NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 31 E 4.3593 8.3033 120.2289 56.4810 31.8952 176.9524 32 D 4.4317 8.2793 126.4082 56.1255 41.6818 175.8211 33 K 4.5385 8.0973 116.9895 56.3401 35.1692 177.4345 34 Q 4.0478 7.9449 119.5521 58.5742 29.1452 177.0622 35 E 3.9648 8.6606 121.1280 59.3462 29.5945 179.0298 36 R 4.2814 8.1325 117.4130 58.7858 30.1943 178.6792 37 A 4.0430 7.7492 121.0637 55.1774 18.3927 179.3278 38 N 4.3289 8.5178 115.3208 56.9595 38.6411 177.3268 39 Y 4.3923 7.8193 117.4755 61.0247 37.8220 178.6064 40 E 4.2206 8.7869 119.9527 59.5258 29.5893 179.0206 41 K 3.8706 8.4692 118.7290 59.8357 32.1977 178.8462 42 L 3.9661 8.4771 120.3402 58.3827 41.9939 179.0377 43 Q 4.2524 8.8680 118.2573 59.4198 28.5093 179.0960 44 Q 3.9987 8.2702 117.9375 58.5756 28.7486 178.5176 45 K 4.0062 8.0829 120.3476 59.4025 32.3843 178.2202 46 F 3.8754 8.2741 119.7033 61.2020 39.1355 177.4641 47 Q 3.7097 7.5036 113.5679 56.6315 29.2663 177.1885 *49 L 3.9690 7.8058 118.4506 54.8111 43.1916 179.2158 *51 S 4.2694 8.2232 115.9247 58.5715 64.8074 175.6099 52 K 3.9651 8.0073 119.6367 59.7648 32.0266 177.4401 53 H 4.4864 8.0782 114.0240 55.9713 30.8059 179.0723 54 Q 3.1739 8.7161 116.0195 56.5481 27.6853 174.2591 55 A 4.0774 9.5665 125.2976 56.3149 18.8894 179.4271 56 H 4.3905 7.9211 111.3513 56.0937 29.1748 176.3849 57 V 4.6807 8.1992 116.6520 60.8222 33.5397 178.0770 58 R 4.0347 8.0785 118.5062 59.3599 29.8078 176.5619 59 P 4.3618 0.0000 0.0000 65.4610 31.1926 178.6002 60 Q 3.7555 7.8977 116.5723 58.8685 28.5385 178.5315 61 F 4.1268 8.0499 118.0185 59.8194 38.9447 177.9425 62 E 4.3288 7.9705 118.8608 58.5817 29.5439 179.0959 63 S 4.2241 7.9983 113.4554 61.4381 62.5923 176.2485 64 L 4.0993 7.7007 121.1348 57.5885 41.1180 179.1705 65 E 4.4458 8.6502 118.6299 58.6213 29.0849 179.3544 66 K 4.0478 7.7394 118.1398 59.3487 32.1731 178.3876 67 I 3.9041 7.6495 118.3445 63.7645 37.4833 176.0498 68 N 4.9069 8.1592 118.3792 52.0918 41.7587 175.2690 69 K 4.1557 8.8614 125.4353 59.6114 32.9282 177.2690 70 D 4.5799 9.4456 119.4147 54.7869 40.8998 175.5724 71 I 4.4411 7.6701 121.7069 61.0156 36.9985 176.1087 72 V 4.2618 8.4026 120.3113 60.6268 32.6822 175.7626 73 G 3.8195 7.4650 107.2575 45.9195 0.0000 171.7753 74 W 5.3823 8.8656 129.1580 55.4551 34.6140 173.6824 75 I 5.3689 8.2085 126.1809 59.2452 40.6953 173.9525 76 K 5.2334 9.6401 129.8667 54.8841 35.9303 174.5303 77 L 5.2120 9.1831 128.5643 52.9395 44.7928 175.9771 78 S 4.1786 8.8681 121.6907 59.7576 63.4839 174.6969 79 G 3.9526 9.2937 110.7877 45.8505 0.0000 172.3332 80 T 4.7625 7.3508 107.7969 59.8436 71.9080 173.7494 81 S 4.3215 8.5558 113.9245 58.7845 63.5727 174.3152 82 L 4.3557 7.8625 124.6285 55.3544 41.6021 174.7606 83 N 5.1893 7.3271 122.5093 52.9117 39.5447 171.9709 84 Y 4.3132 8.2190 120.5288 54.6038 43.3767 172.8208 85 P 3.7063 0.0000 0.0000 62.0564 33.0566 175.3904 86 V 4.5021 9.0619 122.5184 61.5475 33.8283 175.2104 87 L 4.9452 8.8136 127.5054 53.0005 44.6641 175.2359 88 Q 4.8103 7.9225 119.0102 55.9097 31.8001 173.2740 89 G 4.6068 8.6998 116.1220 43.8066 0.0000 171.9984 90 K 4.1489 