==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=21-JUN-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER HYDROLASE 07-MAY-13 4KL7 . COMPND 2 MOLECULE: RESUSCITATION-PROMOTING FACTOR RPFB; . SOURCE 2 ORGANISM_SCIENTIFIC: MYCOBACTERIUM TUBERCULOSIS; . AUTHOR F.SQUEGLIA,M.ROMANO,A.RUGGIERO,R.BERISIO . 320 4 4 4 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14906.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 201 62.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 10 3.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 4 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 0 0.0 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 . 4 1.2 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 43 13.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 121 37.8 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 15 4.7 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 1 2 4 1 0 0 4 0 0 0 0 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 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 0 0 0 0 PARALLEL BRIDGES PER LADDER . 2 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 0 0 ANTIPARALLEL BRIDGES PER LADDER . 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 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 1 283 A S >> 0 0 114 0, 0.0 3,-1.3 0, 0.0 4,-0.9 0.000 360.0 360.0 360.0 90.7 -0.3 13.5 -5.2 2 284 A I H 3> + 0 0 54 1,-0.3 4,-2.1 2,-0.2 3,-0.4 0.821 360.0 63.6 -57.5 -33.8 0.8 10.2 -3.6 3 285 A W H 3> S+ 0 0 8 1,-0.2 4,-2.8 2,-0.2 -1,-0.3 0.795 95.4 58.2 -66.1 -27.8 4.0 10.1 -5.6 4 286 A D H <> S+ 0 0 54 -3,-1.3 4,-1.9 2,-0.2 -1,-0.2 0.870 106.7 48.4 -68.0 -34.6 5.3 13.3 -3.9 5 287 A A H X S+ 0 0 49 -4,-0.9 4,-2.0 -3,-0.4 -2,-0.2 0.913 112.8 48.5 -68.0 -41.9 4.9 11.5 -0.6 6 288 A I H X S+ 0 0 0 -4,-2.1 4,-2.9 1,-0.2 -2,-0.2 0.943 112.3 49.6 -62.3 -42.4 6.8 8.5 -2.0 7 289 A A H X S+ 0 0 0 -4,-2.8 4,-2.4 2,-0.2 6,-2.1 0.820 106.5 53.6 -69.6 -31.1 9.5 10.8 -3.4 8 290 A G H X S+ 0 0 26 -4,-1.9 4,-1.6 4,-0.3 -1,-0.2 0.947 115.3 42.8 -64.1 -42.5 9.9 12.6 -0.1 9 291 A a H < S+ 0 0 6 -4,-2.0 93,-0.3 2,-0.2 -2,-0.2 0.894 122.1 37.3 -66.2 -44.6 10.5 9.2 