NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 223 M 4.4004 8.3001 120.3490 54.9402 34.2267 175.1705 224 A 4.2050 7.4314 120.2641 51.1177 22.0126 171.2593 225 A 3.6047 9.1255 129.9801 52.0399 18.3925 175.2374 226 G 4.1862 8.2594 109.3881 44.1361 0.0000 172.3179 227 V 3.7537 8.3328 122.5479 63.1620 32.2310 175.6121 228 K 4.3349 8.5478 122.5716 57.9938 33.3471 177.4771 229 Q 4.5023 7.7208 118.3912 55.3393 29.2974 174.9995 230 L 4.6686 7.8078 118.2541 56.1878 49.3511 176.2980 231 A 4.7303 7.6177 118.8926 52.0172 19.2668 176.8384 232 D 4.6150 7.6319 114.6843 55.8169 43.1280 176.4991 233 D 4.6777 8.2659 118.2807 54.1939 44.9808 177.0345 234 R 4.2037 8.0655 115.7803 59.3071 30.1183 178.6608 235 T 4.0188 7.8320 115.4437 65.5540 68.4539 176.0631 236 L 4.2030 7.8817 120.2737 56.5239 41.9206 178.2764 237 L 4.2088 7.7316 118.3860 56.2835 41.7803 178.4429 238 M 4.0071 7.8895 117.5981 58.0192 32.4286 177.5027 239 A 4.3386 7.8246 118.5289 53.4685 19.0281 178.7056 240 G 4.2043 7.7587 104.9471 47.3604 0.0000 175.5982 241 V 4.6329 7.4100 121.0564 64.2474 31.9003 177.5716 242 S 4.0800 8.0231 112.1936 62.0367 61.8999 175.6624 243 H 4.0885 7.9040 119.7498 58.9678 29.8085 176.1718 244 D 4.5683 8.2591 119.9740 54.6300 39.5934 177.7199 245 L 4.2042 7.3228 119.3415 56.2907 42.4239 177.4572 246 R 4.2165 7.8543 117.0687 58.4254 30.0831 177.8186 247 T 4.0744 7.7785 115.4024 65.4782 68.5093 174.8743 248 P 4.1450 0.0000 0.0000 65.8565 31.6878 178.4644 249 L 4.0816 7.9101 118.2292 57.1117 41.2751 179.6300 250 T 3.8481 7.3926 115.9314 66.7219 68.3173 176.8059 251 R 3.9417 7.9081 119.4078 59.3950 30.1656 178.8180 252 I 3.9511 7.8007 118.4954 63.2201 37.2843 178.2295 253 R 3.8893 8.0890 120.6732 59.1049 29.8478 178.1089 254 L 4.1624 7.7800 118.4723 56.8501 41.9424 179.0088 255 A 3.9851 7.7218 121.2905 55.1900 18.4517 179.3898 256 T 4.2124 8.1363 107.4857 63.6928 69.0599 176.7597 257 E 3.9767 7.7474 121.5749 59.1163 29.8732 178.0811 258 M 4.1798 8.0396 118.6006 58.5505 32.3305 176.9853 259 M 4.4816 7.4534 114.9396 55.8619 32.3564 177.2492 260 S 4.1819 7.9584 112.6438 60.4259 62.2693 174.9539 261 E 4.0917 7.4209 119.7196 58.2735 30.2043 176.4272 262 Q 4.1534 7.9430 115.9985 56.5588 29.9591 174.2597 263 D 4.7932 8.5838 116.0187 57.5261 44.2364 178.5233 264 G 4.3497 7.1302 111.1345 48.6917 0.0000 175.2543 265 Y 4.3521 7.5234 117.3029 61.2466 37.6123 178.0262 266 L 3.6630 8.0182 116.7479 58.4948 41.4650 180.2778 267 A 3.6207 7.6463 118.4196 55.1112 19.7789 179.1840 268 E 3.9412 8.2859 115.4560 59.3947 29.6425 179.7947 269 S 4.1490 8.0558 114.1819 62.3138 63.0951 175.8334 270 I 4.0576 7.9599 122.3055 62.4930 37.2159 177.5830 271 N 4.1585 8.0354 117.8259 56.4143 38.7745 177.5096 272 K 4.0732 8.2846 120.3071 60.0506 32.8684 178.8138 273 D 4.4289 7.9873 118.0848 56.3830 41.3846 178.1459 274 I 3.8985 7.2539 119.3746 64.2758 37.2853 177.5726 275 E 3.9468 7.9114 119.9485 59.4354 29.5117 178.8383 276 E 4.0553 8.1470 116.8512 59.3671 29.5155 178.3702 277 C 4.1906 7.9489 119.3908 61.9706 31.5544 174.9459 278 N 4.3565 8.0039 118.2876 56.1711 38.6504 176.7507 279 A 3.9972 7.9511 122.0012 55.2090 18.5657 179.4717 280 I 3.8471 7.8808 111.5928 64.3317 37.5289 178.4340 281 I 3.9420 7.5769 121.0018 63.4694 36.7533 178.2399 282 E 4.0343 8.0275 120.1836 59.2729 29.3303 179.0147 283 Q 4.1766 7.9191 116.2177 59.0628 29.0206 178.0083 284 F 2.7769 8.0308 119.8380 59.7291 39.0036 177.9050 285 I 3.8104 7.6813 119.1966 64.3640 36.6568 178.0506 286 D 4.5761 8.1055 119.5273 56.9371 40.3585 178.0000 287 Y 4.1619 8.2300 116.9784 60.0354 38.6624 176.8974 288 L 4.6778 7.8679 120.8344 54.4285 41.5839 176.4998 289 R 4.2032 7.7224 123.1583 56.5233 30.2390 174.4362 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 223 M 8.30 4.40 0.00 1.97 2.16 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.61 0.00 224 A 7.43 4.21 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 225 A 9.13 3.60 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 226 G 8.26 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 V 8.33 3.75 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.94 0.00 0.00 228 K 8.55 4.33 0.00 1.78 1.83 0.00 1.81 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.37 1.35 7.81 229 Q 7.72 4.50 0.00 2.