8.8616 117.5591 58.5303 32.6048 176.7385 91 T 3.9815 7.1471 107.8746 59.5216 71.6187 173.5790 92 N 5.0981 8.5681 116.5410 53.7458 38.2151 175.5397 93 H 4.7563 7.6451 112.2198 54.8349 29.9325 175.0383 94 D 4.0505 7.5706 119.7085 57.6264 40.2884 177.2000 95 Y 4.2343 7.1196 114.0149 57.4363 38.6630 177.2337 96 L 3.9583 7.1834 124.2389 57.9801 42.3362 179.4479 97 N 5.2638 7.8531 115.2173 52.7178 39.1619 173.9081 98 L 5.1495 7.5788 116.6208 52.9542 45.7906 176.7511 99 D 5.6720 8.6170 121.9683 51.2973 41.4710 176.8916 100 F 4.4502 8.7290 113.3006 59.2133 37.8882 175.5415 101 E 4.4776 7.4079 117.8988 55.4594 29.6353 175.6798 102 R 3.7506 7.7074 115.8193 58.0263 28.1482 175.9689 103 E 4.6330 8.2981 116.3818 54.5938 31.8098 175.8713 104 H 4.7863 8.5536 119.5614 55.9277 29.7953 175.3273 105 R 4.6741 8.5917 121.5850 54.6942 34.3583 176.3995 106 R 3.8877 8.6570 121.9187 59.0796 30.2234 177.3673 107 K 4.0867 8.0832 114.5142 55.6184 33.6813 178.5340 108 G 4.1154 7.1858 108.1716 45.6952 0.0000 175.7849 109 S 4.6818 8.6695 121.6108 57.2051 68.3266 171.2059 110 I 4.4319 8.1287 121.4904 60.5739 38.2269 174.9436 111 F 5.5190 8.5112 124.3803 54.5629 41.6341 172.8550 *113 D 5.0058 8.6194 116.1134 54.3518 41.8919 177.3692 114 F 4.5234 9.1637 120.6999 59.2468 38.0963 176.4185 115 R 3.8299 8.0076 120.5725 58.2906 30.0502 176.9784 116 N 5.1329 7.6342 113.6755 52.9140 39.1402 173.3520 117 E 4.7667 8.4065 119.2253 54.8093 31.4814 176.4155 118 L 4.1497 8.5743 124.3941 57.7498 41.5123 177.9902 119 K 2.7159 7.3499 117.6040 57.9752 32.3526 175.8556 120 N 4.7351 7.5362 126.9199 51.0630 39.1203 174.9484 121 L 3.9587 8.3524 123.2130 55.2152 42.5464 177.5908 122 N 4.7311 8.1981 118.0723 52.4528 40.6965 175.5270 123 H 4.2591 8.5113 114.7982 58.6505 29.9792 175.1797 124 N 5.4345 8.3362 116.9978 52.1841 41.7715 173.5226 125 T 4.6610 8.4859 124.0906 61.7141 69.4273 174.7014 126 I 4.3639 8.1162 127.4388 59.8871 39.1513 175.3207 127 L 4.7273 8.1714 124.5265 53.1569 45.7295 175.2273 128 Y 5.6801 7.6738 119.6453 55.4468 42.3477 174.6575 129 G 3.9801 8.2749 104.9654 45.7872 0.0000 172.8454 130 H 4.9616 8.9697 118.7473 55.4856 29.7199 175.3426 131 H 5.1068 8.1051 117.4365 55.3310 29.4712 173.6366 132 V 3.8397 7.7490 111.8081 61.7688 32.5111 176.7154 133 G 3.8378 9.1290 108.4248 46.6856 0.0000 173.6281 134 D 4.7349 7.8007 113.8508 52.4513 40.6483 174.5235 135 N 4.2776 8.6593 114.0803 55.7741 36.9325 173.7534 136 T 5.0666 8.5221 102.4634 60.6157 69.5950 174.7296 *138 F 5.3354 8.0497 117.3545 58.7393 40.6717 177.5599 139 D 4.4400 8.7257 124.3590 57.2943 40.6434 178.4185 140 V 4.4204 7.8068 120.2269 63.7729 31.2844 178.1201 141 L 4.0444 7.5851 120.2809 57.7596 41.3369 178.7560 142 E 3.8485 7.8376 119.0790 59.3454 29.4600 178.6084 143 D 3.9935 7.5930 118.4307 57.1304 40.3900 177.6919 144 Y 4.5202 7.3578 114.4517 59.3591 37.8661 177.3853 145 L 4.2628 7.8162 120.2152 55.1488 42.2946 176.7259 146 K 4.4755 7.6586 119.9031 54.8880 33.5059 177.1708 147 Q 4.0848 8.9551 124.8827 59.4456 29.1218 177.8914 148 S 4.1159 8.3009 113.5364 61.8287 62.0306 175.7705 149 F 3.9038 8.2207 121.3999 61.4125 