1.4 10 292 A E H < S+ 0 0 39 -4,-2.9 -3,-0.2 16,-0.3 -2,-0.2 0.875 140.6 2.4 -79.1 -38.2 12.7 7.8 -1.3 11 293 A A H >< S- 0 0 9 -4,-2.4 3,-1.5 15,-0.4 -3,-0.2 0.137 95.5-103.9-143.6 17.2 14.8 10.8 -2.3 12 294 A G T 3< S- 0 0 51 -4,-1.6 -4,-0.3 1,-0.2 -3,-0.1 0.802 83.0 -58.3 53.9 31.0 13.8 13.8 -0.1 13 295 A G T 3 S+ 0 0 42 -6,-2.1 2,-1.0 13,-0.3 -1,-0.2 0.642 102.3 134.7 79.0 13.2 11.8 15.3 -2.9 14 296 A N X - 0 0 79 -3,-1.5 3,-1.5 -7,-0.4 -1,-0.2 -0.793 29.5-179.5 -99.1 96.7 14.8 15.4 -5.3 15 297 A W T 3 S+ 0 0 34 -2,-1.0 11,-0.8 1,-0.3 34,-0.2 0.650 80.4 54.5 -72.3 -14.5 13.5 14.1 -8.6 16 298 A A T 3 S+ 0 0 62 9,-0.2 -1,-0.3 -5,-0.1 31,-0.1 0.246 78.5 140.8 -96.4 12.4 16.9 14.5 -10.2 17 299 A I < + 0 0 30 -3,-1.5 8,-3.0 7,-0.1 2,-0.2 -0.236 18.6 165.8 -68.4 142.6 18.8 12.5 -7.6 18 300 A N + 0 0 78 6,-0.2 6,-0.1 1,-0.1 -1,-0.1 -0.635 6.0 159.2-154.8 83.4 21.6 10.3 -8.8 19 301 A T - 0 0 27 4,-0.4 73,-0.1 -2,-0.2 5,-0.1 0.665 58.7-108.5 -90.1 -17.6 23.8 9.2 -6.0 20 302 A G S S+ 0 0 27 3,-0.5 70,-0.1 71,-0.1 71,-0.1 0.511 83.0 121.8 100.0 8.0 25.4 6.1 -7.4 21 303 A N S S- 0 0 16 2,-0.4 132,-0.2 69,-0.3 133,-0.2 0.232 92.5 -94.6 -87.5 11.9 23.4 3.6 -5.2 22 304 A G S S+ 0 0 22 1,-0.3 9,-0.5 131,-0.1 2,-0.3 0.394 100.1 92.0 90.9 -4.8 21.9 1.7 -8.1 23 305 A Y E -A 30 0A 102 7,-0.2 -3,-0.5 8,-0.1 -4,-0.4 -0.891 57.8-154.0-129.2 156.6 18.7 3.8 -8.0 24 306 A Y E > -A 29 0A 44 5,-2.1 5,-2.0 -2,-0.3 3,-0.3 -0.983 39.6 -13.3-141.3 136.8 17.7 6.9 -9.8 25 307 A G T > 5S- 0 0 0 -8,-3.0 3,-1.4 -2,-0.4 -9,-0.2 -0.100 97.6 -32.2 76.2-168.8 15.4 9.9 -9.4 26 308 A G T 3 5S+ 0 0 0 -11,-0.8 -15,-0.4 1,-0.3 -13,-0.3 0.743 139.0 32.6 -62.9 -34.8 12.5 10.8 -7.2 27 309 A V T 3 5S- 0 0 1 -3,-0.3 -1,-0.3 -12,-0.2 -2,-0.1 0.185 109.4-117.3-110.7 15.6 11.1 7.3 -6.7 28 310 A Q T < 5 - 0 0 26 -3,-1.4 2,-0.3 1,-0.2 -3,-0.2 0.911 39.7-172.7 53.6 57.3 14.5 5.5 -6.9 29 311 A F E < -A 24 0A 6 -5,-2.0 -5,-2.1 -6,-0.1 2,-0.2 -0.588 19.3-133.8 -70.5 135.7 14.0 3.4 -9.9 30 312 A D E > -A 23 0A 62 -2,-0.3 4,-2.4 -7,-0.2 -7,-0.2 -0.531 30.0-109.5 -79.1 162.1 16.7 0.9 -10.7 31 313 A Q H > S+ 0 0 48 -9,-0.5 4,-2.7 1,-0.2 5,-0.3 0.910 114.9 54.8 -66.3 -38.7 