NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *-1 S 4.4402 8.3349 117.0992 57.8201 64.4430 173.9887 0 M 3.9849 8.0119 122.3306 52.6212 32.5607 172.6485 *181 P 4.4325 0.0000 0.0000 62.3803 34.3521 175.3378 182 L 4.5691 8.4211 121.2482 54.6243 42.3297 177.1653 183 Q 4.1126 9.0595 123.4529 55.4246 29.5886 175.8332 184 P 4.2736 0.0000 0.0000 66.1111 31.3598 178.8385 185 E 3.9546 8.2256 116.4899 59.3483 29.4264 179.1031 186 A 3.9454 7.9100 120.3338 55.1168 18.5196 179.4665 187 Q 3.3791 7.9309 116.5818 59.0858 28.7612 179.4064 188 R 3.9390 8.1961 118.8607 58.9983 30.0242 178.7677 189 A 3.9455 7.9840 120.6030 55.3015 18.3712 179.7067 190 L 3.6443 7.5295 117.1676 57.8559 41.4431 179.7051 191 Q 4.0619 8.0585 117.9297 59.1846 28.6074 179.0501 192 Q 4.0035 8.2324 119.0150 58.8251 28.6564 178.5586 193 L 3.9066 8.0796 121.5117 58.1022 41.8903 178.8618 194 K 3.8965 7.9358 118.3763 59.3338 32.1600 177.7469 195 Q 4.3271 7.6469 115.3399 54.8115 28.8787 175.7615 196 K 3.9736 7.9670 118.4123 57.7337 30.2258 176.6209 197 M 4.2635 8.2439 120.0545 57.0580 32.2072 176.8134 198 V 4.6435 7.5748 110.2588 59.4969 35.5068 174.6591 199 N 5.0761 8.5587 116.1113 52.8328 39.2274 173.0728 200 Y 5.4174 7.7049 120.2256 57.0028 42.6736 173.0717 201 I 4.8386 8.3493 126.8487 59.4245 41.6911 173.8029 202 Q 4.9593 8.7701 127.6936 54.5648 31.4241 174.1556 203 M 5.5956 9.2707 125.6625 53.6223 36.4509 174.4585 204 K 5.1419 8.9363 119.0557 55.4667 37.0729 174.8457 205 L 4.5640 8.9320 121.5512 54.2422 42.7397 176.6497 206 D 4.7069 9.2789 124.5353 52.9538 41.2124 176.8119 207 L 4.2550 8.5330 126.0774 56.4751 42.4213 178.8504 208 E 4.1112 8.4262 118.0340 59.1563 29.5327 178.0001 209 R 4.2304 8.1610 114.6449 55.4827 31.3566 175.8315 210 E 3.7766 8.0706 116.7188 57.6559 27.1038 173.0212 211 T 4.8763 7.1680 107.7549 60.0765 73.8111 173.9462 212 I 4.7376 8.6416 123.2933 60.0640 38.9396 174.5300 213 E 4.9040 9.0375 128.6678 53.9275 32.2297 174.6501 214 L 4.2593 8.5153 128.9921 55.6257 42.3482 176.1993 215 V 4.1150 9.1796 128.2686 64.6487 31.8417 175.3585 216 H 4.9330 7.6008 113.1279 54.7898 31.9004 172.4558 217 T 5.6372 8.1872 106.3516 60.0906 68.9702 174.2218 218 E 4.1974 8.9257 120.8859 56.6404 30.3113 175.5805 219 P 4.5041 0.0000 0.0000 63.6520 31.8022 176.1670 220 T 4.6336 9.0031 119.2432 62.1425 71.8487 173.8122 221 D 4.8876 9.5478 127.3395 53.2677 42.0709 177.7322 222 V 3.6672 8.8031 119.5692 66.5843 31.0259 178.0711 223 A 4.0237 7.9748 119.0495 54.7602 18.7763 178.7187 224 Q 4.1260 8.0069 115.1069 56.9414 29.0676 177.7060 225 L 3.5777 7.2312 122.5122 57.8530 41.9750 177.1117 226 P 4.2335 0.0000 0.0000 65.4860 30.9931 178.5453 227 S 4.1914 7.6494 111.5786 60.7698 62.9446 175.8531 228 R 4.3385 7.5485 119.8628 55.7488 29.9912 176.0631 229 V 4.2121 6.9322 119.3469 60.1523 32.0630 173.6899 230 P 4.4326 0.0000 0.0000 62.6001 31.7586 177.2369 231 R 4.1083 8.4441 120.0337 57.8574 30.3701 177.0145 232 D 4.8553 7.8819 114.3491 52.5823 40.2942 175.3519 233 A 4.4495 7.3743 120.7213 50.6894 22.0464 175.9933 234 A 4.1431 7.8570 123.0913 52.0537 19.1714 177.1805 235 R 4.5205 8.5883 118.5668 54.8746 35.2857 173.6254 236 Y 5.2333 8.5515 118.8064 56.9231 40.7640 174.7128 237 H 5.1039 8.7190 119.2815 54.0603 33.5776 172.2965 238 F 5.3748 9.1958 120.7030 55.6980 42.4377 174.0214 239 F 5.4818 9.5889 125.4780 56.4711 42.8620 173.3109 240 L 4.6084 8.5617 129.3191 54.3080 42.1853 175.5785 241 Y 4.4303 9.0730 130.2947 56.4648 39.6011 174.1499 242 K 4.9074 8.3769 127.2842 55.2760 33.6244 175.6705 243 H 4.6626 8.8268 120.2722 55.2017 32.5249 172.3079 244 T 4.6891 8.3465 114.4433 61.9307 70.8611 173.4200 245 H 4.4899 8.8046 128.8316 55.4779 30.6516 174.0859 246 E 3.8423 9.3204 125.7138 56.9680 26.2809 172.7422 247 G 3.8049 8.1440 107.8109 46.6436 0.0000 173.0238 248 D 4.7799 7.5301 119.5467 50.1228 40.4659 178.7544 249 P 4.8258 0.0000 0.0000 61.9853 32.1584 175.8925 250 L 4.8475 9.0416 120.7795 53.1090 46.5805 175.5913 251 E 4.9336 8.6784 119.0870 55.0855 32.4968 175.0901 252 S 4.8610 9.1279 121.7026 56.4467 66.2606 173.8503 253 V 