==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=19-JUL-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER TRANSFERASE 28-JUN-11 3SMQ . COMPND 2 MOLECULE: PROTEIN ARGININE N-METHYLTRANSFERASE 3; . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR E.DOBROVETSKY,A.DONG,J.R.WALKER,A.SIARHEYEVA,G.SENISTERRA,G. . 299 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 14517.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 224 74.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 24 8.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 69 23.1 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 1 0.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 3 1.0 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 . 27 9.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 39 13.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 53 17.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 6 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 1 0 0 1 2 0 0 2 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 RESIDUES PER ALPHA HELIX . 1 0 1 1 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 PARALLEL BRIDGES PER LADDER . 5 0 1 1 0 3 1 1 1 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 . 0 0 0 2 0 1 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 1 243 A H >> 0 0 105 0, 0.0 4,-0.9 0, 0.0 3,-0.6 0.000 360.0 360.0 360.0 -72.7 2.1 13.3 -6.7 2 244 A Y H 3> + 0 0 132 1,-0.2 4,-2.1 2,-0.2 5,-0.1 0.825 360.0 66.9 -67.2 -31.3 -1.4 14.0 -8.2 3 245 A G H 3> S+ 0 0 49 1,-0.2 4,-2.1 2,-0.2 -1,-0.2 0.824 95.6 56.5 -54.9 -36.0 -2.3 10.4 -7.3 4 246 A I H <> S+ 0 0 77 -3,-0.6 4,-2.0 2,-0.2 -1,-0.2 0.910 106.1 48.3 -64.1 -45.7 -2.1 11.4 -3.6 5 247 A H H X S+ 0 0 39 -4,-0.9 4,-2.3 1,-0.2 -2,-0.2 0.888 110.4 53.3 -60.8 -39.3 -4.7 14.2 -4.1 6 248 A E H X S+ 0 0 99 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.902 107.2 51.5 -60.2 -43.1 -6.8 11.7 -6.0 7 249 A E H < S+ 0 0 99 -4,-2.1 4,-0.4 2,-0.2 -2,-0.2 0.896 110.1 48.2 -62.1 -42.5 -6.6 9.4 -3.0 8 250 A M H >< S+ 0 0 44 -4,-2.0 3,-0.7 1,-0.2 7,-0.4 0.887 111.6 50.0 -67.7 -39.5 -7.7 12.1 -0.5 9 251 A L H 3< S+ 0 0 68 -4,-2.3 -2,-0.2 1,-0.2 -1,-0.2 0.869 109.5 51.8 -62.2 -37.8 -10.6 13.1 -2.8 10 252 A K T 3< S+ 0 0 142 -4,-2.1 2,-1.2 -5,-0.2 -1,-0.2 0.490 81.5 100.9 -81.4 -5.7 -11.7 9.5 -3.0 11 253 A D <> - 0 0 13 -3,-0.7 4,-2.9 -4,-0.4 5,-0.3 -0.731 57.6-171.8 -77.3 98.0 -11.6 9.2 0.8 12 254 A K H >>S+ 0 0 137 -2,-1.2 4,-3.0 2,-0.2 5,-0.6 0.912 78.7 53.7 -64.2 -46.0 -15.4 9.5 1.3 13 255 A I H >5S+ 0 0 49 239,-0.3 4,-1.5 1,-0.2 -1,-0.2 0.951 116.0 41.2 -53.6 -50.2 -15.4 9.8 5.0 14 256 A R H >5S+ 0 0 20 2,-0.2 4,-1.5 1,-0.2 -2,-0.2 0.976 123.3 35.4 -60.3 -59.7 -12.9 12.7 4.8 15 257 A T H X5S+ 0 0 15 -4,-2.9 4,-2.3 -7,-0.4 -3,-0.2 0.886 117.9 48.9 -73.2 -40.0 -14.4 14.5 1.9 16 258 A E H X5S+ 0 0 77 -4,-3.0 4,-3.2 -5,-0.3 -1,-0.2 0.823 106.3 58.7 -68.8 -30.4 -18.1 14.0 2.5 17 259 A S H X< S+ 0 0 0 -4,-2.6 3,-0.7 1,-0.2 -2,-0.2 0.958 120.5 43.1 -65.5 -52.9 -20.4 23.2 4.8 23 265 A Y H 3< S+ 0 0 101 -4,-3.0 -1,-0.2 -5,-0.2 -2,-0.2 0.808 116.6 47.1 -66.4 -31.9 -23.6 22.3 2.8 24 266 A Q H 3< S+ 0 0 85 -4,-2.4 -1,-0.2 -5,-0.3 -2,-0.2 0.545 118.7 40.9 -89.7 -6.3 -25.7 21.6 6.0 25 267 A N X< + 0 0 0 -4,-0.8 3,-2.0 -3,-0.7 4,-0.4 -0.357 64.5 150.5-131.0 54.1 -24.5 24.8 7.8 26 268 A P G >> + 0 0 57 0, 0.0 4,-2.5 0, 0.0 3,-1.1 0.709 64.2 75.1 -65.3 -18.5 -24.5 27.4 5.0 27 269 A H G 34 S+ 0 0 79 1,-0.3 -5,-0.0 2,-0.2 211,-0.0 0.767 90.0 59.0 -59.5 -27.0 -25.3 30.1 7.7 28 270 A I G <4 S+ 0 0 13 -3,-2.0 -1,-0.3 -6,-0.2 104,-0.1 0.780 117.9 29.6 -71.5 -24.8 -21.6 29.8 8.7 29 271 A F T X4 S+ 0 0 0 -3,-1.1 3,-2.5 -4,-0.4 25,-0.4 0.668 83.1 123.0-110.5 -23.3 -20.5 30.7 5.1 30 272 A K T 3< S- 0 0 137 -4,-2.5 23,-0.2 1,-0.3 22,-0.1 -0.219 97.2 -14.9 -54.1 116.4 -23.2 33.0 3.8 31 273 A D T 3 S+ 0 0 101 21,-2.7 -1,-0.3 1,-0.2 2,-0.2 0.714 108.0 135.0 62.7 25.2 -21.7 36.4 2.7 32 274 A K < - 0 0 83 -3,-2.5 23,-1.7 20,-0.1 22,-1.4 -0.668 61.1-119.5-101.8 158.3 -18.4 35.5 4.7 33 275 A V E -a 55 0A 18 -2,-0.2 66,-2.2 21,-0.2 67,-1.8 -0.886 38.0-165.8 -93.7 121.4 -14.8 35.8 3.8 34 276 A V E -ab 56 100A 0 21,-3.0 23,-3.1 -2,-0.6 2,-0.5 -0.889 15.1-157.4-115.7 136.5 -13.3 32.3 4.0 35 277 A L E -ab 57 101A 0 65,-2.8 67,-2.5 -2,-0.4 2,-0.7 -0.971 4.8-161.6-112.0 123.9 -9.6 31.2 4.1 36 278 A D E > -ab 58 102A 1 21,-3.4 23,-2.4 -2,-0.5 