17.6 0.9 -14.3 32 314 A G H > S+ 0 0 50 1,-0.2 4,-2.8 2,-0.2 -1,-0.2 0.914 111.2 45.2 -61.8 -39.4 16.1 -2.4 -15.2 33 315 A T H > S+ 0 0 28 2,-0.2 4,-1.6 1,-0.2 6,-0.2 0.880 110.3 54.5 -72.0 -39.2 12.7 -1.4 -13.9 34 316 A W H <>S+ 0 0 1 -4,-2.4 5,-2.6 1,-0.2 3,-0.3 0.964 115.5 39.7 -56.0 -49.5 12.9 2.0 -15.6 35 317 A E H ><5S+ 0 0 94 -4,-2.7 3,-1.5 1,-0.2 5,-0.2 0.908 111.5 55.6 -69.1 -43.7 13.5 0.3 -18.9 36 318 A A H 3<5S+ 0 0 58 -4,-2.8 -1,-0.2 -5,-0.3 -2,-0.2 0.783 108.5 49.2 -60.3 -27.4 11.1 -2.6 -18.4 37 319 A N T 3<5S- 0 0 10 -4,-1.6 -1,-0.3 -3,-0.3 -2,-0.2 0.162 127.3 -92.4-104.8 19.9 8.2 -0.1 -17.7 38 320 A G T X 5S+ 0 0 38 -3,-1.5 3,-1.7 22,-0.1 4,-0.3 0.558 77.5 141.1 88.7 14.2 8.8 2.0 -20.8 39 321 A G G >>< + 0 0 0 -5,-2.6 4,-2.1 1,-0.3 3,-2.0 0.770 59.5 70.7 -61.8 -31.5 11.2 4.7 -19.3 40 322 A L G 34 S+ 0 0 94 1,-0.3 -1,-0.3 -6,-0.2 -5,-0.1 0.694 85.6 69.6 -63.3 -17.2 13.5 5.0 -22.3 41 323 A R G <4 S+ 0 0 223 -3,-1.7 -1,-0.3 1,-0.1 -2,-0.2 0.784 112.7 30.2 -65.0 -29.3 10.7 6.7 -24.2 42 324 A Y T <4 S- 0 0 100 -3,-2.0 -2,-0.2 1,-0.3 -1,-0.1 0.817 132.1 -23.3 -97.5 -44.9 11.1 9.6 -21.9 43 325 A A < - 0 0 10 -4,-2.1 -1,-0.3 6,-0.1 6,-0.1 -0.985 60.0 -99.1-165.1 163.6 14.8 9.6 -20.9 44 326 A P S S+ 0 0 81 0, 0.0 2,-0.3 0, 0.0 -4,-0.1 0.851 107.2 5.8 -61.2 -34.1 17.9 7.5 -20.6 45 327 A R S >> S- 0 0 73 -6,-0.1 3,-1.5 -11,-0.1 4,-0.5 -0.948 82.3-103.2-143.1 164.9 17.4 7.1 -16.8 46 328 A A G >4 S+ 0 0 0 -2,-0.3 3,-1.3 1,-0.3 -20,-0.2 0.857 117.5 57.4 -59.8 -40.4 14.7 8.1 -14.3 47 329 A D G 34 S+ 0 0 16 1,-0.3 -1,-0.3 -22,-0.2 4,-0.1 0.643 104.1 53.8 -70.0 -13.4 16.7 11.0 -12.9 48 330 A L G <4 S+ 0 0 91 -3,-1.5 -1,-0.3 2,-0.1 2,-0.2 0.482 97.3 81.1 -96.2 -6.2 17.0 12.6 -16.4 49 331 A A S << S- 0 0 8 -3,-1.3 -6,-0.1 -4,-0.5 2,-0.0 -0.607 89.5-102.7 -94.3 157.6 13.2 12.4 -16.9 50 332 A T > - 0 0 56 -2,-0.2 4,-3.2 1,-0.1 5,-0.3 -0.337 34.1-103.4 -74.0 160.7 10.8 15.1 -15.5 51 333 A R H > S+ 0 0 75 1,-0.2 4,-2.7 2,-0.2 5,-0.2 0.929 124.2 50.4 -44.9 -47.9 8.7 14.4 -12.3 52 334 A E H > S+ 0 0 109 1,-0.2 4,-2.2 2,-0.2 -1,-0.2 0.878 111.7 46.7 -64.1 -39.8 5.7 13.9 -14.5 53 335 A E H > S+ 0 0 63 