NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 172 D 4.6377 8.2227 120.1986 54.0205 41.8311 175.2879 173 E 3.8663 8.2506 124.3289 57.6990 29.9397 176.0764 174 L 4.0692 8.1800 120.3142 58.2274 42.6632 177.6570 175 Y 3.9602 8.2072 119.0153 60.7266 38.7846 177.9078 176 R 3.9817 8.2646 119.5848 59.6215 30.2104 178.2145 177 Q 3.9068 8.7596 119.4948 59.2641 29.0745 178.3786 178 S 4.2053 8.3709 116.3027 61.5715 62.9602 176.3554 179 L 3.8928 7.9697 124.7488 57.3549 41.6692 178.6152 180 E 3.8315 8.0624 119.1432 59.2999 29.6393 178.7778 181 I 3.4435 7.4168 119.5907 64.4628 37.0571 178.5671 182 I 3.7768 7.6408 120.4322 64.4006 36.9433 178.7428 183 S 4.1091 8.5004 116.3258 61.7049 62.6736 176.8542 184 R 3.9161 8.1329 120.8590 59.4027 29.6460 178.4656 185 Y 4.1987 8.0542 119.0226 60.8302 38.7849 178.0454 186 L 3.8061 8.1133 119.9204 57.7355 41.6577 179.5813 187 R 3.8286 8.4519 119.1703 59.4068 29.9743 178.4493 188 E 4.2043 8.2343 118.8462 58.8233 29.4114 179.0910 189 Q 3.7827 7.9130 118.4177 58.7201 28.7949 178.2708 190 A 4.0627 8.0254 121.2163 54.6722 18.5358 178.9975 191 T 4.2505 8.0909 106.9980 61.4975 69.5623 176.1246 192 G 3.8395 8.7079 108.7782 45.4638 0.0000 172.8119 193 A 4.6566 7.3923 120.6558 50.0227 22.2022 176.7626 194 K 4.2684 8.4447 120.5776 55.6827 33.4681 175.8607 195 D 4.8818 8.3037 119.8171 52.9048 42.9631 175.6329 196 T 4.2920 8.3168 123.5192 62.9467 70.4330 171.3647 197 K 3.5912 8.6971 135.0000 53.9721 29.7820 171.8356 *203 G 3.8845 7.7331 113.8808 44.7421 0.0000 174.0277 204 A 3.9521 7.8581 119.4265 54.5945 19.1095 179.6586 205 T 3.8444 7.8556 111.1834 65.3988 67.3998 176.3564 206 S 3.9530 8.0807 116.6230 61.4769 62.8614 176.6622 207 R 3.8759 8.0743 120.7051 59.3804 29.8314 179.3804 208 K 4.1661 8.2138 117.9475 59.1858 31.9157 179.3192 209 A 4.2513 8.5678 121.5490 55.1686 18.2439 179.4047 210 L 3.8023 8.0584 119.0087 58.3083 42.1701 178.9230 211 E 3.9713 8.3365 118.5373 59.7850 29.4242 179.5152 212 T 3.7813 8.1268 115.6871 66.5383 68.5509 176.3921 213 L 3.9955 8.4171 122.5561 58.1043 42.0693 178.9719 214 R 4.0899 8.1325 118.3186 59.4402 30.1053 178.9593 215 R 3.8199 7.8472 117.9450 59.7442 30.1169 178.9401 216 V 3.7524 8.2161 112.5039 63.7465 31.3677 178.9623 217 G 3.7831 8.3442 107.4448 47.3581 0.0000 175.5662 218 D 4.6019 8.0946 120.5473 56.9341 41.1737 178.7020 219 G 3.8485 7.9992 106.4526 47.9485 0.0000 176.0186 220 V 3.7262 7.8695 120.9910 64.6316 31.4631 178.1898 221 Q 3.4522 8.0244 120.8079 57.7164 28.5254 177.3400 222 R 4.9321 7.0309 118.0181 56.4698 30.0595 180.3422 223 N 4.7103 8.7289 119.7666 53.2517 38.3642 175.6537 224 H 4.8333 7.1126 112.2138 55.4296 29.1857 176.2461 225 E 3.8580 7.9021 123.2136 59.9200 29.3210 179.2046 226 T 3.8794 7.8824 114.8927 66.5506 68.4895 176.4299 227 A 4.0095 7.9415 122.1019 55.1922 18.4638 179.4411 228 F 3.9323 8.7197 116.7248 60.7534 38.8724 177.7604 229 Q 4.4145 8.4709 118.0471 59.1359 28.6206 179.3620 230 G 3.6747 8.2797 106.4993 48.1640 0.0000 175.6220 231 M 4.0008 8.3256 121.7407 57.8104 31.9806 178.4482 232 L 4.1474 8.5279 120.9194 58.2962 42.0538 178.8491 233 R 3.9199 7.9199 117.0513 59.7232 30.1049 178.3592 234 K 4.1382 7.8217 116.5278 59.2272 32.0609 178.7446 235 L 4.0341 8.2265 120.4103 56.1827 42.4165 176.4915 236 D 4.3297 8.0282 115.6973 54.7203 40.1497 173.5709 237 I 3.9247 7.8231 117.3017 61.0695 38.5088 175.4321 238 K 4.1652 9.0961 128.3663 58.8599 32.5466 176.1521 239 N 4.5474 7.5606 114.2623 51.7945 39.6107 174.7704 240 E 3.9902 8.5701 115.6889 58.9345 29.4067 178.0499 241 D 4.6874 8.3506 117.6648 54.6400 41.9306 176.7385 242 D 4.6423 7.8904 121.0947 53.1856 39.5713 176.5984 243 V 4.3166 7.3459 