4,-1.9 -3,-0.1 1,-0.2 2,-0.0 0.387 53.6 152.9 62.0 -3.1 29.9 9.1 47.2 12 310 A V - 0 0 58 -5,-0.2 -5,-2.1 -6,-0.1 2,-0.4 -0.326 28.9-158.3 -59.1 132.4 30.7 10.8 43.9 13 311 A V E -A 6 0A 75 -7,-0.2 2,-0.3 -3,-0.1 -7,-0.2 -0.928 7.2-168.0-116.1 138.5 29.0 14.2 43.6 14 312 A L E -A 5 0A 31 -9,-2.6 -9,-2.1 -2,-0.4 2,-0.4 -0.924 15.9-132.7-125.3 151.4 28.3 16.0 40.3 15 313 A T E -A 4 0A 56 -2,-0.3 2,-0.6 -11,-0.2 -11,-0.2 -0.884 14.9-151.0-106.3 133.9 27.2 19.5 39.7 16 314 A D E +A 3 0A 0 -13,-3.1 -13,-1.5 -2,-0.4 347,-0.2 -0.905 33.8 149.5-109.8 121.1 24.3 20.3 37.3 17 315 A T > + 0 0 52 345,-2.8 3,-1.3 -2,-0.6 4,-0.2 0.469 62.8 80.6-119.3 -13.9 24.2 23.6 35.4 18 316 A L G > S+ 0 0 10 344,-2.2 3,-2.1 1,-0.3 345,-0.2 0.816 75.7 73.6 -65.0 -31.1 22.4 22.3 32.4 19 317 A H G > S+ 0 0 19 343,-0.3 3,-1.9 1,-0.3 -1,-0.3 0.758 81.5 73.6 -57.4 -21.0 19.0 22.5 34.2 20 318 A L G < S+ 0 0 96 -3,-1.3 -1,-0.3 1,-0.3 -2,-0.2 0.786 89.8 57.5 -62.5 -27.9 19.2 26.3 33.8 21 319 A K G < S+ 0 0 161 -3,-2.1 -1,-0.3 -4,-0.2 -2,-0.2 0.248 80.6 131.5 -87.2 12.6 18.5 25.8 30.1 22 320 A S < + 0 0 18 -3,-1.9 370,-0.2 1,-0.1 419,-0.1 -0.414 28.4 172.7 -67.0 140.9 15.2 24.1 31.0 23 321 A T + 0 0 57 368,-1.4 -1,-0.1 -2,-0.1 369,-0.1 0.766 48.4 53.5-112.0 -71.6 12.2 25.4 29.2 24 322 A L S S- 0 0 66 367,-0.3 367,-0.4 1,-0.1 2,-0.1 -0.079 82.9 -96.3 -68.9 167.7 9.0 23.4 29.7 25 323 A E - 0 0 131 1,-0.1 415,-0.2 365,-0.1 -1,-0.1 -0.277 15.5-148.7 -81.2 166.9 7.3 22.4 32.9 26 324 A T - 0 0 27 413,-1.4 414,-0.1 2,-0.4 3,-0.1 0.662 41.1-111.5-108.6 -27.5 7.5 19.1 34.8 27 325 A G S S+ 0 0 29 1,-0.6 2,-0.2 412,-0.3 412,-0.1 0.126 87.7 106.4 110.7 -15.7 4.1 18.7 36.4 28 326 A C - 0 0 4 410,-0.2 -1,-0.6 411,-0.2 -2,-0.4 -0.565 46.1-177.4 -94.7 158.5 5.7 19.3 39.8 29 327 A T - 0 0 45 3,-2.7 408,-0.3 -2,-0.2 406,-0.1 -0.640 47.2 -89.8-135.5-168.3 5.6 22.4 42.0 30 328 A E S S+ 0 0 83 -2,-0.2 405,-1.3 1,-0.2 406,-0.2 0.725 127.1 46.0 -82.5 -20.8 7.1 23.4 45.3 31 329 A H S S+ 0 0 94 1,-0.2 2,-0.3 403,-0.2 -1,-0.2 0.493 120.7 25.0 -99.7 -4.5 4.0 21.9 47.1 32 330 A I - 0 0 10 405,-0.1 -3,-2.7 769,-0.1 2,-0.5 -0.910 59.1-147.1-165.0 134.3 3.8 18.6 45.2 33 331 A C B -C 800 0C 9 767,-2.5 767,-2.0 -2,-0.3 3,-0.2 -0.880 9.7-178.6-104.0 130.2 6.0 16.1 43.3 34 332 A M > + 0 0 31 -2,-0.5 3,-2.3 765,-0.2 -1,-0.1 -0.081 35.9 134.5-114.7 29.7 4.5 14.2 40.4 35 333 A G T 3 S+ 0 0 23 1,-0.3 334,-0.1 765,-0.1 -1,-0.1 0.757 72.4 48.5 -51.1 -31.4 7.6 12.2 39.6 36 334 A S T 3 S+ 0 0 18 762,-0.5 2,-0.6 -3,-0.2 -1,-0.3 0.185 81.6 114.6 -98.5 16.8 5.7 8.9 39.4 37 335 A I < - 0 0 8 -3,-2.3 -3,-0.1 760,-0.1 377,-0.0 -0.795 65.2-139.3 -90.8 121.6 2.9 10.2 37.1 38 336 A M S S- 0 0 51 -2,-0.6 -1,-0.1 1,-0.2 -3,-0.0 0.829 86.6 -3.0 -45.6 -42.9 3.1 8.5 33.7 39 337 A L 0 0 89 -3,-0.0 -1,-0.2 -12,-0.0 -12,-0.1 -0.722 360.0 360.0-160.9 102.8 2.3 11.8 31.8 40 338 A P 0 0 102 0, 0.0 -12,-0.1 0, 0.0 -13,-0.0 -0.406 360.0 360.0 -71.3 360.0 1.5 15.2 33.4 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 0 107 0, 0.0 4,-3.9 0, 0.0 5,-0.2 0.000 360.0 360.0 360.0 155.5 2.2 30.3 15.5 43 351 A K H > + 0 0 99 1,-0.2 4,-2.1 2,-0.2 37,-0.0 0.919 360.0 41.9 -51.4 -57.5 4.7 32.7 13.8 44 352 A D H 4 S+ 0 0 120 1,-0.2 -1,-0.2 2,-0.2 0, 0.0 0.865 119.3 47.5 -61.7 -33.9 5.6 34.7 16.9 45 353 A Q H > S+ 0 0 118 1,-0.2 4,-1.2 2,-0.1 -2,-0.2 0.921 111.9 51.9 -71.1 -43.1 5.8 31.5 18.9 46 354 A L H X S+ 0 0 16 -4,-3.9 4,-2.3 1,-0.2 -2,-0.2 0.787 100.2 57.5 -65.9 -36.4 7.8 29.7 16.2 47 355 A F H X S+ 0 0 56 -4,-2.1 4,-3.4 2,-0.2 5,-0.3 0.955 103.9 49.8 -66.9 -48.6 10.7 32.2 15.6 48 356 A P H > S+ 0 0 65 0, 0.0 4,-3.2 0, 0.0 -1,-0.2 0.949 113.6 48.5 -52.4 -47.4 12.0 32.3 19.2 49 357 A L H X S+ 0 0 57 -4,-1.2 4,-2.5 2,-0.2 219,-0.2 0.915 112.2 48.4 -57.1 -46.7 12.0 28.5 19.2 50 358 A A H X S+ 0 0 0 -4,-2.3 4,-3.1 2,-0.2 5,-0.2 0.959 112.8 48.0 -58.8 -52.0 13.8 28.4 15.8 51 359 A K H X S+ 0 0 86 -4,-3.4 4,-2.8 1,-0.2 5,-0.2 0.930 110.3 52.0 -52.4 -52.2 16.4 31.0 17.0 52 360 A E H X S+ 0 0 67 -4,-3.2 4,-2.1 -5,-0.3 -1,-0.2 0.934 113.3 45.2 -49.2 -53.6 17.0 29.0 20.2 53 361 A F H X S+ 0 0 2 -4,-2.5 4,-2.9 1,-0.2 -2,-0.2 0.951 112.0 49.3 -57.3 -56.9 17.6 25.8 18.2 54 362 A L H X S+ 0 0 0 -4,-3.1 4,-3.0 1,-0.2 5,-0.3 0.870 108.9 53.3 -54.0 -40.8 19.8 27.4 15.6 55 363 A D H X S+ 0 0 27 -4,-2.8 4,-2.6 -5,-0.2 -1,-0.2 0.943 109.2 50.2 -60.7 -45.7 22.0 29.0 18.3 56 364 A Q H X S+ 0 0 51 -4,-2.1 4,-2.3 -5,-0.2 -2,-0.2 0.961 112.3 47.3 -54.7 -54.7 22.3 25.6 19.8 57 365 A Y H X S+ 0 0 32 -4,-2.9 4,-1.6 1,-0.2 3,-0.3 0.953 115.2 42.4 -53.3 -59.1 23.3 24.1 16.5 58 366 A Y H X>S+ 0 0 21 -4,-3.0 5,-2.7 1,-0.3 4,-0.5 0.844 111.9 55.9 -59.6 -33.5 25.9 26.7 15.5 59 367 A S H ><5S+ 0 0 71 -4,-2.6 3,-0.9 -5,-0.3 -1,-0.3 0.910 106.6 51.9 -64.8 -38.2 27.2 26.7 19.1 60 368 A S H 3<5S+ 0 0 60 -4,-2.3 -2,-0.2 -3,-0.3 -1,-0.2 0.828 110.2 46.4 -67.8 -32.9 27.8 23.0 18.8 61 369 A I H 3<5S- 0 0 54 -4,-1.6 -1,-0.2 -5,-0.2 -2,-0.2 0.444 117.1-112.1 -89.7 0.9 29.8 23.3 15.5 62 370 A K T <<5S+ 0 0 181 -3,-0.9 -3,-0.2 -4,-0.5 -2,-0.1 0.918 90.2 107.4 70.0 47.5 31.9 26.2 16.9 63 371 A R > < + 0 0 142 -5,-2.7 3,-0.7 -6,-0.1 6,-0.4 -0.094 39.0 158.7-141.8 32.3 30.5 28.9 14.7 64 372 A F T 3 S+ 0 0 135 -6,-0.4 3,-0.1 1,-0.2 -9,-0.1 -0.471 75.5 5.2 -65.1 120.8 28.3 30.8 17.2 65 373 A G T 3 S+ 0 0 39 -2,-0.3 5,-0.3 1,-0.2 -1,-0.2 -0.019 95.4 140.5 96.0 -30.5 27.8 34.3 15.8 66 374 A S S <> S- 0 0 38 -3,-0.7 4,-2.5 3,-0.1 -1,-0.2 0.263 70.3-105.2 -38.1 168.7 29.5 33.6 12.5 67 375 A K H > S+ 0 0 149 2,-0.2 4,-4.3 1,-0.2 5,-0.2 0.968 124.9 56.4 -65.3 -49.1 28.0 35.1 9.3 68 376 A A H > S+ 0 0 48 1,-0.2 4,-2.7 2,-0.2 5,-0.3 0.920 108.0 48.7 -42.2 -55.5 26.8 31.6 8.5 69 377 A H H > S+ 0 0 3 -6,-0.4 4,-2.8 1,-0.2 -1,-0.2 0.958 115.8 41.9 -50.3 -59.8 25.0 31.6 11.8 70 378 A M H X S+ 0 0 88 -4,-2.5 4,-3.0 -5,-0.3 5,-0.2 0.896 111.8 54.7 -58.0 -45.7 23.4 35.0 11.2 71 379 A D H X S+ 0 0 67 -4,-4.3 4,-3.4 2,-0.2 3,-0.3 0.973 113.1 41.9 -51.8 -60.2 22.6 34.3 7.6 72 380 A R H X S+ 0 0 6 -4,-2.7 4,-3.1 1,-0.3 5,-0.3 0.908 