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.901 111.8 50.7 -68.8 -44.2 7.5 11.4 -16.8 54 336 A Q H X S+ 0 0 1 -4,-3.2 4,-2.5 1,-0.2 -2,-0.2 0.928 110.8 50.7 -59.7 -42.4 8.9 9.5 -13.8 55 337 A I H X S+ 0 0 23 -4,-2.7 4,-2.6 -5,-0.3 -2,-0.2 0.911 106.8 53.4 -60.0 -43.6 5.3 9.4 -12.4 56 338 A A H X S+ 0 0 35 -4,-2.2 4,-1.7 1,-0.2 -1,-0.2 0.924 112.1 44.4 -57.9 -46.3 3.9 8.0 -15.6 57 339 A V H X S+ 0 0 2 -4,-2.2 4,-2.5 1,-0.2 -1,-0.2 0.891 111.8 54.4 -64.6 -38.0 6.5 5.2 -15.6 58 340 A A H X S+ 0 0 0 -4,-2.5 4,-3.0 -5,-0.2 -2,-0.2 0.879 104.2 54.7 -63.6 -36.5 5.7 4.7 -11.9 59 341 A E H X S+ 0 0 88 -4,-2.6 4,-2.0 2,-0.2 -1,-0.2 0.921 111.1 44.5 -62.4 -46.3 2.0 4.3 -12.6 60 342 A V H X S+ 0 0 63 -4,-1.7 4,-2.6 2,-0.2 -2,-0.2 0.905 114.2 50.4 -62.3 -43.9 2.7 1.5 -15.1 61 343 A T H X>S+ 0 0 0 -4,-2.5 4,-3.5 1,-0.2 5,-0.6 0.928 109.9 49.3 -61.3 -46.9 5.2 -0.1 -12.7 62 344 A R H X5S+ 0 0 67 -4,-3.0 4,-1.7 2,-0.2 -1,-0.2 0.885 111.7 49.4 -61.8 -37.7 2.7 0.0 -9.8 63 345 A L H <5S+ 0 0 138 -4,-2.0 -2,-0.2 -5,-0.2 -1,-0.2 0.926 120.2 36.4 -66.0 -43.5 0.1 -1.6 -12.0 64 346 A R H <5S+ 0 0 174 -4,-2.6 -2,-0.2 -5,-0.1 -1,-0.2 0.865 135.3 18.7 -74.7 -41.2 2.5 -4.3 -13.2 65 347 A Q H <5S- 0 0 92 -4,-3.5 3,-0.3 1,-0.2 -3,-0.2 0.572 99.2-127.8-112.9 -16.5 4.5 -5.0 -10.0 66 348 A G ><< - 0 0 24 -4,-1.7 3,-1.3 -5,-0.6 -1,-0.2 -0.187 44.7 -59.4 86.4 175.7 2.4 -3.5 -7.1 67 349 A W G > S+ 0 0 29 1,-0.3 3,-2.4 2,-0.1 7,-0.3 0.639 116.8 88.7 -69.2 -11.6 3.3 -1.1 -4.4 68 350 A G G 3 + 0 0 63 1,-0.3 -1,-0.3 -3,-0.3 -2,-0.1 0.553 67.2 78.8 -64.3 -11.2 6.0 -3.6 -3.3 69 351 A A G < S+ 0 0 37 -3,-1.3 -1,-0.3 1,-0.3 -2,-0.1 0.685 101.1 39.7 -63.0 -20.4 8.3 -1.8 -5.7 70 352 A W S <> S- 0 0 5 -3,-2.4 4,-2.3 -4,-0.1 5,-0.4 -0.693 84.7-168.8-127.6 73.8 8.7 0.9 -2.9 71 353 A P T 4 S+ 0 0 113 0, 0.0 -1,-0.1 0, 0.0 -3,-0.1 0.496 77.0 5.2 -49.6 -26.6 8.8 -1.4 0.3 72 354 A V T > S+ 0 0 46 3,-0.0 4,-2.2 30,-0.0 3,-0.3 0.522 125.2 62.1-122.5 -41.3 8.4 1.2 3.2 73 355 A a H > S+ 0 0 3 1,-0.2 4,-1.5 2,-0.2 6,-0.2 0.803 95.8 58.8 -69.5 -31.8 7.8 4.4 1.3 74 356 A A H <>S+ 0 0 6 -4,-2.3 5,-2.8 -7,-0.3 -1,-0.2 0.931 110.0 45.5 -57.9 -44.9 4.5 3.3 -0.4 75 357 A A H >45S+ 0 