4.4824 8.4398 124.3015 62.5746 32.8873 174.7194 254 V 4.9565 9.2340 121.7687 59.6302 34.3739 174.3748 255 F 5.0157 9.2344 128.3914 57.0561 41.1016 174.3194 256 I 4.6834 8.1676 126.7072 59.4802 40.5906 173.6337 257 Y 5.1093 8.7253 129.2052 56.0668 40.5455 174.1333 258 S 4.9500 8.9231 122.5420 56.8433 65.8948 173.0549 259 M 4.5948 8.5800 123.8992 52.9128 34.1347 171.6119 260 P 4.5389 0.0000 0.0000 60.3932 30.0739 177.1718 261 G 3.6016 8.4293 116.2482 49.4426 0.0000 173.0293 262 Y 4.2229 7.7998 115.7499 59.7273 37.9599 176.5883 263 K 4.5639 8.1613 116.5536 55.8661 33.8374 175.5720 264 C 4.9151 7.4436 116.0773 57.6835 30.5238 174.5176 265 S 4.4589 8.5287 117.7165 57.8898 65.0826 175.2316 266 I 3.6912 8.2215 122.1612 64.1657 37.7140 178.2313 267 K 4.0131 8.0377 119.0023 59.3763 31.8513 178.9544 268 E 4.1037 8.1756 118.5874 59.5317 29.4534 179.4071 269 R 4.0514 8.1165 118.0265 59.8676 30.1472 179.0745 270 M 4.1580 8.2634 118.2005 58.3532 31.8417 178.9545 271 L 4.0034 8.2292 119.1908 58.0285 41.8635 179.1638 272 Y 3.9748 8.3957 118.2781 60.5154 37.0183 178.6879 273 S 4.0419 8.4375 116.1183 61.7518 63.2445 177.0209 274 S 4.1985 8.2955 117.8771 61.8734 62.6302 176.5466 275 C 4.0412 8.3922 119.1000 61.7343 27.7730 175.8418 276 K 3.4524 7.6396 121.8506 59.5120 31.7085 178.7411 277 S 4.0298 7.3618 111.0276 61.4986 62.7892 176.7435 278 R 3.8225 7.2282 119.6290 58.6407 29.7611 178.4607 279 L 3.7910 8.2062 120.4508 58.3724 42.0242 179.1807 280 L 3.8355 7.6680 121.0875 58.1851 41.4419 179.7271 281 D 4.3718 7.9498 121.1643 58.6871 39.6659 181.3326 282 S 4.5466 7.9390 118.1778 60.8593 62.8689 176.8779 283 V 3.6113 8.0450 121.2571 66.0259 30.6781 177.9676 284 E 4.1336 8.2818 118.0314 59.4311 29.3216 179.1084 285 Q 4.0297 8.4384 116.7618 58.3843 29.4148 176.9376 286 D 4.4410 8.6505 118.6151 54.6635 41.6525 177.5622 287 F 4.4244 7.6521 114.5303 56.1366 40.6055 174.2441 288 H 4.2154 7.8083 115.7017 55.6120 26.0518 174.2344 289 L 4.4757 7.8040 120.1237 53.2391 43.2609 174.9820 290 E 4.2140 8.7434 127.3239 55.4607 29.7782 175.3292 291 I 4.4537 8.2350 127.6624 59.9626 38.2327 175.7274 292 A 4.2893 9.1758 128.9548 54.6712 19.0413 177.5918 293 K 4.5691 7.9488 114.3845 55.3276 35.8990 174.6513 294 K 5.2752 8.7584 125.8365 54.9025 34.1467 175.6257 295 I 4.7573 9.0841 125.4652 59.4701 41.1503 174.1443 296 E 5.2495 8.9774 125.0518 54.5763 31.7725 175.2903 297 I 4.6138 8.5713 117.0774 59.2171 41.1843 176.1405 298 G 4.1060 9.2161 110.1758 44.9886 0.0000 172.8904 299 D 4.5759 7.7121 119.8777 52.3361 44.1653 175.8226 300 G 3.4830 8.8702 115.5974 48.5280 0.0000 175.0192 301 A 3.8682 7.8043 121.7626 54.7437 18.4305 178.6195 302 E 3.7213 7.8460 114.9976 58.8263 30.0238 177.9526 303 L 4.2588 7.3232 121.4634 53.6232 40.2913 176.4934 304 T 4.3455 7.2015 112.1779 60.4169 72.1320 175.7004 305 A 4.0653 8.5294 125.2822 55.9892 18.4195 180.2617 306 E 3.9783 8.2502 116.3510 61.2714 29.7811 180.8498 307 F 4.3365 8.3262 121.7290 61.1463 39.4104 177.2333 308 L 3.6553 8.0919 118.6526 57.6510 41.2445 179.0139 309 D 4.5391 8.2367 118.9934 57.8116 40.6530 178.7055 310 D 4.2992 7.7643 116.6806 57.1502 41.2282 177.8695 311 E 3.9064 7.6884 118.4895 59.2353 29.5837 179.0786 312 V 3.6652 7.7447 117.2350 65.3928 31.6999 175.4755 313 H 4.5070 8.1576 119.3134 55.8311 28.9765 173.7240 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 *-1 S 8.33 4.44 0.00 3.59 3.71 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 0.00 0.00 0.00 0.00 0 M 8.01 3.98 0.00 2.23 2.