112.4296 60.8095 33.1223 177.3063 244 K 3.9835 7.9762 119.7001 59.5948 31.9807 179.0405 245 S 4.1831 8.0229 114.0023 61.2445 63.0223 176.1324 246 L 3.9949 7.8840 123.5643 57.8700 41.9226 178.6312 247 S 4.1242 8.2670 113.1728 61.5621 62.3529 176.3203 248 R 3.9374 8.0850 120.6991 59.2136 29.6878 179.2312 249 V 3.5496 7.9526 117.9611 66.3743 31.1908 178.0949 250 M 3.9468 8.2063 118.4342 58.2909 31.5331 178.8376 251 I 3.8342 7.7649 119.2731 64.6351 37.6099 177.5317 252 H 4.1368 8.3525 119.0931 59.1504 29.4249 177.0988 253 V 3.4337 7.6487 119.2877 66.1553 31.5664 177.3896 254 F 4.6639 7.5026 114.5300 58.0839 38.7945 177.0204 255 S 4.4356 7.8450 114.0970 59.4745 63.2602 174.3564 256 D 4.4023 7.8825 121.1718 54.0595 39.6701 177.1642 257 G 3.8499 8.2708 108.7845 45.3556 0.0000 173.3259 258 V 4.1680 7.6820 119.4379 61.3369 32.7484 175.2276 259 T 4.2942 7.9986 122.7878 61.0612 71.3440 173.3210 260 N 4.8351 7.8446 122.2945 50.5594 41.5289 175.4078 261 W 4.6911 8.3795 120.2091 59.4820 29.1664 179.1542 262 G 3.9818 8.2650 105.7663 47.9747 0.0000 175.8664 263 R 3.9819 8.7981 120.9604 59.0095 30.1092 179.2365 264 I 3.9163 7.8293 119.5279 64.5152 37.1851 178.9648 265 V 3.9623 8.6508 120.2969 65.1755 31.1801 178.6084 266 T 4.1550 8.1731 116.3313 66.4400 68.3036 176.6297 267 L 4.0704 8.2943 121.1108 57.9642 41.5746 179.7344 268 I 3.9318 8.1545 119.7812 64.3917 37.0568 178.4173 269 S 4.4857 8.9145 114.5521 61.5541 62.2104 176.0065 270 F 4.1952 8.9389 123.9572 61.0404 38.9500 177.1701 271 G 3.6333 8.4407 105.2894 47.8213 0.0000 175.3270 272 A 3.9243 8.4133 123.5486 54.8799 18.2583 179.4468 273 F 4.0032 8.4082 119.1492 61.4379 39.4668 177.5810 274 V 3.4176 7.8709 117.8458 65.7270 31.3142 177.7767 275 A 3.9199 8.1653 120.8874 55.0706 18.1131 179.4747 276 K 3.6759 7.9910 117.0136 60.1826 31.8992 179.0493 277 H 4.1195 7.7736 118.0950 58.9334 29.7011 177.3284 278 L 3.9339 7.9291 121.1490 57.6409 41.2107 179.5362 279 K 4.1509 7.7602 117.7378 59.4695 31.9789 179.1705 280 T 3.9625 7.4284 109.5385 64.7452 68.7080 176.3314 281 I 4.1214 7.1696 114.8369 62.0678 38.1337 175.5610 282 N 4.6960 8.1399 119.6264 51.8506 40.4226 174.6024 283 Q 4.1186 8.7828 126.2806 58.4518 28.9895 177.3349 284 E 4.5083 7.3896 114.8921 55.9297 29.7935 176.2860 285 S 4.8635 7.6059 115.5950 58.8054 63.2534 173.8179 286 C 4.3708 8.7027 123.3640 59.3543 28.7126 174.4412 287 I 4.0018 8.2876 117.8935 62.3155 37.6073 177.8091 288 E 3.9758 8.0513 121.1559 59.2514 29.3598 177.0204 289 P 4.3493 0.0000 0.0000 65.4013 31.3820 178.4371 290 L 3.9351 7.8822 118.4814 58.1090 42.0794 178.7330 291 A 4.0378 8.0801 120.7613 55.2415 18.2702 179.4424 292 E 3.9752 8.7662 117.5711 59.5059 29.6073 179.5284 293 S 4.1381 8.1720 113.2406 61.4757 62.4248 176.4196 294 I 3.8276 7.8132 122.4271 64.8138 36.4146 178.5718 295 T 3.8852 8.1920 116.7854 66.4634 68.1829 176.2548 296 D 4.5500 8.4333 120.1130 57.3774 41.3464 178.2574 297 V 3.6168 7.6586 118.2414 66.0893 31.5103 177.4678 298 L 3.7722 8.1143 119.8882 58.3696 41.7637 179.1764 299 V 3.6563 8.3233 117.4221 65.7812 31.6521 177.3317 300 R 4.0903 8.0114 118.1711 59.4642 30.0711 177.5690 301 T 4.1461 7.7099 106.0557 63.0179 69.3426 175.2967 302 K 4.3960 7.8179 121.7158 55.6821 32.9486 177.8980 303 R 3.9278 8.1978 119.5279 60.4679 29.7296 177.6978 304 D 4.3387 8.0156 117.6336 56.8226 39.8541 178.3721 305 W 4.0625 8.1844 128.5508 60.4331 30.5918 177.8758 306 L 3.8056 8.3586 119.0077 57.7900 41.1533 179.4593 307 V 3.5550 7.9367 118.3595 66.1211 31.1919 177.7896 308 K 3.9097 7.8304 118.1009 58.5177 31.9585 176.9986 309 Q 4.4550 7.2320 113.1756 55.4244 29.2919 175.6045 310 R 3.9971 8.6267 115.0830 58.3476 29.5237 