0 35 -5,-0.4 3,-1.8 -3,-0.3 -2,-0.2 0.906 108.5 55.6 -65.2 -43.4 3.1 2.7 3.2 76 358 A R H 3<5S+ 0 0 64 -4,-2.2 -1,-0.2 1,-0.3 -2,-0.2 0.824 106.9 51.6 -60.4 -28.4 4.4 6.1 4.4 77 359 A A T 3<5S- 0 0 21 -4,-1.5 -1,-0.3 -3,-0.2 -2,-0.2 0.428 126.0-102.4 -88.7 1.6 2.5 7.7 1.5 78 360 A G T < 5 - 0 0 44 -3,-1.8 -3,-0.2 125,-0.2 -2,-0.1 0.377 57.5-167.4 99.4 1.5 -0.7 5.9 2.5 79 361 A A < 0 0 16 -5,-2.8 -1,-0.2 -6,-0.2 -5,-0.0 0.248 360.0 360.0 -54.4 140.6 -0.5 3.3 -0.2 80 362 A R 0 0 136 -6,-0.0 -2,-0.0 -14,-0.0 -6,-0.0 0.983 360.0 360.0 -44.4 360.0 -3.1 0.8 -1.4 81 !* 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 82 283 B S >> 0 0 116 0, 0.0 3,-1.3 0, 0.0 4,-1.1 0.000 360.0 360.0 360.0 73.6 37.7 8.7 3.9 83 284 B I H 3> + 0 0 58 1,-0.3 4,-2.4 2,-0.2 5,-0.2 0.834 360.0 64.6 -57.3 -31.8 35.8 5.7 2.3 84 285 B W H 3> S+ 0 0 8 1,-0.2 4,-2.5 2,-0.2 -1,-0.3 0.823 95.5 56.3 -67.6 -26.9 32.9 6.7 4.5 85 286 B D H <> S+ 0 0 51 -3,-1.3 4,-1.8 2,-0.2 -1,-0.2 0.888 108.5 47.1 -68.1 -40.3 32.5 10.0 2.6 86 287 B A H X S+ 0 0 54 -4,-1.1 4,-2.2 2,-0.2 -2,-0.2 0.927 113.8 48.5 -62.0 -44.8 32.2 8.1 -0.7 87 288 B I H X S+ 0 0 0 -4,-2.4 4,-2.8 1,-0.2 -2,-0.2 0.910 110.6 50.3 -62.1 -41.9 29.7 5.7 0.9 88 289 B A H X S+ 0 0 0 -4,-2.5 4,-2.5 2,-0.2 6,-2.3 0.837 107.7 54.2 -66.9 -32.9 27.7 8.7 2.3 89 290 B G H X S+ 0 0 25 -4,-1.8 4,-1.6 4,-0.3 -2,-0.2 0.957 114.2 41.9 -60.6 -47.8 27.7 10.3 -1.2 90 291 B b H < S+ 0 0 12 -4,-2.2 -69,-0.3 2,-0.2 -2,-0.2 0.879 122.5 37.7 -67.3 -42.5 26.2 7.1 -2.5 91 292 B E H < S+ 0 0 39 -4,-2.8 -3,-0.2 16,-0.3 -2,-0.2 0.881 138.5 5.6 -81.1 -36.0 23.7 6.5 0.3 92 293 B A H >< S- 0 0 8 -4,-2.5 3,-1.7 15,-0.4 -3,-0.2 0.156 95.9-103.9-139.5 14.6 22.6 10.0 1.1 93 294 B G T 3< S- 0 0 52 -4,-1.6 -4,-0.3 1,-0.2 -3,-0.1 0.784 82.6 -61.0 58.4 26.4 24.1 12.5 -1.4 94 295 B G T 3 S+ 0 0 38 -6,-2.3 2,-1.1 13,-0.3 -1,-0.2 0.577 99.8 138.8 78.7 6.6 26.5 13.5 1.3 95 296 B N X - 0 0 78 -3,-1.7 3,-1.6 -7,-0.4 -1,-0.2 -0.750 30.2-175.3 -90.1 98.0 23.7 14.7 3.7 96 297 B W T 3 S+ 0 0 42 -2,-1.1 11,-0.9 1,-0.3 34,-0.2 0.663 84.0 49.4 -67.5 -19.9 24.9 13.5 7.1 97 298 B A T 3 S+ 0 0 61 9,-0.2 -1,-0.3 10,-0.1 31,-0.1 0.189 80.2 