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.64 0.00 *181 P 0.00 4.43 0.00 2.15 2.23 0.00 4.11 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.85 0.00 182 L 8.42 4.57 0.00 1.59 1.58 0.73 0.81 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 0.00 183 Q 9.06 4.11 0.00 2.06 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.73 0.00 0.00 0.00 0.00 0.00 2.39 2.48 0.00 184 P 0.00 4.27 0.00 2.17 2.14 0.00 3.61 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.22 0.00 185 E 8.23 3.95 0.00 1.98 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.34 0.00 186 A 7.91 3.95 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 0.00 187 Q 7.93 3.38 0.00 2.38 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.76 0.00 0.00 0.00 0.00 0.00 2.50 2.67 0.00 188 R 8.20 3.94 0.00 2.13 1.97 0.00 3.15 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.66 0.00 189 A 7.98 3.95 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 L 7.53 3.64 0.00 1.39 1.37 -0.06 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 191 Q 8.06 4.06 0.00 2.27 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 2.79 2.66 0.00 192 Q 8.23 4.00 0.00 2.25 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.80 0.00 0.00 0.00 0.00 0.00 2.39 2.57 0.00 193 L 8.08 3.91 0.00 1.77 1.74 1.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 194 K 7.94 3.90 0.00 1.86 2.07 0.00 1.73 0.00 0.00 1.70 0.00 0.00 3.11 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.48 1.55 7.81 195 Q 7.65 4.33 0.00 2.03 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.56 0.00 0.00 0.00 0.00 0.00 2.50 2.54 0.00 196 K 7.97 3.97 0.00 1.88 1.88 0.00 1.69 0.00 0.00 1.86 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.37 1.39 7.81 197 M 8.24 4.26 0.00 2.02 2.23 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 2.52 0.00 198 V 7.57 4.64 2.15 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 0.80 0.00 0.00 0.94 0.00 0.00 199 N 8.56 5.08 0.00 2.78 3.01 0.00 0.00 5.35 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 Y 7.70 5.42 0.00 3.43 3.21 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 0.00 201 I 8.35 4.84 1.95 0.00 0.00 0.64 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 0.64 0.88 0.00 0.00 202 Q 8.77 4.96 0.00 2.26 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.69 0.00 0.00 0.00 0.00 0.00 2.25 2.38 0.00 203 M 9.27 5.60 0.00 2.15 2.23 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.52 0.00 204 K 8.94 5.14 0.00 1.93 1.93 0.00 1.35 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.38 1.48 7.81 205 L 8.93 4.56 0.00 1.21 1.45 0.30 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 206 D 9.28 4.71 0.00 2.96 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.53 4.26 0.00 1.70 1.71 0.97 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 208 E 8.43 4.11 0.00 2.33 2.01 0.00 0.00 0.00 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 1.90 0.00 209 R 8.16 4.23 0.00 1.96 1.97 0.00 3.48 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 210 E 8.07 3.78 0.00 2.13 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.22 0.00 211 T 7.17 4.88 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 212 I 8.64 4.74 1.88 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.75 1.02 0.00 0.00 213 E 9.04 4.90 0.00 2.03 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 2.24 2.37 0.00 214 L 8.52 4.26 0.00 1.75 1.58 0.97 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 215 V 9.18 4.12 2.22 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 0.95 0.00 0.00 0.98 0.00 0.00 216 H 7.60 4.93 0.00 3.33 3.44 0.00 5.65 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 T 8.19 5.64 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 218 E 8.93 4.20 0.00 2.06 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 2.33 2.34 0.00 219 P 0.00 4.50 0.00 2.08 2.08 0.00 3.68 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.19 0.00 220 T 9.00 4.63 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 221 D 9.55 4.89 0.00 2.72 2.68 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 0.00 0.00 0.00 0.00 222 V 8.80 3.67 2.27 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 1.12 0.00 0.00 1.43 0.00 0.00 223 A 7.97 4.02 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 0.00 224 Q 8.01 4.13 0.00 2.21 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.68 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 225 L 7.23 3.58 0.00 1.16 1.46 0.51 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 226 P 0.00 4.23 0.00 2.09 2.02 0.00 3.61 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.22 0.00 227 S 7.65 4.19 0.00 3.99 