178.7934 311 G 3.9354 7.9896 113.5475 46.6679 0.0000 178.6783 312 W 4.1482 9.0672 127.3612 58.7079 28.5589 176.6263 313 D 4.5920 8.2787 118.5498 57.1885 40.5816 178.3228 314 G 3.9091 8.0532 107.6499 47.0930 0.0000 175.4686 315 F 2.7079 7.1733 122.4129 60.4052 39.1829 176.9949 316 V 3.4713 7.9581 116.7908 66.3453 31.7326 177.5930 317 E 4.0558 8.3940 118.3848 59.1314 29.0294 179.0857 318 F 3.9340 7.9028 120.0052 60.7871 39.4506 176.2881 319 F 4.6629 7.3093 114.2515 56.3060 39.0829 175.2195 320 H 4.2812 7.3778 119.7622 56.1847 30.1236 175.7206 321 V 3.9217 7.9515 118.9594 61.5275 32.1332 175.3601 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 172 D 8.22 4.64 0.00 2.71 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 0.00 173 E 8.25 3.87 0.00 2.25 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 2.43 2.55 0.00 174 L 8.18 4.07 0.00 1.90 1.77 1.11 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 175 Y 8.21 3.96 0.00 3.34 3.13 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 0.00 176 R 8.26 3.98 0.00 2.14 2.14 0.00 3.18 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 177 Q 8.76 3.91 0.00 2.37 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.58 0.00 0.00 0.00 0.00 0.00 2.17 2.32 0.00 178 S 8.37 4.21 0.00 4.10 4.15 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 0.00 179 L 7.97 3.89 0.00 1.41 1.70 0.89 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 180 E 8.06 3.83 0.00 2.16 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 2.23 2.31 0.00 181 I 7.42 3.44 1.02 0.00 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.37 0.18 0.00 0.00 182 I 7.64 3.78 1.95 0.00 0.00 1.04 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 0.73 0.99 0.00 0.00 183 S 8.50 4.11 0.00 3.83 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 0.00 184 R 8.13 3.92 0.00 2.03 1.99 0.00 3.10 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.80 0.00 185 Y 8.05 4.20 0.00 2.99 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 0.00 186 L 8.11 3.81 0.00 1.91 1.67 1.11 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 187 R 8.45 3.83 0.00 1.93 1.90 0.00 3.08 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 188 E 8.23 4.20 0.00 2.30 2.20 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 2.60 2.16 0.00 189 Q 7.91 3.78 0.00 1.89 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.03 0.00 0.00 0.00 0.00 0.00 1.70 1.35 0.00 190 A 8.03 4.06 1.26 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 0.00 0.00 0.00 191 T 8.09 4.25 4.21 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 1.22 0.00 0.00 192 G 8.71 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 0.00 0.00 0.00 193 A 7.39 4.66 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 0.00 194 K 8.44 4.27 0.00 1.76 1.75 0.00 1.74 0.00 0.00 1.64 0.00 0.00 2.78 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.66 1.42 7.81 195 D 8.30 4.88 0.00 2.61 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 T 8.32 4.29 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 0.00 197 K 8.70 3.59 0.00 1.94 1.73 0.00 1.84 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.25 0.99 7.81 *203 G 7.73 3.88 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 0.00 0.00 0.00 0.00 0.00 0.00 204 A 7.86 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 0.00 205 T 7.86 3.84 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 206 S 8.08 3.95 0.00 4.00 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 R 8.07 3.88 0.00 2.09 1.97 0.00 3.12 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 208 K 8.21 4.17 0.00 1.98 1.89 0.00 1.62 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.51 