143.2-101.8 14.9 21.6 14.7 8.7 98 299 B I < + 0 0 30 -3,-1.6 8,-2.9 7,-0.1 2,-0.2 -0.259 16.0 164.8 -64.7 140.3 19.3 13.1 6.2 99 300 B N + 0 0 74 6,-0.2 6,-0.1 29,-0.1 -1,-0.1 -0.633 5.5 158.3-156.1 84.5 16.0 11.7 7.6 100 301 B T - 0 0 27 4,-0.4 -89,-0.1 -91,-0.2 -88,-0.1 0.586 59.9-107.1 -90.6 -13.4 13.5 11.0 4.8 101 302 B G S S+ 0 0 22 3,-0.4 -92,-0.1 -91,-0.1 -25,-0.1 0.529 83.1 123.4 92.7 11.3 11.2 8.4 6.6 102 303 B N S S- 0 0 21 2,-0.4 -29,-0.1 -93,-0.3 3,-0.1 0.364 91.6 -95.3 -85.0 8.7 12.5 5.5 4.5 103 304 B G S S+ 0 0 12 1,-0.3 9,-0.5 -31,-0.1 2,-0.3 0.358 99.7 90.0 92.9 -5.0 13.5 3.4 7.6 104 305 B Y - 0 0 101 7,-0.2 -4,-0.4 8,-0.1 -3,-0.4 -0.889 58.7-152.0-130.0 157.7 17.1 4.6 7.5 105 306 B Y B > -B 110 0B 6 5,-2.3 5,-1.8 -2,-0.3 3,-0.3 -0.980 40.4 -10.1-139.9 137.8 19.0 7.6 9.0 106 307 B G T > 5S- 0 0 0 -8,-2.9 3,-1.5 -2,-0.4 -9,-0.2 -0.102 97.3 -34.2 77.8-172.2 21.9 9.8 8.4 107 308 B G T 3 5S+ 0 0 0 -11,-0.9 -15,-0.4 1,-0.3 -13,-0.3 0.727 138.6 34.1 -61.3 -34.8 24.9 9.9 5.9 108 309 B V T 3 5S- 0 0 0 -3,-0.3 -1,-0.3 -12,-0.2 -2,-0.1 0.248 109.8-117.5-111.5 15.3 25.4 6.1 5.7 109 310 B Q T < 5 - 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0 0 22 -3,-1.5 2,-0.3 1,-0.2 -3,-0.2 0.910 38.3-172.1 50.6 58.9 12.2 28.6 27.5 272 311 D F E < -D 267 0D 6 -5,-1.8 -5,-2.1 -6,-0.1 -1,-0.2 -0.530 18.3-134.8 -71.0 138.5 11.1 25.5 25.6 273 312 D D E > -D 266 0D 55 -2,-0.3 4,-2.1 -7,-0.2 -7,-0.2 -0.515 30.9-107.5 -79.6 164.8 12.9 22.2 26.3 274 313 D Q H > S+ 0 0 47 -9,-0.5 4,-2.6 1,-0.2 5,-0.2 0.877 116.9 56.0 -67.0 -37.9 13.8 20.3 23.2 275 314 D G H > S+ 0 0 17 1,-0.2 4,-2.2 2,-0.2 -98,-0.3 0.884 110.9 44.7 -57.2 -42.7 11.1 17.6 23.7 276 315 D T H > S+ 0 0 20 2,-0.2 4,-1.5 1,-0.2 6,-0.3 0.902 111.9 52.1 -74.4 -39.4 8.4 20.2 23.8 277 316 D W H <>S+ 0 0 0 -4,-2.1 5,-2.7 1,-0.2 6,-0.3 0.948 115.1 42.1 -56.1 -48.7 9.7 22.2 20.8 278 317 D E H ><5S+ 0 0 65 -4,-2.6 3,-1.3 1,-0.2 5,-0.2 0.898 111.8 54.2 -69.1 -42.4 9.9 19.0 18.7 279 318 D A H 3<5S+ 0 0 8 -4,-2.2 -1,-0.2 1,-0.2 -2,-0.2 0.816 110.0 47.6 -62.7 -29.3 6.4 17.7 19.9 280 319 D N T 3<5S- 0 0 9 -4,-1.5 -1,-0.2 -3,-0.2 -2,-0.2 0.200 125.5 -91.6-109.4 19.3 4.6 20.9 