111.5 57.2 -52.4 -45.8 20.6 31.2 8.5 73 381 A L H X S+ 0 0 16 -4,-2.8 4,-1.7 -5,-0.3 -1,-0.3 0.917 114.1 38.6 -52.7 -46.3 19.2 33.0 11.4 74 382 A E H X S+ 0 0 116 -4,-3.0 4,-3.1 -3,-0.3 5,-0.2 0.890 112.6 56.2 -72.8 -41.0 17.8 35.6 9.0 75 383 A E H X S+ 0 0 90 -4,-3.4 4,-2.8 -5,-0.2 -2,-0.2 0.918 110.7 44.8 -57.0 -46.8 16.9 33.1 6.3 76 384 A V H X S+ 0 0 0 -4,-3.1 4,-3.1 2,-0.2 5,-0.3 0.924 111.8 53.1 -64.2 -45.5 14.7 31.2 8.7 77 385 A N H X S+ 0 0 57 -4,-1.7 4,-2.2 -5,-0.3 -2,-0.2 0.970 112.4 43.5 -53.2 -58.7 13.2 34.4 10.0 78 386 A K H X S+ 0 0 120 -4,-3.1 4,-1.8 1,-0.2 5,-0.3 0.937 113.5 52.7 -51.8 -51.3 12.2 35.5 6.5 79 387 A E H X S+ 0 0 48 -4,-2.8 4,-2.8 1,-0.3 6,-0.5 0.890 110.4 45.7 -53.9 -46.2 11.0 32.1 5.7 80 388 A I H X S+ 0 0 5 -4,-3.1 4,-1.7 1,-0.2 -1,-0.3 0.845 108.2 61.3 -65.9 -32.4 8.7 31.9 8.7 81 389 A E H < S+ 0 0 129 -4,-2.2 -2,-0.2 -5,-0.3 -1,-0.2 0.877 118.5 24.4 -60.4 -42.3 7.6 35.4 7.9 82 390 A S H < S+ 0 0 97 -4,-1.8 -2,-0.2 -3,-0.2 -1,-0.2 0.705 133.7 32.8 -99.5 -24.0 6.2 34.4 4.5 83 391 A T H < S- 0 0 70 -4,-2.8 -3,-0.2 2,-0.3 -2,-0.2 0.552 93.4-126.0-110.7 -10.7 5.4 30.7 4.9 84 392 A S S < S+ 0 0 66 -4,-1.7 2,-0.3 -5,-0.4 -4,-0.2 0.755 88.6 31.5 70.9 23.5 4.4 30.4 8.6 85 393 A T S S- 0 0 26 -6,-0.5 -2,-0.3 -9,-0.1 2,-0.3 -0.950 73.9-135.4 178.7-173.3 7.1 27.7 9.1 86 394 A Y - 0 0 0 -2,-0.3 2,-0.4 -3,-0.1 -10,-0.1 -0.988 14.7-114.6-162.7 160.5 10.4 26.6 7.8 87 395 A Q - 0 0 98 -2,-0.3 2,-0.4 182,-0.0 -8,-0.1 -0.841 27.5-126.7-105.9 140.0 12.5 23.6 6.6 88 396 A L - 0 0 4 -2,-0.4 5,-0.1 1,-0.1 179,-0.0 -0.690 24.3-119.2 -85.5 129.5 15.5 22.3 8.5 89 397 A K >> - 0 0 98 -2,-0.4 4,-1.7 1,-0.1 3,-1.0 -0.346 35.1-105.7 -62.2 148.2 18.7 21.8 6.5 90 398 A D H 3> S+ 0 0 100 1,-0.3 4,-2.2 2,-0.2 3,-0.4 0.876 119.6 53.7 -41.6 -52.4 19.7 18.1 6.5 91 399 A T H 3> S+ 0 0 74 1,-0.3 4,-1.9 2,-0.2 -1,-0.3 0.843 109.2 47.6 -53.5 -41.5 22.6 18.8 9.0 92 400 A E H <> S+ 0 0 0 -3,-1.0 4,-3.1 2,-0.2 -1,-0.3 0.781 108.7 55.9 -72.6 -29.3 20.3 20.4 11.5 