39.4523 175.8508 150 Y 4.3367 8.4084 119.1120 60.8580 38.3470 177.7773 151 E 3.7286 8.5942 118.2792 59.5934 29.8185 179.4059 152 K 4.0209 7.3929 114.5408 57.6830 32.9426 176.7943 153 H 4.8450 7.7027 117.4658 54.6938 29.7413 175.0678 154 K 3.8968 7.8723 119.5915 58.4929 33.2156 177.9900 155 I 5.1299 7.3896 119.6606 59.4001 40.4961 175.0356 156 I 4.7492 8.8038 126.5805 59.5451 40.7101 174.4797 157 E 4.8560 9.4837 126.5708 55.8041 31.2357 175.3753 158 F 5.6332 9.4317 125.6758 56.8903 42.8774 173.0483 159 D 5.4347 9.0981 125.4320 52.9501 45.5129 174.4398 160 N 3.1427 8.1599 116.7693 51.1112 40.5148 174.7910 161 K 3.6452 7.9404 118.8249 58.9371 32.0233 176.7405 162 Y 4.6960 9.4501 114.6514 56.7743 38.8592 175.3871 163 G 3.9477 6.8726 111.6309 45.3669 0.0000 171.1881 164 K 5.1277 8.0048 119.0342 54.2463 34.2876 175.7956 165 Y 5.3960 9.2763 121.0981 56.3064 42.8564 173.9597 166 Q 5.1390 9.6428 122.8838 54.4593 32.2205 174.1065 167 L 4.9478 9.5819 127.8689 53.8942 43.5235 175.9025 168 Q 4.8937 9.1577 125.3528 54.0631 29.6139 175.3318 169 V 4.2760 8.2908 125.2225 63.2193 31.7443 175.6796 170 F 5.0476 8.7339 119.9687 56.2893 39.7740 174.6030 171 S 4.5323 7.1327 113.9072 57.0273 65.9511 172.4567 172 A 4.9384 8.3417 127.5881 50.5727 22.5086 174.2609 173 Y 4.9196 8.0347 118.7920 56.2209 41.8479 173.5340 174 K 4.9037 8.6353 119.2923 55.6188 34.1776 175.9380 175 T 4.7743 9.2022 116.7713 61.3815 70.8162 174.2724 176 T 5.1425 8.8445 120.8565 63.9486 70.4581 175.6428 177 T 4.2073 7.4573 109.1064 61.6880 69.2474 174.2480 178 K 4.6027 8.5480 119.9736 56.1007 34.2226 175.8447 179 D 4.8031 7.3817 118.7334 52.8983 40.9390 173.0245 180 N 4.5939 8.2169 118.3249 55.6424 38.9478 176.4386 181 Y 5.0702 7.9149 112.8086 58.2424 38.3513 175.7320 182 I 4.3566 7.0030 120.7168 61.3064 37.7562 175.6388 183 R 4.1609 7.8143 120.3770 54.5243 30.2692 176.2953 184 T 4.0310 7.5672 115.0100 61.8883 69.4223 174.1992 185 D 5.0124 7.2853 122.3781 51.4018 43.9646 174.7886 186 F 4.6278 8.0508 119.6791 55.2870 42.4795 175.8672 187 E 4.1369 8.9112 121.0676 58.9115 29.4816 177.4976 188 N 4.7787 7.8561 113.7180 50.9138 41.0592 174.4693 189 D 4.5029 8.7577 120.3265 57.7899 40.8448 179.2358 190 Q 3.9086 8.1109 119.1848 59.3574 29.4228 177.4485 191 D 4.4783 8.9455 119.5052 57.7178 41.2150 177.7168 192 Y 3.6617 8.5452 120.3950 60.3027 38.7234 177.0601 193 Q 3.7332 8.4912 121.0314 59.3079 29.0612 178.5809 194 Q 3.9562 7.9817 118.4947 58.8980 28.7073 178.4587 195 F 4.0325 7.7891 120.5152 61.4354 39.4058 177.1636 196 L 3.9535 7.7653 118.3750 57.8905 41.3322 179.2512 197 D 4.2832 8.0567 118.8794 57.2462 40.7318 178.5620 198 E 3.7741 8.5296 120.1388 59.5190 29.4438 178.6734 199 T 3.6250 7.5109 114.7563 66.7666 68.6549 176.3046 200 K 4.1772 8.1652 120.0991 59.4721 31.8976 179.4965 201 R 3.8432 7.7640 117.9675 59.2257 30.0392 178.3751 202 K 3.8628 8.0901 117.5933 57.4660 32.3888 177.6570 203 S 4.4352 7.0806 113.9324 58.8091 62.7204 173.9857 204 V 4.3958 8.5982 119.8691 60.7343 31.6770 175.7030 205 I 4.6728 7.5147 112.3133 59.1711 40.3818 174.1864 206 N 4.5807 10.1079 121.8723 52.4753 