NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 201 K 4.2215 8.3149 120.1369 55.4317 32.5453 175.3847 202 P 4.2392 0.0000 0.0000 61.5342 31.1842 171.6912 203 V 3.8304 8.0671 117.8984 60.6936 33.2386 176.3185 204 S 4.4907 8.4650 119.0056 57.2860 62.5761 173.1722 205 L 4.9569 7.9934 123.9806 53.3248 45.6471 176.2869 206 S 4.5261 8.4029 114.1629 58.9760 66.8270 173.2617 207 Y 4.1090 8.9060 130.7790 58.2103 37.9366 169.2326 208 R 3.9552 7.8679 118.3702 55.9186 30.7165 175.8986 209 C 4.8619 8.3230 122.7138 54.5137 42.1662 171.9282 210 P 4.1865 0.0000 0.0000 65.2462 31.0084 177.0213 211 C 4.7690 8.6201 117.1493 55.6225 39.7830 173.2479 212 R 4.0323 8.3749 123.6916 56.0665 31.0713 177.1001 213 F 5.0492 8.0609 115.6336 55.3114 41.7342 174.3636 214 F 5.2048 8.3801 118.4493 54.5642 40.7907 174.0915 215 E 4.0247 9.4445 124.4821 56.3935 29.8349 176.8162 216 S 4.7534 8.5040 120.8945 58.9007 64.4198 174.3037 217 H 4.9777 8.8176 115.9159 54.8646 28.5266 175.2007 218 V 3.7350 7.3920 118.8274 62.2575 31.9055 175.2096 219 A 4.4193 8.1520 125.4034 49.7669 21.9510 177.0495 220 R 2.5100 7.0987 121.1648 58.7189 30.1783 178.3399 221 A 4.1193 7.5164 118.6038 53.5709 18.8031 177.0555 222 N 4.6163 7.8661 114.0235 54.0704 40.3314 175.0534 223 V 4.1439 6.9565 117.3999 62.6994 32.1106 175.6867 224 K 4.4460 9.1522 127.5469 59.2616 33.0579 176.5776 225 H 4.8849 7.7373 112.3783 54.9305 31.4253 172.7808 226 L 5.2774 8.6734 118.7260 52.9738 44.7064 176.0323 227 K 4.5310 9.0695 122.5536 54.9292 35.4089 174.8435 228 I 4.8220 8.4135 128.5448 59.6983 38.3269 175.5623 229 L 4.2499 8.8987 128.4185 54.2519 42.6533 176.8601 230 N 4.5727 8.7156 121.7402 52.6640 38.6317 174.3172 231 T 4.5707 8.2179 116.4632 59.1825 70.5587 172.3576 232 P 4.4899 0.0000 0.0000 63.8304 31.9237 176.0131 233 N 5.0916 7.9618 115.5825 53.1711 40.0838 173.8631 234 C 4.8785 8.0165 112.0908 54.9657 44.0106 174.5743 235 A 4.1118 8.3687 127.6049 51.1237 17.0208 170.3116 236 C 3.7168 8.3190 127.4476 58.6194 32.7572 172.2882 237 Q 4.6321 8.4591 125.2874 54.1530 31.3941 174.4014 238 I 4.9383 8.2924 124.5697 59.3673 40.4801 174.5186 239 V 4.7773 9.0795 126.7154 60.9975 34.1710 173.8960 240 A 5.1265 9.1373 129.6666 50.1704 21.6774 174.9534 241 R 4.8183 8.3984 123.1130 54.6934 31.9078 175.4087 242 L 5.0838 8.4555 126.8478 53.1177 43.6489 176.8581 243 K 3.6109 9.0338 121.1790 58.8567 33.3919 176.1846 244 N 4.2347 9.1428 118.0797 54.0483 39.1734 173.8572 245 N 4.6333 8.2118 118.4588 53.8944 40.1929 175.3351 246 N 4.7307 7.9049 116.2116 52.6079 40.0300 174.0010 247 R 4.8362 8.0538 115.4170 54.8453 31.8981 173.4005 248 Q 5.0625 8.5000 118.3125 55.2294 30.7413 176.4757 249 V 4.6399 8.9311 118.5653 59.9208 36.8306 173.1393 250 C 5.3268 8.7754 122.4569 55.1727 45.8230 172.5446 251 I 4.9055 8.9164 119.2231 59.2075 40.7518 173.6260 252 D 4.6314 8.1428 120.2175 51.3595 42.8460 174.9485 253 P 4.2075 0.0000 0.0000 64.7410 31.2504 177.4120 254 K 3.9826 8.2878 118.5808 58.3002 32.4633 177.9695 255 L 3.9795 7.4893 120.8965 54.2890 42.3284 177.6279 256 K 3.8990 8.7346 125.2264 59.4305 32.2678 178.8293 257 W 4.6160 8.0384 117.7194 58.8756 28.1728 178.2394 258 I 2.8151 6.6428 120.2982 64.1891 36.4428 178.2187 259 Q 4.0004 7.8150 118.4832 58.8399 28.4034 178.5927 260 E 4.3504 7.9916 121.0536 58.5412 29.2657 178.5931 261 Y 4.1567 8.0177 119.5448 60.6676 39.1680 177.8725 262 L 4.2177 8.1281 120.6054 58.6317 40.4385 178.9006 263 E 3.9573 8.3928 119.5951 59.0702 29.1090 179.0488 264 K 4.0832 7.6515 117.0187 58.5387 32.1683 178.1620 265 C 4.5669 7.9104 116.1271 59.8041 28.5935 173.6427 