7.81 209 A 8.57 4.25 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.06 3.80 0.00 1.76 1.80 1.01 1.29 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 0.00 211 E 8.34 3.97 0.00 2.21 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 2.34 2.52 0.00 212 T 8.13 3.78 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 213 L 8.42 4.00 0.00 1.90 1.62 0.78 0.63 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 0.00 214 R 8.13 4.09 0.00 2.11 2.06 0.00 3.23 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.95 0.00 215 R 7.85 3.82 0.00 1.88 2.01 0.00 3.05 0.00 0.00 3.14 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.65 0.00 216 V 8.22 3.75 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.35 0.00 0.00 0.49 0.00 0.00 217 G 8.34 3.78 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 0.00 0.00 0.00 218 D 8.09 4.60 0.00 2.79 2.80 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 0.00 219 G 8.00 3.85 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 0.00 0.00 0.00 220 V 7.87 3.73 2.17 0.00 0.00 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 1.04 0.00 0.00 221 Q 8.02 3.45 0.00 2.26 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.81 7.05 0.00 0.00 0.00 0.00 0.00 2.48 2.73 0.00 222 R 7.03 4.93 0.00 1.86 1.72 0.00 3.28 0.00 0.00 3.08 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.43 0.00 223 N 8.73 4.71 0.00 2.61 2.82 0.00 0.00 6.91 8.04 0.00 0.00 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 H 7.11 4.83 0.00 2.91 3.10 0.00 5.82 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 225 E 7.90 3.86 0.00 2.05 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 2.42 2.56 0.00 226 T 7.88 3.88 4.25 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 1.23 0.00 0.00 227 A 7.94 4.01 1.39 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 0.00 0.00 0.00 0.00 0.00 0.00 228 F 8.72 3.93 0.00 2.58 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 Q 8.47 4.41 0.00 2.35 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.69 2.84 0.00 230 G 8.28 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.33 4.00 0.00 1.52 1.91 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.26 0.00 232 L 8.53 4.15 0.00 2.18 2.18 0.92 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 233 R 7.92 3.92 0.00 2.03 2.19 0.00 3.34 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 234 K 7.82 4.14 0.00 1.92 1.85 0.00 1.77 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.58 1.57 7.81 235 L 8.23 4.03 0.00 1.91 2.00 1.01 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 236 D 8.03 4.33 0.00 2.83 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 0.00 237 I 7.82 3.92 1.89 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 1.52 1.07 0.93 0.00 0.00 238 K 9.10 4.17 0.00 1.89 1.85 0.00 1.97 0.00 0.00 1.76 0.00 0.00 3.12 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.42 7.81 239 N 7.56 4.55 0.00 2.87 2.88 0.00 0.00 6.03 7.66 0.00 0.00 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 E 8.57 3.99 0.00 2.29 2.25 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 2.35 2.34 0.00 241 D 8.35 4.69 0.00 2.83 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.89 4.64 0.00 2.76 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 0.00 243 V 7.35 4.32 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 0.83 0.00 0.00 0.95 0.00 0.00 244 K 7.98 3.98 0.00 1.81 1.88 0.00 1.68 0.00 0.00 1.88 0.00 0.00 3.01 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.55 1.52 7.81 245 S 8.02 4.18 0.00 4.06 4.13 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 0.00 246 L 7.88 3.99 0.00 1.83 1.88 1.12 0.91 