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 228 R 7.55 4.34 0.00 1.70 1.93 0.00 3.11 0.00 0.00 2.97 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.61 0.00 229 V 6.93 4.21 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.72 0.00 0.00 230 P 0.00 4.43 0.00 2.20 2.04 0.00 3.72 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.11 0.00 231 R 8.44 4.11 0.00 1.76 1.95 0.00 3.10 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.57 0.00 232 D 7.88 4.86 0.00 2.71 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.37 4.45 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.86 4.14 0.24 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 0.00 0.00 0.00 235 R 8.59 4.52 0.00 1.55 1.53 0.00 3.37 0.00 0.00 3.12 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.80 0.00 236 Y 8.55 5.23 0.00 3.04 2.89 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.72 5.10 0.00 2.91 3.18 0.00 5.55 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 F 9.20 5.37 0.00 2.89 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 239 F 9.59 5.48 0.00 3.25 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 0.00 240 L 8.56 4.61 0.00 1.59 1.42 0.87 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 241 Y 9.07 4.43 0.00 3.09 3.03 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 0.00 242 K 8.38 4.91 0.00 1.63 1.67 0.00 1.81 0.00 0.00 1.78 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.38 1.49 7.81 243 H 8.83 4.66 0.00 2.87 2.35 0.00 5.20 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 244 T 8.35 4.69 4.22 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 1.19 0.00 0.00 245 H 8.80 4.49 0.00 3.00 3.09 0.00 5.75 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 246 E 9.32 3.84 0.00 2.17 1.83 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 2.13 1.85 0.00 247 G 8.14 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 248 D 7.53 4.78 0.00 2.56 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 249 P 0.00 4.83 0.00 2.12 2.03 0.00 3.65 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.96 0.00 250 L 9.04 4.85 0.00 1.14 1.43 0.95 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 251 E 8.68 4.93 0.00 1.76 1.81 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 2.14 2.26 0.00 252 S 9.13 4.86 0.00 3.89 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 0.00 253 V 8.44 4.48 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.98 0.00 0.00 254 V 9.23 4.96 2.19 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 0.86 0.00 0.00 1.30 0.00 0.00 255 F 9.23 5.02 0.00 3.00 2.91 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 0.00 0.00 0.00 256 I 8.17 4.68 1.73 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.55 0.79 0.00 0.00 257 Y 8.73 5.11 0.00 3.06 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 258 S 8.92 4.95 0.00 3.76 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 259 M 8.58 4.59 0.00 1.54 1.27 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 2.30 2.39 0.00 260 P 0.00 4.54 0.00 2.33 2.13 0.00 3.74 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.98 0.00 261 G 8.43 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.80 4.22 0.00 2.95 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 263 K 8.16 4.56 0.00 1.72 1.78 0.00 1.68 0.00 0.00 1.73 0.00 0.00 2.96 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.76 7.81 264 C 7.44 4.92 0.00 2.91 2.78 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.53 4.46 0.00 4.06 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.22 3.69 1.88 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 1.65 1.33 0.92 0.00 0.00 267 K 8.04 4.01 0.00 1.87 1.88 0.00 1.74 0.00 0.00 1.83 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.55 1.55 7.81 268 E 8.18 4.10 0.00 2.23 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 2.41 2.40 0.00 269 R 8.12 4.05 0.00 2.03 2.05 0.00 3.09 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.90 0.00 270 M 8.26 4.16 0.00 2.10 2.16 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 2.79 2.62 0.00 271 L 8.23 4.00 0.00 