266 L 4.0841 7.2758 120.6269 54.9404 41.0314 176.5113 267 N 4.0930 8.7591 117.7477 53.9023 35.4869 174.4266 268 K 4.1184 7.7214 120.5448 56.4253 32.5087 175.7030 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 201 K 8.31 4.22 0.00 1.77 1.88 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.48 7.81 202 P 0.00 4.24 0.00 2.13 2.03 0.00 3.68 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.18 0.00 203 V 8.07 3.83 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 0.87 0.00 0.00 0.94 0.00 0.00 204 S 8.46 4.49 0.00 3.98 3.92 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 0.00 205 L 7.99 4.96 0.00 1.60 1.75 0.95 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 206 S 8.40 4.53 0.00 3.85 3.76 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 0.00 207 Y 8.91 4.11 0.00 3.04 3.15 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 0.00 208 R 7.87 3.96 0.00 1.83 1.85 0.00 3.27 0.00 0.00 3.24 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 209 C 8.32 4.86 0.00 2.90 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 0.00 210 P 0.00 4.19 0.00 2.04 2.13 0.00 3.80 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.12 0.00 211 C 8.62 4.77 0.00 3.03 3.10 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 0.00 212 R 8.37 4.03 0.00 1.60 1.62 0.00 3.04 0.00 0.00 3.16 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.71 0.00 213 F 8.06 5.05 0.00 3.01 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 214 F 8.38 5.20 0.00 3.10 2.94 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 0.00 215 E 9.44 4.02 0.00 2.02 1.94 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 2.26 2.37 0.00 216 S 8.50 4.75 0.00 3.78 3.83 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 0.00 217 H 8.82 4.98 0.00 3.19 3.35 0.00 5.56 0.00 0.00 0.00 0.00 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 V 7.39 3.73 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 1.05 0.00 0.00 1.17 0.00 0.00 219 A 8.15 4.42 1.09 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 0.00 0.00 0.00 0.00 0.00 0.00 220 R 7.10 2.51 0.00 0.67 1.33 0.00 3.56 0.00 0.00 3.38 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 221 A 7.52 4.12 1.19 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 0.00 222 N 7.87 4.62 0.00 2.72 2.87 0.00 0.00 6.67 7.47 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 0.00 223 V 6.96 4.14 2.02 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 0.98 0.00 0.00 1.11 0.00 0.00 224 K 9.15 4.45 0.00 1.66 1.89 0.00 1.86 0.00 0.00 1.73 0.00 0.00 2.97 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.45 7.81 225 H 7.74 4.88 0.00 3.19 3.41 0.00 5.41 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 226 L 8.67 5.28 0.00 1.55 1.54 0.51 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 227 K 9.07 4.53 0.00 1.83 1.63 0.00 1.63 0.00 0.00 1.69 0.00 0.00 2.87 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.34 1.42 7.81 228 I 8.41 4.82 1.87 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.01 0.89 0.00 0.00 229 L 8.90 4.25 0.00 1.45 1.59 0.96 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 230 N 8.72 4.57 0.00 2.66 2.75 0.00 0.00 6.83 7.71 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 0.00 231 T 8.22 4.57 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 1.28 0.00 0.00 232 P 0.00 4.49 0.00 2.21 2.21 0.00 3.72 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.95 0.00 233 N 7.96 5.09 0.00 2.70 2.95 0.00 0.00 6.86 7.70 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 0.00 234 C 8.02 4.88 0.00 2.91 