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 0.00 247 S 8.27 4.12 0.00 4.06 3.99 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 0.00 248 R 8.08 3.94 0.00 2.10 1.98 0.00 3.19 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.80 0.00 249 V 7.95 3.55 2.26 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 1.01 0.00 0.00 0.93 0.00 0.00 250 M 8.21 3.95 0.00 2.17 2.26 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.58 0.00 251 I 7.76 3.83 2.03 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.77 0.93 0.00 0.00 252 H 8.35 4.14 0.00 3.39 3.35 0.00 5.81 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 253 V 7.65 3.43 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 0.28 0.00 0.00 0.74 0.00 0.00 254 F 7.50 4.66 0.00 3.08 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 255 S 7.85 4.44 0.00 3.96 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 0.00 256 D 7.88 4.40 0.00 2.79 2.80 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 0.00 257 G 8.27 3.85 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 0.00 0.00 0.00 258 V 7.68 4.17 2.16 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 0.78 0.00 0.00 0.96 0.00 0.00 259 T 8.00 4.29 3.06 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 -0.85 0.00 0.00 260 N 7.84 4.84 0.00 2.81 2.82 0.00 0.00 6.28 8.88 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 0.00 261 W 8.38 4.69 0.00 2.72 3.44 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 0.00 262 G 8.27 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 0.00 0.00 0.00 263 R 8.80 3.98 0.00 2.07 1.85 0.00 3.14 0.00 0.00 3.01 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.82 0.00 264 I 7.83 3.92 2.21 0.00 0.00 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.98 1.18 0.00 0.00 265 V 8.65 3.96 2.71 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 1.21 0.00 0.00 1.05 0.00 0.00 266 T 8.17 4.16 4.47 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 0.00 0.00 0.00 1.33 0.00 0.00 267 L 8.29 4.07 0.00 1.97 1.80 0.77 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 268 I 8.15 3.93 2.05 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.00 1.13 0.00 0.00 269 S 8.91 4.49 0.00 4.16 4.37 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.94 4.20 0.00 2.61 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 0.00 271 G 8.44 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.41 3.92 1.31 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 0.00 0.00 0.00 273 F 8.41 4.00 0.00 3.54 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 0.00 274 V 7.87 3.42 1.95 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 0.85 0.00 0.00 0.24 0.00 0.00 275 A 8.17 3.92 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 0.00 276 K 7.99 3.68 0.00 1.87 1.67 0.00 1.50 0.00 0.00 1.46 0.00 0.00 2.85 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.39 7.81 277 H 7.77 4.12 0.00 2.96 3.33 0.00 5.78 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 278 L 7.93 3.93 0.00 1.87 1.65 0.88 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 279 K 7.76 4.15 0.00 1.85 1.82 0.00 1.71 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.42 1.67 7.81 280 T 7.43 3.96 4.17 0.00 0.00 0.00 0.00 0.00 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 0.00 281 I 7.17 4.12 1.81 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 1.54 0.60 0.79 0.00 0.00 282 N 8.14 4.70 0.00 2.67 2.64 0.00 0.00 7.16 6.10 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 0.00 283 Q 8.78 4.12 0.00 2.06 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 7.22 0.00 0.00 0.00 0.00 0.00 2.34 2.27 0.00 284 E 7.39 4.51 0.00 2.19 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 