18.9 281 320 D G T X 5S+ 0 0 26 -3,-1.3 3,-1.8 -4,-0.1 4,-0.3 0.463 79.5 135.5 94.4 7.4 6.0 21.4 15.5 282 321 D G G >>< + 0 0 0 -5,-2.7 4,-2.3 1,-0.3 3,-2.1 0.773 61.9 70.3 -58.1 -31.8 9.0 23.6 16.1 283 322 D L G 34 S+ 0 0 95 -6,-0.3 -1,-0.3 1,-0.3 -5,-0.1 0.726 86.9 68.7 -64.2 -18.4 11.4 21.6 13.9 284 323 D R G <4 S+ 0 0 201 -3,-1.8 -1,-0.3 1,-0.1 -2,-0.2 0.798 113.8 28.2 -63.8 -25.5 9.4 23.0 10.9 285 324 D Y T <4 S- 0 0 94 -3,-2.1 -2,-0.2 1,-0.4 -1,-0.1 0.817 133.3 -15.5-103.6 -45.6 10.8 26.4 11.8 286 325 D A < - 0 0 8 -4,-2.3 -1,-0.4 6,-0.1 6,-0.1 -0.984 60.8-106.5-160.3 158.8 14.2 25.9 13.4 287 326 D P S S+ 0 0 87 0, 0.0 2,-0.3 0, 0.0 -4,-0.1 0.711 106.2 10.5 -67.8 -21.0 16.2 23.1 15.0 288 327 D R S > S- 0 0 74 -6,-0.1 3,-1.4 -11,-0.1 4,-0.4 -0.967 84.1-105.3-148.5 160.5 15.6 24.6 18.5 289 328 D A G > S+ 0 0 0 -2,-0.3 3,-1.6 1,-0.3 -20,-0.2 0.869 114.8 57.4 -57.0 -42.6 13.4 27.3 19.8 290 329 D D G 3 S+ 0 0 15 1,-0.3 -1,-0.3 -22,-0.2 -22,-0.1 0.703 102.8 56.2 -63.5 -20.3 16.0 30.0 20.3 291 330 D L G < S+ 0 0 101 -3,-1.4 -1,-0.3 2,-0.1 2,-0.2 0.465 95.4 82.5 -91.1 -6.3 16.9 29.7 16.5 292 331 D A S < S- 0 0 9 -3,-1.6 -6,-0.1 -4,-0.4 -10,-0.0 -0.564 90.2 -98.1 -90.9 159.9 13.3 30.5 15.5 293 332 D T > - 0 0 59 -2,-0.2 4,-2.8 1,-0.1 5,-0.2 -0.296 35.1-106.2 -69.4 160.1 11.9 34.0 15.2 294 333 D R H > S+ 0 0 71 1,-0.2 4,-2.5 2,-0.2 5,-0.2 0.924 123.5 50.2 -49.2 -46.3 9.8 35.4 18.1 295 334 D E H > S+ 0 0 109 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.893 110.0 49.1 -69.4 -36.0 6.7 34.9 15.9 296 335 D E H > S+ 0 0 60 2,-0.2 4,-2.3 1,-0.2 -1,-0.2 0.906 111.2 50.6 -63.4 -46.2 7.6 31.3 15.1 297 336 D Q H X S+ 0 0 1 -4,-2.8 4,-2.6 1,-0.2 -2,-0.2 0.905 109.9 50.3 -58.7 -43.2 8.2 30.6 18.9 298 337 D I H X S+ 0 0 24 -4,-2.5 4,-2.5 2,-0.2 -1,-0.2 0.906 107.6 53.3 -64.0 -42.3 4.8 32.1 19.7 299 338 D A H X S+ 0 0 38 -4,-2.1 4,-2.0 2,-0.2 -2,-0.2 0.946 112.4 44.1 -57.1 -47.5 3.0 30.0 17.1 300 339 D V H X S+ 0 0 2 -4,-2.3 4,-2.9 1,-0.2 -2,-0.2 0.918 112.8 53.0 -64.9 -39.4 4.6 26.8 18.6 301 340 D A H X S+ 0 0 0 -4,-2.6 4,-2.9 -5,-0.2 -1,-0.2 0.875 106.5 53.2 -60.8 -40.4 3.7 28.1 22.1 302 341 D E H X S+ 0 0 89 -4,-2.5 