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 A 8.37 4.11 1.21 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 0.00 0.00 0.00 0.00 0.00 236 C 8.32 3.72 0.00 3.07 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 0.00 237 Q 8.46 4.63 0.00 1.95 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.56 0.00 0.00 0.00 0.00 0.00 2.29 2.26 0.00 238 I 8.29 4.94 1.74 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.80 0.78 0.00 0.00 239 V 9.08 4.78 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 1.18 0.00 0.00 0.99 0.00 0.00 240 A 9.14 5.13 1.28 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 R 8.40 4.82 0.00 1.78 1.60 0.00 3.22 0.00 0.00 3.14 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.70 0.00 242 L 8.46 5.08 0.00 1.57 1.75 0.91 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 243 K 9.03 3.61 0.00 1.81 1.93 0.00 1.45 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.79 1.38 7.81 244 N 9.14 4.23 0.00 2.81 2.72 0.00 0.00 7.00 7.79 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 N 8.21 4.63 0.00 2.72 2.84 0.00 0.00 6.90 8.00 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 0.00 246 N 7.90 4.73 0.00 2.86 2.76 0.00 0.00 6.80 7.05 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 0.00 247 R 8.05 4.84 0.00 1.96 2.07 0.00 2.93 0.00 0.00 3.26 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.57 0.00 248 Q 8.50 5.06 0.00 2.07 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.87 0.00 0.00 0.00 0.00 0.00 2.26 2.36 0.00 249 V 8.93 4.64 2.10 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 0.57 0.00 0.00 0.99 0.00 0.00 250 C 8.78 5.33 0.00 3.03 2.99 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 0.00 0.00 0.00 251 I 8.92 4.91 1.94 0.00 0.00 0.79 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 0.79 1.11 0.00 0.00 252 D 8.14 4.63 0.00 1.58 1.54 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 0.00 0.00 0.00 0.00 253 P 0.00 4.21 0.00 2.08 2.03 0.00 3.58 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 2.03 0.00 254 K 8.29 3.98 0.00 1.53 1.81 0.00 1.62 0.00 0.00 1.61 0.00 0.00 2.88 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.59 1.41 7.81 255 L 7.49 3.98 0.00 1.27 1.30 0.93 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 256 K 8.73 3.90 0.00 1.81 1.88 0.00 1.83 0.00 0.00 2.07 0.00 0.00 3.05 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.54 1.49 7.81 257 W 8.04 4.62 0.00 3.67 3.35 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 0.00 258 I 6.64 2.82 1.58 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 -0.25 0.24 0.61 0.00 0.00 259 Q 7.82 4.00 0.00 2.23 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.75 0.00 0.00 0.00 0.00 0.00 2.30 2.54 0.00 260 E 7.99 4.35 0.00 2.29 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 0.00 2.54 2.56 0.00 261 Y 8.02 4.16 0.00 3.21 3.08 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 0.00 0.00 0.00 262 L 8.13 4.22 0.00 2.00 1.96 0.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 263 E 8.39 3.96 0.00 2.22 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 2.34 2.60 0.00 264 K 7.65 4.08 0.00 1.70 1.79 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.76 1.49 7.81 265 C 7.91 4.57 0.00 3.02 2.98 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 0.00 266 L 7.28 4.08 0.00 1.77 1.63 0.92 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 267 N 8.76 4.09 0.00 2.79 2.79 0.00 0.00 6.85 7.61 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 0.00 268 K 7.72 4.12 0.00 1.63 1.58 0.00 1.78 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.30 1.41 7.81