2.35 2.25 0.00 285 S 7.61 4.86 0.00 3.98 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 286 C 8.70 4.37 0.00 2.96 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 0.00 287 I 8.29 4.00 1.84 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 1.61 0.58 0.87 0.00 0.00 288 E 8.05 3.98 0.00 2.04 2.20 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 2.41 2.41 0.00 289 P 0.00 4.35 0.00 2.33 2.11 0.00 3.71 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.15 0.00 290 L 7.88 3.94 0.00 1.75 1.85 0.91 1.26 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 0.00 291 A 8.08 4.04 1.39 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 0.00 0.00 0.00 0.00 0.00 0.00 292 E 8.77 3.98 0.00 2.10 2.12 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 2.47 2.42 0.00 293 S 8.17 4.14 0.00 3.99 4.10 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 0.00 294 I 7.81 3.83 1.95 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.58 1.03 0.00 0.00 295 T 8.19 3.89 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 0.65 0.00 0.00 296 D 8.43 4.55 0.00 3.14 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 297 V 7.66 3.62 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 1.11 0.00 0.00 1.06 0.00 0.00 298 L 8.11 3.77 0.00 1.84 1.93 0.74 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 299 V 8.32 3.66 2.38 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 1.05 0.00 0.00 1.04 0.00 0.00 300 R 8.01 4.09 0.00 1.90 2.19 0.00 3.31 0.00 0.00 3.29 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.58 0.00 301 T 7.71 4.15 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 302 K 7.82 4.40 0.00 1.71 1.54 0.00 0.90 0.00 0.00 1.12 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.76 0.56 7.81 303 R 8.20 3.93 0.00 2.13 1.95 0.00 3.27 0.00 0.00 3.39 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.84 0.00 304 D 8.02 4.34 0.00 2.75 2.71 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 0.00 305 W 8.18 4.06 0.00 3.22 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 0.00 306 L 8.36 3.81 0.00 1.92 1.70 0.97 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 307 V 7.94 3.56 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 1.00 0.00 0.00 1.01 0.00 0.00 308 K 7.83 3.91 0.00 1.88 1.64 0.00 1.75 0.00 0.00 1.63 0.00 0.00 3.04 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.37 1.40 7.81 309 Q 7.23 4.46 0.00 2.13 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.09 6.09 0.00 0.00 0.00 0.00 0.00 2.13 2.19 0.00 310 R 8.63 4.00 0.00 2.07 2.05 0.00 3.29 0.00 0.00 3.18 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.55 0.00 311 G 7.99 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 0.00 0.00 0.00 312 W 9.07 4.15 0.00 3.48 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 313 D 8.28 4.59 0.00 2.88 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 0.00 314 G 8.05 3.91 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 0.00 0.00 0.00 315 F 7.17 2.71 0.00 1.51 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 0.00 316 V 7.96 3.47 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 1.12 0.00 0.00 317 E 8.39 4.06 0.00 1.97 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 2.64 2.43 0.00 318 F 7.90 3.93 0.00 2.93 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 0.00 319 F 7.31 4.66 0.00 2.74 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 0.00 320 H 7.38 4.28 0.00 3.26 3.25 0.00 5.89 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 321 V 7.95 3.92 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 0.77 0.00 0.00 0.87 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.