1.88 1.66 0.97 0.74 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 0.00 272 Y 8.40 3.97 0.00 3.24 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 0.00 273 S 8.44 4.04 0.00 4.02 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.30 4.20 0.00 4.01 3.90 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 0.00 275 C 8.39 4.04 0.00 2.98 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 276 K 7.64 3.45 0.00 1.76 1.89 0.00 1.92 0.00 0.00 1.61 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.36 1.55 7.81 277 S 7.36 4.03 0.00 4.06 4.06 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 0.00 0.00 0.00 278 R 7.23 3.82 0.00 2.00 1.96 0.00 3.11 0.00 0.00 3.06 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.73 0.00 279 L 8.21 3.79 0.00 1.41 1.47 0.87 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 280 L 7.67 3.84 0.00 1.52 1.47 0.47 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 281 D 7.95 4.37 0.00 2.70 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 282 S 7.94 4.55 0.00 4.04 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 283 V 8.04 3.61 2.05 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 0.93 0.00 0.00 0.84 0.00 0.00 284 E 8.28 4.13 0.00 2.11 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 2.50 2.40 0.00 285 Q 8.44 4.03 0.00 2.29 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.82 0.00 0.00 0.00 0.00 0.00 2.38 2.26 0.00 286 D 8.65 4.44 0.00 2.72 2.35 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 0.00 287 F 7.65 4.42 0.00 3.06 2.97 0.00 0.00 0.00 0.00 0.00 0.00 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 H 7.81 4.22 0.00 3.26 3.35 0.00 5.93 0.00 0.00 0.00 0.00 8.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 289 L 7.80 4.48 0.00 1.58 1.56 0.89 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 290 E 8.74 4.21 0.00 1.97 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.42 0.00 291 I 8.23 4.45 1.92 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 1.54 0.79 1.09 0.00 0.00 292 A 9.18 4.29 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 0.00 293 K 7.95 4.57 0.00 1.86 1.62 0.00 1.58 0.00 0.00 1.86 0.00 0.00 2.90 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.45 1.52 7.81 294 K 8.76 5.28 0.00 1.77 1.97 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.60 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.42 1.54 7.81 295 I 9.08 4.76 1.91 0.00 0.00 0.78 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 0.89 1.09 0.00 0.00 296 E 8.98 5.25 0.00 1.87 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.44 0.00 297 I 8.57 4.61 1.82 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.88 0.82 0.00 0.00 298 G 9.22 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 299 D 7.71 4.58 0.00 2.55 2.34 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 0.00 300 G 8.87 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 301 A 7.80 3.87 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 302 E 7.85 3.72 0.00 1.40 1.12 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 2.08 2.20 0.00 303 L 7.32 4.26 0.00 1.54 1.47 0.71 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 304 T 7.20 4.35 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 305 A 8.53 4.07 1.44 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 0.00 0.00 0.00 306 E 8.25 3.98 0.00 1.99 1.98 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 2.32 1.94 0.00 307 F 8.33 4.34 0.00 3.05 3.20 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 0.00 308 L 8.09 3.66 0.00 1.40 0.72 0.53 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 309 D 8.24 4.54 0.00 3.02 2.83 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 0.00 310 D 7.76 4.30 0.00 2.73 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 0.00 311 E 7.69 3.91 0.00 1.55 1.71 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 0.00 1.49 1.47 0.00 312 V 7.74 3.67 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.98 0.00 0.00 313 H 8.16 4.51 0.00 3.29 3.12 0.00 5.74 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.