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.78 0.00 0.00 0.00 0.00 0.00 2.31 2.55 0.00 230 L 7.81 4.67 0.00 1.59 1.59 1.02 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 231 A 7.62 4.73 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 232 D 7.63 4.61 0.00 2.74 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 233 D 8.27 4.68 0.00 2.58 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 234 R 8.07 4.20 0.00 2.10 2.19 0.00 3.14 0.00 0.00 3.30 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.73 0.00 235 T 7.83 4.02 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 236 L 7.88 4.20 0.00 1.84 1.70 0.94 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 237 L 7.73 4.21 0.00 1.84 1.69 0.89 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 238 M 7.89 4.01 0.00 2.09 2.05 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.61 0.00 239 A 7.82 4.34 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 240 G 7.76 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 241 V 7.41 4.63 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.94 0.00 0.00 242 S 8.02 4.08 0.00 3.92 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 243 H 7.90 4.09 0.00 3.14 3.39 0.00 5.80 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 244 D 8.26 4.57 0.00 3.00 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 245 L 7.32 4.20 0.00 1.85 1.71 0.90 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 246 R 7.85 4.22 0.00 1.94 1.90 0.00 3.30 0.00 0.00 3.20 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 247 T 7.78 4.07 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 248 P 0.00 4.14 0.00 2.25 2.28 0.00 3.80 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.13 0.00 249 L 7.91 4.08 0.00 1.67 1.77 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 250 T 7.39 3.85 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 251 R 7.91 3.94 0.00 1.97 1.97 0.00 3.16 0.00 0.00 3.33 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.78 0.00 252 I 7.80 3.95 2.03 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.85 0.91 0.00 0.00 253 R 8.09 3.89 0.00 2.05 1.89 0.00 3.05 0.00 0.00 3.27 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 254 L 7.78 4.16 0.00 1.85 1.69 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 255 A 7.72 3.99 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 256 T 8.14 4.21 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 257 E 7.75 3.98 0.00 2.14 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.30 0.00 258 M 8.04 4.18 0.00 2.44 2.03 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.58 0.00 259 M 7.45 4.48 0.00 2.20 2.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.54 0.00 260 S 7.96 4.18 0.00 4.11 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 261 E 7.42 4.09 0.00 1.98 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.19 0.00 262 Q 7.94 4.15 0.00 2.03 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.45 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 263 D 8.58 4.79 0.00 2.70 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 264 G 7.13 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 265 Y 7.52 4.35 0.00 3.39 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 266 L 8.02 3.66 0.00 1.84 1.60 1.05 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 267 A 7.65 3.62 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 268 E 8.29 3.94 0.00 2.02 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 269 S 8.06 4.15 0.00 4.18 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 270 I 7.96 4.06 2.04 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.63 0.92 0.00 0.00 271 N 8.04 4.16 0.00 2.87 2.91 0.00 0.00 6.80 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 272 K 8.28 4.07 0.00 2.00 2.23 0.00 1.34 0.00 0.00 1.60 0.00 0.00 2.97 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.66 1.45 7.81 273 D 7.99 4.43 0.00 2.74 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 274 I 7.25 3.90 2.08 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.21 0.93 0.00 0.00 275 E 7.91 3.95 0.00 2.03 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.48 0.00 276 E 8.15 4.06 0.00 2.29 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.59 0.00 277 C 7.95 4.19 0.00 3.18 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 278 N 8.00 4.36 0.00 2.86 2.90 0.00 0.00 6.95 8.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 279 A 7.95 4.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 280 I 7.88 3.85 2.07 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.64 1.01 0.00 0.00 281 I 7.58 3.94 2.05 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.51 0.92 0.00 0.00 282 E 8.03 4.03 0.00 2.24 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.49 0.00 283 Q 7.92 4.18 0.00 2.16 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.93 0.00 0.00 0.00 0.00 0.00 2.40 1.86 0.00 284 F 8.03 2.78 0.00 3.21 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 285 I 7.68 3.81 2.05 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.56 0.94 0.00 0.00 286 D 8.11 4.58 0.00 2.98 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 287 Y 8.23 4.16 0.00 3.15 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 288 L 7.87 4.68 0.00 1.69 1.70 1.05 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 289 R 7.72 4.20 0.00 2.02 1.75 0.00 3.32 0.00 0.00 3.29 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.56 0.00