2,-0.6 -0.889 12.4-152.3-106.9 102.5 -8.8 27.6 2.9 37 279 A V E 3 S+a 59 0A 5 65,-1.9 67,-0.5 -2,-0.7 23,-0.1 -0.663 79.7 2.8 -82.8 116.2 -5.4 26.7 4.3 38 280 A G T 3 S- 0 0 20 21,-2.0 66,-0.4 -2,-0.6 22,-0.3 0.979 80.1-176.2 70.5 63.8 -3.6 24.1 2.1 39 281 A C X - 0 0 8 20,-1.8 3,-2.5 -3,-0.6 4,-0.4 0.563 2.6-174.6 -75.7 -12.5 -6.5 24.1 -0.5 40 282 A G T 3 S- 0 0 10 1,-0.3 28,-0.3 19,-0.2 -1,-0.2 -0.298 75.9 -2.7 55.3-129.4 -5.1 21.4 -2.8 41 283 A T T 3 S- 0 0 22 26,-0.1 -1,-0.3 1,-0.1 31,-0.1 0.596 104.7-109.2 -65.6 -15.6 -7.4 21.1 -5.9 42 284 A G S <> S+ 0 0 0 -3,-2.5 4,-2.2 -4,-0.1 5,-0.2 0.512 75.7 136.7 99.5 7.6 -9.7 23.8 -4.3 43 285 A I H > S+ 0 0 39 -4,-0.4 4,-2.1 1,-0.2 5,-0.1 0.886 72.6 47.3 -59.4 -42.1 -12.6 21.4 -3.5 44 286 A L H > S+ 0 0 7 -5,-0.4 4,-2.3 1,-0.2 -1,-0.2 0.867 110.7 53.8 -67.3 -35.7 -13.2 22.9 -0.0 45 287 A S H > S+ 0 0 0 -6,-0.2 4,-2.1 2,-0.2 -2,-0.2 0.889 109.1 48.2 -63.1 -40.2 -13.1 26.4 -1.5 46 288 A M H X S+ 0 0 21 -4,-2.2 4,-2.5 2,-0.2 -2,-0.2 0.878 109.2 52.9 -70.4 -36.7 -15.7 25.5 -4.0 47 289 A F H X S+ 0 0 19 -4,-2.1 4,-1.9 -5,-0.2 -2,-0.2 0.946 111.2 47.4 -57.6 -48.1 -17.9 23.9 -1.3 48 290 A A H <>S+ 0 0 0 -4,-2.3 5,-2.2 1,-0.2 -2,-0.2 0.892 110.9 51.1 -63.4 -39.5 -17.7 27.2 0.6 49 291 A A H ><5S+ 0 0 13 -4,-2.1 3,-1.6 1,-0.2 -1,-0.2 0.930 110.1 49.7 -64.1 -44.1 -18.5 29.2 -2.5 50 292 A K H 3<5S+ 0 0 125 -4,-2.5 -1,-0.2 1,-0.3 -2,-0.2 0.832 103.8 58.9 -61.9 -34.5 -21.6 27.1 -3.2 51 293 A A T 3<5S- 0 0 14 -4,-1.9 -1,-0.3 -5,-0.2 -22,-0.2 0.433 132.0 -91.2 -77.5 0.5 -22.7 27.6 0.4 52 294 A G T < 5 + 0 0 31 -3,-1.6 -21,-2.7 1,-0.2 -3,-0.2 0.572 61.9 171.0 106.2 14.8 -22.7 31.3 -0.3 53 295 A A < - 0 0 8 -5,-2.2 -1,-0.2 -23,-0.2 3,-0.2 -0.278 28.8-148.0 -54.8 137.3 -19.3 32.7 0.6 54 296 A K S S+ 0 0 124 -22,-1.4 2,-0.3 -25,-0.4 -21,-0.2 0.907 83.3 1.6 -69.5 -42.6 -18.7 36.3 -0.4 55 297 A K E -a 33 0A 61 -23,-1.7 -21,-3.0 -7,-0.0 2,-0.4 -0.994 64.0-164.8-148.9 134.6 -15.0 35.6 -1.0 56 298 A V E -ac 34 81A 0 24,-2.7 26,-2.7 -2,-0.3 2,-0.6 -0.993 4.4-161.4-122.9 132.7 -12.8 32.5 -0.6 57 299 A L E -ac 35 82A 0 -23,-3.1 -21,-3.4 -2,-0.4 2,-0.6 -0.949 7.3-166.2-110.3 116.4 -9.0 32.6 -0.5 58 300 A G E -ac 36 83A 0 