39.1530 174.7330 207 S 4.7278 8.3476 117.2796 56.6074 64.9947 172.8164 208 D 4.6515 8.7610 124.8568 54.1409 41.1915 176.1802 209 V 3.9509 7.6086 118.3002 63.0492 32.2304 174.8758 210 N 4.7450 8.2582 118.8580 51.1213 39.2979 173.8905 211 V 4.2166 7.9377 122.5741 61.0069 34.3620 173.9835 212 T 4.5232 7.8517 113.4437 59.9888 71.8143 174.6475 213 V 3.8898 8.1092 119.8259 64.5790 31.6519 177.0629 214 K 4.1346 8.6899 119.3203 60.0609 32.2300 177.4345 215 D 4.5824 7.3156 116.0664 54.9441 41.5419 176.1289 216 R 4.8709 8.3918 119.3083 54.7409 33.1281 175.3833 217 I 5.1924 9.0018 117.1131 59.3800 41.4943 173.8885 *219 T 4.4209 8.3825 116.0158 63.7257 70.4602 172.8881 220 L 4.9302 8.9940 126.6991 52.8660 44.5514 175.5168 221 S 4.9904 8.6124 118.2110 56.4351 66.0903 173.4747 222 T 5.2312 8.3190 115.9289 61.1307 70.0836 173.3292 223 C 4.8397 8.3850 121.0869 58.1063 34.5873 172.9755 224 E 4.6244 8.6643 124.4727 54.3354 31.5210 175.4689 225 D 4.5598 8.4997 120.2157 54.1614 41.5225 176.1811 226 A 4.0100 8.2980 123.8431 53.9246 18.6042 177.6936 227 Y 3.6514 8.1818 119.0789 58.5506 35.6814 170.8425 228 S 4.5433 7.6499 118.3269 55.9972 61.3889 172.7578 229 E 3.8163 7.9381 121.6903 57.0786 30.1450 176.6349 230 T 4.0793 7.9749 116.1530 63.5553 71.8225 173.3134 231 T 4.2561 8.2938 116.2942 61.8942 68.8746 173.8156 232 K 4.8436 7.6130 122.4642 55.3824 33.0471 175.7925 233 R 4.7776 8.9474 124.1243 54.2023 34.4891 174.7396 234 I 4.6539 8.3838 122.6350 59.4675 39.9914 174.8207 235 V 4.4367 7.9291 126.1269 60.7186 34.6610 174.2641 236 V 4.4608 8.5477 126.7398 60.8638 34.6754 174.1218 237 V 4.5655 8.2612 127.1692 60.9596 34.2907 174.0624 238 A 5.4323 8.1899 127.0114 49.9893 23.3431 174.6207 239 K 4.2551 9.4558 121.9273 56.2703 33.6140 176.1570 240 I 4.5344 8.8272 129.6301 60.7127 37.6406 175.4012 241 I 4.4080 8.9055 130.1308 59.3176 38.9408 175.4539 242 K 4.2997 8.9247 129.8124 55.8755 32.3195 176.2167 243 V 4.4590 8.3049 122.2799 60.9251 32.3800 176.8653 244 S 4.0987 7.6163 121.1755 58.6633 62.9196 173.5179 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 31 E 8.30 4.36 0.00 2.06 1.89 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 2.30 2.34 0.00 32 D 8.28 4.43 0.00 2.77 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 K 8.10 4.54 0.00 1.78 1.84 0.00 1.71 0.00 0.00 1.79 0.00 0.00 2.88 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.45 1.35 7.81 34 Q 7.94 4.05 0.00 2.22 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.90 0.00 0.00 0.00 0.00 0.00 2.43 2.35 0.00 35 E 8.66 3.96 0.00 2.20 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 0.00 2.70 2.52 0.00 36 R 8.13 4.28 0.00 2.14 2.07 0.00 3.26 0.00 0.00 3.41 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.83 0.00 37 A 7.75 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 38 N 8.52 4.33 0.00 2.69 2.98 0.00 0.00 7.09 7.02 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 39 Y 7.82 4.39 0.00 3.30 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 40 E 8.79 4.22 0.00 2.36 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 2.40 2.60 0.00 41 K 8.47 3.87 0.00 2.04 1.94 