4,-2.3 2,-0.2 -1,-0.2 0.907 110.4 45.6 -63.4 -41.1 0.1 28.6 21.1 303 342 D V H X S+ 0 0 52 -4,-2.0 4,-1.7 2,-0.2 -2,-0.2 0.916 114.4 50.2 -66.6 -44.3 -0.2 25.0 19.8 304 343 D T H X S+ 0 0 0 -4,-2.9 4,-2.9 2,-0.2 5,-0.4 0.920 110.7 48.4 -55.9 -48.3 1.6 23.9 23.1 305 344 D R H X S+ 0 0 79 -4,-2.9 4,-2.7 1,-0.2 -2,-0.2 0.919 108.0 55.0 -62.3 -40.7 -0.8 25.9 25.2 306 345 D L H < S+ 0 0 117 -4,-2.3 -1,-0.2 1,-0.2 -2,-0.2 0.874 118.6 34.8 -57.3 -40.8 -3.8 24.5 23.3 307 346 D R H < S+ 0 0 54 -4,-1.7 -2,-0.2 -5,-0.1 -141,-0.2 0.802 135.1 20.9 -85.1 -31.9 -2.6 20.9 24.1 308 347 D Q H < S- 0 0 80 -4,-2.9 3,-0.4 1,-0.2 -3,-0.2 0.546 96.5-130.3-117.0 -15.0 -1.1 21.4 27.6 309 348 D G >< - 0 0 24 -4,-2.7 3,-1.1 -5,-0.4 -1,-0.2 -0.249 49.4 -54.4 78.4-176.4 -2.6 24.6 29.1 310 349 D W G > S+ 0 0 41 13,-0.3 3,-2.1 1,-0.3 7,-0.3 0.622 116.5 89.3 -75.9 -10.4 -0.8 27.5 30.7 311 350 D G G 3 + 0 0 57 -3,-0.4 -1,-0.3 1,-0.3 -2,-0.1 0.603 65.1 78.1 -63.7 -15.4 0.9 25.1 33.1 312 351 D A G < S+ 0 0 36 -3,-1.1 -1,-0.3 1,-0.3 -2,-0.1 0.673 105.0 39.2 -63.4 -19.5 3.8 24.5 30.6 313 352 D W S <> S+ 0 0 6 -3,-2.1 4,-2.0 1,-0.1 5,-0.4 -0.692 84.3 176.1-123.1 73.2 4.9 27.9 32.0 314 353 D P T 4 S+ 0 0 102 0, 0.0 4,-0.1 0, 0.0 -2,-0.1 0.697 75.9 18.7 -64.6 -26.2 3.8 27.1 35.7 315 354 D V T > S+ 0 0 71 3,-0.1 4,-2.3 2,-0.1 3,-0.2 0.761 123.5 51.6-102.3 -51.0 5.1 30.4 37.2 316 355 D d H > S+ 0 0 9 1,-0.2 4,-1.6 2,-0.2 5,-0.1 0.788 102.2 59.1 -65.6 -30.0 5.5 32.9 34.3 317 356 D A H X>S+ 0 0 4 -4,-2.0 5,-3.3 -7,-0.3 4,-1.4 0.929 112.0 41.9 -64.3 -44.8 2.0 32.4 32.9 318 357 D A H 45S+ 0 0 73 -5,-0.4 -2,-0.2 -3,-0.2 -1,-0.2 0.919 112.6 52.9 -62.8 -46.6 0.4 33.5 36.2 319 358 D R H <5S+ 0 0 195 -4,-2.3 -2,-0.2 1,-0.3 -1,-0.2 0.774 112.0 46.9 -66.0 -24.4 3.0 36.3 36.6 320 359 D A H <5S- 0 0 30 -4,-1.6 -1,-0.3 -5,-0.2 -2,-0.2 0.766 123.0-108.6 -79.2 -31.3 2.0 37.5 33.1 321 360 D G T <5 + 0 0 65 -4,-1.4 -3,-0.2 1,-0.3 2,-0.2 0.706 69.0 139.1 105.9 31.9 -1.7 37.2 34.0 322 361 D A < 0 0 23 -5,-3.3 -1,-0.3 -6,-0.1 -2,-0.1 -0.659 360.0 360.0-108.2 161.2 -2.8 34.2 31.9 323 362 D R 0 0 158 -2,-0.2 -13,-0.3 -5,-0.0 -12,-0.1 0.199 360.0 360.0 -80.5 360.0 -5.1 31.3 32.9