24,-2.5 26,-2.6 -2,-0.6 2,-0.4 -0.922 7.6-174.1-105.8 122.2 -7.3 29.2 -1.2 59 301 A V E +ac 37 84A 4 -23,-2.4 -21,-2.0 -2,-0.6 -20,-1.8 -0.942 12.8 155.4-118.7 133.6 -3.6 29.0 -0.3 60 302 A D E - c 0 85A 21 24,-1.6 26,-1.8 -2,-0.4 27,-0.1 -0.966 33.9-150.5-153.9 143.3 -1.3 26.1 -1.1 61 303 A Q S S+ 0 0 109 -2,-0.3 26,-0.1 24,-0.2 2,-0.1 0.611 72.8 88.5 -88.5 -12.3 2.5 25.9 -1.4 62 304 A S S > S- 0 0 48 24,-0.1 3,-2.1 1,-0.1 4,-0.2 -0.447 89.6-109.8 -90.2 159.8 2.4 23.0 -3.9 63 305 A E T >> S+ 0 0 65 1,-0.3 3,-1.8 2,-0.2 4,-0.7 0.657 107.2 83.5 -58.9 -20.6 2.2 22.9 -7.7 64 306 A I H >> S+ 0 0 7 1,-0.3 4,-2.5 2,-0.2 3,-0.6 0.786 73.7 76.6 -51.2 -28.6 -1.4 21.5 -7.3 65 307 A L H <> S+ 0 0 0 -3,-2.1 4,-1.9 1,-0.3 -1,-0.3 0.830 88.8 55.6 -55.6 -34.2 -2.3 25.2 -6.9 66 308 A Y H <> S+ 0 0 131 -3,-1.8 4,-1.4 2,-0.2 -1,-0.3 0.858 107.2 48.5 -68.4 -36.0 -2.0 25.6 -10.7 67 309 A Q H S+ 0 0 4 -4,-3.4 5,-2.4 1,-0.2 6,-0.4 0.897 112.3 48.2 -56.0 -40.7 -11.9 27.1 -10.3 73 315 A R H ><5S+ 0 0 106 -4,-1.8 3,-1.5 -5,-0.2 -1,-0.2 0.885 106.4 55.2 -66.5 -42.2 -12.2 28.5 -13.9 74 316 A L H 3<5S+ 0 0 144 -4,-2.4 -1,-0.2 1,-0.3 -2,-0.2 0.803 111.5 46.3 -60.2 -30.8 -13.9 25.3 -15.2 75 317 A N T 3<5S- 0 0 86 -4,-1.7 -1,-0.3 -5,-0.2 -2,-0.2 0.340 112.0-122.0 -96.0 7.6 -16.5 25.8 -12.4 76 318 A K T < 5S+ 0 0 170 -3,-1.5 -3,-0.2 -5,-0.1 3,-0.2 0.853 76.2 122.3 57.5 43.1 -16.9 29.5 -13.1 77 319 A L >>< + 0 0 19 -5,-2.4 4,-3.2 -6,-0.1 3,-1.8 0.267 27.3 109.1-117.3 9.3 -16.0 30.5 -9.6 78 320 A E T 34 S+ 0 0 85 -6,-0.4 -1,-0.1 1,-0.3 -5,-0.1 0.744 75.5 58.9 -63.6 -24.5 -13.0 32.8 -10.3 79 321 A D T 34 S+ 0 0 137 -3,-0.2 -1,-0.3 1,-0.1 3,-0.1 0.634 118.9 30.8 -78.0 -12.4 -15.0 35.9 -9.2 80 322 A T T <4 S+ 0 0 37 -3,-1.8 -24,-2.7 1,-0.2 2,-0.5 0.712 116.6 57.0-108.1 -37.5 -15.6 34.3 -5.8 81 323 A I E < -c 56 0A 5 -4,-3.2 2,-0.4 -26,-0.2 -1,-0.2 -0.889 58.5-172.8-110.5 122.5 -12.4 32.2 -5.3 82 324 A T E -c 57 0A 53 -26,-2.7 -24,-2.5 -2,-0.5 2,-0.4 -0.942 12.6-151.7-110.5 131.2 -8.9 33.6 -5.4 83 325 A L E -c 58 0A 20 -2,-0.4 2,-0.4 -26,-0.2 -24,-0.2 -0.865 10.1-171.3-109.4 139.5 -5.9 31.2 -5.3 84 326 A I E -c 59 0A 28 -26,-2.6 -24,-1.6 -2,-0.4 2,-0.5 -0.995 14.9-141.5-135.3 125.1 -2.5 32.1 -3.9 85 327 A K E +c 60 0A 81 -2,-0.4 -24,-0.2 -26,-0.2 2,-0.2 -0.757 58.5 54.6 -92.3 123.7 0.6 30.0 -4.2 86 328 A G S S- 0 0 18 -26,-1.8 2,-0.3 -2,-0.5 -24,-0.1 -0.815 89.1 -47.5 147.4 176.6 2.9 29.9 -1.1 87 329 A K >> - 0 0 39 -2,-0.2 3,-2.3 -26,-0.1 4,-2.2 -0.590 48.6-124.8 -75.5 140.0 3.2 29.2 2.6 88 330 A I T 34 S+ 0 0 6 1,-0.3 -1,-0.1 -2,-0.3 -3,-0.0 0.773 111.5 57.4 -57.1 -26.7 0.5 30.9 4.7 89 331 A E T 34 S+ 0 0 65 1,-0.1 -1,-0.3 3,-0.0 -2,-0.0 0.540 116.2 33.7 -81.9 -6.5 3.3 32.6 6.8 90 332 A E T <4 S+ 0 0 151 -3,-2.3 -2,-0.2 2,-0.0 -1,-0.1 0.684 95.0 93.9-118.9 -29.1 4.8 34.2 3.7 91 333 A V < - 0 0 20 -4,-2.2 2,-0.6 -7,-0.1 -5,-0.1 -0.221 67.5-126.0 -73.0 157.5 2.0 35.1 1.2 92 334 A H - 0 0 168 2,-0.0 -1,-0.1 0, 0.0 -3,-0.0 -0.927 23.0-155.5-102.7 120.4 0.2 38.4 1.0 93 335 A L - 0 0 3 -2,-0.6 -36,-0.0 2,-0.2 -9,-0.0 -0.659 21.6-126.9 -89.5 150.9 -3.6 38.1 1.2 94 336 A P S S+ 0 0 85 0, 0.0 2,-0.3 0, 0.0 -1,-0.1 0.294 92.3 55.6 -82.0 11.3 -5.9 40.8 -0.4 95 337 A V S S- 0 0 50 1,-0.1 -2,-0.2 -62,-0.0 3,-0.1 -0.941 73.0-138.2-134.2 160.6 -7.7 41.2 3.0 96 338 A E S S+ 0 0 172 -2,-0.3 2,-0.3 1,-0.2 -1,-0.1 0.850 87.6 10.5 -81.1 -39.7 -6.6 42.1 6.5 97 339 A K - 0 0 110 30,-0.0 2,-0.3 32,-0.0 30,-0.2 -0.919 63.5-146.6-137.7 159.4 -8.9 39.5 8.3 98 340 A V E - d 0 127A 0 28,-2.6 30,-3.3 -2,-0.3 -64,-0.2 -0.903 12.5-142.5-125.1 159.0 -11.1 36.6 7.4 99 341 A D E S+ 0 0 55 -66,-2.2 33,-1.9 -2,-0.3 2,-0.4 0.773 83.9 22.7 -87.6 -33.0 -14.4 35.4 9.0 100 342 A V E -bd 34 132A 6 -67,-1.8 -65,-2.8 31,-0.2 2,-0.5 -1.000 58.9-159.0-143.1 136.3 -13.8 31.7 8.7 101 343 A I E +bd 35 133A 0 31,-2.4 33,-2.8 -2,-0.4 2,-0.4 -0.974 14.5 178.6-114.0 130.7 -10.8 29.3 8.3 102 344 A I E +bd 36 134A 0 -67,-2.5 -65,-1.9 -2,-0.5 2,-0.3 -0.969 9.6 157.4-125.8 147.9 -11.3 25.8 6.9 103 345 A S - 0 0 1 31,-1.2 2,-0.7 -2,-0.4 3,-0.1 -0.939 41.2-142.3-166.0 141.6 -8.5 23.3 6.3 104 346 A E + 0 0 17 -67,-0.5 -2,-0.0 -66,-0.4 -60,-0.0 -0.894 48.5 144.4-103.7 96.6 -8.0 19.6 6.0 105 347 A W + 0 0 5 -2,-0.7 10,-2.3 9,-0.1 11,-0.4 0.523 19.4 130.4-113.3 -10.7 -4.7 19.6 7.8 106 348 A M - 0 0 10 8,-0.2 5,-0.2 -3,-0.1 2,-0.2 -0.181 33.1-168.4 -65.4 134.6 -4.7 16.3 9.7 107 349 