0.00 1.72 0.00 0.00 1.61 0.00 0.00 2.97 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.51 1.66 7.81 42 L 8.48 3.97 0.00 1.74 1.74 0.78 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 43 Q 8.87 4.25 0.00 2.40 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.58 0.00 0.00 0.00 0.00 0.00 2.69 2.73 0.00 44 Q 8.27 4.00 0.00 2.17 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.95 0.00 0.00 0.00 0.00 0.00 2.41 2.56 0.00 45 K 8.08 4.01 0.00 1.83 1.95 0.00 1.82 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.39 1.41 7.81 46 F 8.27 3.88 0.00 1.89 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 Q 7.50 3.71 0.00 2.14 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 7.00 0.00 0.00 0.00 0.00 0.00 2.65 2.56 0.00 *49 L 7.81 3.97 0.00 1.44 1.39 0.80 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 *51 S 8.22 4.27 0.00 3.77 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 52 K 8.01 3.97 0.00 1.60 1.69 0.00 1.67 0.00 0.00 1.61 0.00 0.00 2.86 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.15 1.34 7.81 53 H 8.08 4.49 0.00 3.10 3.35 0.00 6.05 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 Q 8.72 3.17 0.00 2.13 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.94 0.00 0.00 0.00 0.00 0.00 2.21 2.45 0.00 55 A 9.57 4.08 1.15 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 0.00 0.00 56 H 7.92 4.39 0.00 3.18 3.25 0.00 5.65 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 57 V 8.20 4.68 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 1.24 0.00 0.00 0.96 0.00 0.00 58 R 8.08 4.03 0.00 1.91 1.94 0.00 3.27 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.79 0.00 59 P 0.00 4.36 0.00 1.67 1.91 0.00 3.57 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.12 0.00 60 Q 7.90 3.76 0.00 1.62 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.87 0.00 0.00 0.00 0.00 0.00 2.42 2.46 0.00 61 F 8.05 4.13 0.00 3.12 3.14 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 0.00 62 E 7.97 4.33 0.00 1.97 2.03 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 2.36 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 V 7.81 4.42 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 0.89 0.00 0.00 0.99 0.00 0.00 141 L 7.59 4.04 0.00 1.56 1.51 0.19 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 142 E 7.84 3.85 0.00 1.86 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 2.24 2.31 0.00 143 D 7.59 3.99 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 0.00 144 Y 7.36 4.52 0.00 3.14 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 0.00 145 L 7.82 4.26 0.00 1.68 1.72 0.88 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 146 K 7.66 4.48 0.00 2.02 1.79 0.00 1.70 0.00 0.00 1.56 0.00 0.00 2.77 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.34 7.81 147 Q 8.96 4.08 0.00 2.21 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.81 0.00 0.00 0.00 0.00 0.00 2.50 2.61 0.00 148 S 8.30 4.12 0.00 3.97 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 0.00 149 F 8.22 3.90 0.00 3.03 3.31 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 0.00 150 Y 8.41 4.34 0.00 