93 401 A L H X S+ 0 0 2 -4,-1.7 4,-2.6 -3,-0.4 -2,-0.2 0.905 108.3 46.8 -69.1 -43.3 17.8 17.6 11.2 94 402 A I H X S+ 0 0 70 -4,-2.2 4,-2.9 2,-0.2 5,-0.3 0.944 116.7 44.2 -62.5 -48.6 20.4 15.0 12.1 95 403 A Y H X S+ 0 0 30 -4,-1.9 4,-2.5 1,-0.2 5,-0.2 0.962 111.7 54.0 -59.5 -52.6 21.6 17.1 15.0 96 404 A G H X S+ 0 0 0 -4,-3.1 4,-1.4 1,-0.2 -2,-0.2 0.898 114.0 41.5 -48.0 -49.3 18.0 17.8 16.0 97 405 A A H >X S+ 0 0 0 -4,-2.6 4,-1.8 2,-0.2 3,-0.6 0.953 112.1 51.0 -66.5 -55.4 17.2 14.1 16.1 98 406 A K H 3X S+ 0 0 57 -4,-2.9 4,-2.3 1,-0.3 -1,-0.2 0.846 114.4 48.7 -53.0 -33.0 20.4 12.8 17.8 99 407 A H H 3X S+ 0 0 13 -4,-2.5 4,-1.4 -5,-0.3 -1,-0.3 0.790 100.2 59.7 -81.3 -27.0 19.7 15.5 20.4 100 408 A A H << S+ 0 0 1 -4,-1.4 296,-0.5 -3,-0.6 4,-0.3 0.898 112.0 45.3 -64.5 -34.9 16.1 14.7 21.0 101 409 A W H >< S+ 0 0 35 -4,-1.8 3,-3.0 1,-0.2 -2,-0.2 0.976 106.4 57.1 -67.8 -57.6 17.5 11.3 22.0 102 410 A R H 3< S+ 0 0 29 -4,-2.3 -1,-0.2 1,-0.3 -2,-0.2 0.743 111.2 46.1 -45.6 -26.8 20.3 12.8 24.0 103 411 A N T 3< S+ 0 0 9 -4,-1.4 2,-1.8 291,-0.1 -1,-0.3 0.504 75.0 120.0 -98.1 -5.3 17.6 14.6 26.0 104 412 A A X - 0 0 28 -3,-3.0 3,-2.8 -4,-0.3 6,-0.1 -0.391 45.4-167.9 -63.5 88.2 15.2 11.6 26.5 105 413 A S T 3 S+ 0 0 22 -2,-1.8 262,-3.7 1,-0.3 -1,-0.2 0.572 83.6 54.5 -54.8 -11.0 15.3 11.6 30.4 106 414 A R T 3 S+ 0 0 58 260,-0.2 2,-0.6 264,-0.1 -1,-0.3 0.427 85.1 98.4-104.3 0.1 13.6 8.2 30.4 107 415 A C X - 0 0 34 -3,-2.8 3,-0.7 -6,-0.2 264,-0.1 -0.795 46.7-174.5 -94.8 118.8 16.2 6.5 28.1 108 416 A V T 3 S+ 0 0 26 -2,-0.6 3,-0.4 1,-0.2 -1,-0.1 0.706 81.8 61.6 -80.6 -21.1 18.8 4.4 29.9 109 417 A G T > + 0 0 28 1,-0.2 3,-1.7 2,-0.1 -1,-0.2 0.068 62.4 120.3 -95.1 26.4 20.7 3.6 26.7 110 418 A R G X + 0 0 0 -3,-0.7 3,-2.1 1,-0.3 4,-0.2 0.544 49.3 89.3 -67.8 -4.4 21.5 7.2 25.8 111 419 A I G 3 S+ 0 0 68 -3,-0.4 3,-0.3 1,-0.3 -1,-0.3 0.832 90.1 50.9 -62.0 -23.2 25.2 6.4 25.9 112 420 A Q G X S+ 0 0 50 -3,-1.7 3,-1.2 1,-0.2 -1,-0.3 0.317 74.9 120.4 -92.4 6.1 24.6 5.6 22.2 113 421 A W T < S+ 0 0 41 -3,-2.1 -1,-0.2 1,-0.3 -11,-0.2 0.764 73.4 46.8 -42.6 -41.5 22.9 8.9 21.4 114 422 A S T 3 S+ 0 0 59 -3,-0.3 2,-1.9 -4,-0.2 -1,-0.3 0.788 94.8 76.1 -76.2 -28.8 25.4 10.1 18.8 115 423 A K S < S+ 0 0 136 -3,-1.2 2,-0.4 -17,-0.1 34,-0.3 -0.548 70.5 136.0 -84.4 73.9 25.5 6.8 16.9 116 424 A L - 0 0 19 -2,-1.9 2,-0.6 32,-0.1 34,-0.2 -0.987 49.8-140.8-129.8 129.5 22.2 7.3 15.2 117 425 A Q E -d 150 0D 74 32,-1.5 34,-1.6 -2,-0.4 2,-0.6 -0.762 20.6-157.3 -89.3 123.3 21.2 6.7 11.6 118 426 A V E -d 151 0D 23 -2,-0.6 2,-0.6 32,-0.2 34,-0.2 -0.903 7.1-164.2-110.1 121.4 18.8 9.3 10.3 119 427 A F E -d 152 0D 51 32,-3.0 34,-2.7 -2,-0.6 2,-1.2 -0.913 14.4-145.2-105.3 113.8 16.5 8.7 7.3 120 428 A D E +d 153 0D 49 -2,-0.6 3,-0.4 32,-0.2 34,-0.1 -0.653 29.8 164.6 -79.7 95.4 15.1 11.9 5.8 121 429 A A > + 0 0 0 32,-1.7 3,-1.6 -2,-1.2 -1,-0.2 0.097 36.3 116.6-101.0 24.2 11.7 10.8 4.8 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A I > + 0 0 4 -8,-2.8 4,-1.9 1,-0.2 5,-0.3 0.396 38.7 98.7 -97.4 4.2 3.3 -15.8 32.5 299 607 A L H > S+ 0 0 7 -9,-0.2 4,-2.5 -8,-0.2 5,-0.3 0.918 79.0 56.2 -57.8 -48.4 4.4 -16.1 36.2 300 608 A E H > S+ 0 0 97 -3,-0.3 4,-3.1 2,-0.2 -1,-0.2 0.949 113.0 40.4 -45.7 -64.7 1.8 -18.7 37.1 301 609 A E H > S+ 0 0 76 -4,-0.3 4,-3.0 1,-0.2 5,-0.3 0.952 114.6 49.1 -48.6 -67.3 2.9 -21.2 34.4 302 610 A V H < S+ 0 0 0 -4,-1.9 4,-0.3 1,-0.2 -1,-0.2 0.844 114.6 48.2 -45.8 -40.3 6.6 -20.8 34.7 303 611 A A H >X S+ 0 0 0 -4,-2.5 3,-2.6 -5,-0.3 4,-1.1 0.987 110.9 48.9 -66.2 -57.7 6.3 -21.2 38.4 304 612 A K H >< S+ 0 0 135 -4,-3.1 3,-2.4 1,-0.3 -2,-0.2 0.934 110.6 51.0 -44.7 -58.0 4.1 -24.3 38.2 305 613 A K T 3< S+ 0 0 95 -4,-3.0 -1,-0.3 1,-0.3 -2,-0.2 0.586 108.5 53.7 -58.7 -10.0 6.5 -25.9 35.7 306 614 A M T <4 S- 0 0 37 -3,-2.6 -1,-0.3 -5,-0.3 -2,-0.2 0.594 106.6-132.3 -97.4 -15.9 9.3 -25.1 38.2 307 615 A D << + 0 0 149 -3,-2.4 2,-0.3 -4,-1.1 -3,-0.2 0.999 47.2 157.7 59.9 72.1 7.4 -26.9 40.9 308 616 A L - 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