A G B > -E 110 0B 8 3,-2.8 3,-1.5 1,-0.2 6,-0.2 -0.475 43.6 -59.5-103.2 179.2 -1.8 13.8 9.6 108 350 A Y B 3> S+F 112 0C 77 4,-0.6 4,-2.3 1,-0.3 -1,-0.2 -0.382 131.6 12.5 -55.3 138.4 -1.4 10.2 10.8 109 351 A F T 34 S- 0 0 10 146,-0.3 2,-2.6 1,-0.3 -1,-0.3 0.855 128.9 -84.1 53.5 36.1 -2.1 9.9 14.5 110 352 A L B <4 S+E 107 0B 0 -3,-1.5 -3,-2.8 1,-0.2 -1,-0.3 -0.274 125.5 47.7 67.7 -51.6 -3.5 13.5 14.0 111 353 A L T >4 S+ 0 0 12 -2,-2.6 3,-1.2 -5,-0.2 2,-0.5 0.528 72.2 109.6-106.5 -9.9 -0.1 15.2 14.3 112 354 A F B 3< S-F 108 0C 53 -4,-2.3 -4,-0.6 1,-0.3 -2,-0.1 -0.606 106.8 -16.7 -71.8 122.0 2.5 13.4 12.2 113 355 A E T 3 S+ 0 0 84 -2,-0.5 -1,-0.3 1,-0.2 2,-0.1 0.823 101.0 158.0 53.8 37.0 3.4 15.7 9.2 114 356 A S < - 0 0 22 -3,-1.2 3,-0.3 -6,-0.1 -8,-0.2 -0.449 49.8-135.4 -86.1 161.8 0.2 17.7 9.9 115 357 A M S >> S+ 0 0 57 -10,-2.3 4,-1.9 1,-0.2 3,-0.8 0.154 71.6 114.9 -97.0 15.8 -0.4 21.3 8.8 116 358 A L H 3> S+ 0 0 0 -11,-0.4 4,-2.9 1,-0.3 5,-0.2 0.875 71.1 59.8 -55.3 -38.5 -1.9 22.3 12.2 117 359 A D H 3> S+ 0 0 78 -3,-0.3 4,-1.9 1,-0.2 -1,-0.3 0.898 107.7 45.0 -54.1 -42.2 1.0 24.7 12.7 118 360 A S H <> S+ 0 0 12 -3,-0.8 4,-2.5 2,-0.2 -1,-0.2 0.867 111.4 52.7 -73.1 -37.3 0.0 26.6 9.6 119 361 A V H X S+ 0 0 0 -4,-1.9 4,-2.6 2,-0.2 -2,-0.2 0.922 111.2 46.7 -60.8 -46.0 -3.7 26.6 10.5 120 362 A L H X S+ 0 0 1 -4,-2.9 4,-2.6 2,-0.2 -2,-0.2 0.872 110.7 52.2 -67.4 -37.2 -2.8 28.1 13.9 121 363 A Y H X S+ 0 0 87 -4,-1.9 4,-2.9 -5,-0.2 5,-0.3 0.950 111.5 47.0 -59.0 -49.9 -0.6 30.7 12.3 122 364 A A H X>S+ 0 0 0 -4,-2.5 4,-2.8 1,-0.2 5,-0.8 0.895 111.7 51.7 -57.9 -43.6 -3.5 31.6 10.0 123 365 A K H X5S+ 0 0 30 -4,-2.6 4,-1.1 3,-0.2 -1,-0.2 0.927 113.9 43.3 -58.1 -48.0 -5.8 31.7 13.0 124 366 A N H <5S+ 0 0 105 -4,-2.6 -2,-0.2 1,-0.1 -1,-0.2 0.874 124.2 33.5 -70.5 -39.7 -3.5 34.1 14.9 125 367 A K H <5S+ 0 0 54 -4,-2.9 -2,-0.2 -5,-0.2 -3,-0.2 0.912 132.7 19.3 -81.2 -43.6 -2.6 36.4 12.1 126 368 A Y H <5S+ 0 0 30 -4,-2.8 -28,-2.6 -5,-0.3 2,-0.4 0.625 83.3 109.8-112.0 -17.5 -5.8 36.5 10.0 127 369 A L E << -d 98 0A 27 -4,-1.1 -28,-0.2 -5,-0.8 3,-0.1 -0.513 65.7-124.7 -71.8 122.1 -8.9 35.4 11.9 128 370 A A E > - 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