3.37 3.28 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 0.00 151 E 8.59 3.73 0.00 2.18 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 0.00 2.66 2.57 0.00 152 K 7.39 4.02 0.00 1.22 1.40 0.00 1.57 0.00 0.00 1.57 0.00 0.00 2.85 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.31 1.45 7.81 153 H 7.70 4.84 0.00 2.56 2.97 0.00 5.62 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 K 7.87 3.90 0.00 1.60 1.74 0.00 1.50 0.00 0.00 1.73 0.00 0.00 2.66 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.81 1.31 7.81 155 I 7.39 5.13 1.91 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 1.25 0.96 1.04 0.00 0.00 156 I 8.80 4.75 1.96 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.20 1.11 0.00 0.00 157 E 9.48 4.86 0.00 2.21 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 2.38 0.00 158 F 9.43 5.63 0.00 3.18 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 0.00 159 D 9.10 5.43 0.00 2.99 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 0.00 160 N 8.16 3.14 0.00 2.45 2.39 0.00 0.00 6.73 7.37 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 0.00 161 K 7.94 3.65 0.00 1.38 0.96 0.00 1.15 0.00 0.00 1.49 0.00 0.00 2.84 0.00 0.00 3.08 0.00 0.00 0.00 0.00 0.89 1.29 7.81 162 Y 9.45 4.70 0.00 3.05 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 0.00 163 G 6.87 3.95 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 0.00 0.00 0.00 164 K 8.00 5.13 0.00 1.58 1.71 0.00 1.61 0.00 0.00 1.85 0.00 0.00 3.06 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.46 1.20 7.81 165 Y 9.28 5.40 0.00 3.32 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 0.00 166 Q 9.64 5.14 0.00 2.15 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.84 0.00 0.00 0.00 0.00 0.00 2.32 2.39 0.00 167 L 9.58 4.95 0.00 1.86 1.63 1.01 -0.01 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 0.00 168 Q 9.16 4.89 0.00 2.22 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.99 0.00 0.00 0.00 0.00 0.00 2.39 2.37 0.00 169 V 8.29 4.28 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 0.73 0.00 0.00 0.66 0.00 0.00 170 F 8.73 5.05 0.00 2.99 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 0.00 171 S 7.13 4.53 0.00 3.59 2.96 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 0.00 0.00 0.00 172 A 8.34 4.94 1.15 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 0.00 0.00 173 Y 8.03 4.92 0.00 3.00 3.07 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 0.00 174 K 8.64 4.90 0.00 1.68 1.77 0.00 1.70 0.00 0.00 1.63 0.00 0.00 2.68 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.33 1.40 7.81 175 T 9.20 4.77 4.51 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 0.00 0.00 0.00 1.22 0.00 0.00 176 T 8.84 5.14 4.28 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 1.24 0.00 0.00 177 T 7.46 4.21 4.32 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 1.27 0.00 0.00 178 K 8.55 4.60 0.00 1.72 1.84 0.00 1.72 0.00 0.00 1.82 0.00 0.00 3.21 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.37 1.34 7.81 179 D 7.38 4.80 0.00 2.65 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 N 8.22 4.59 0.00 3.07 3.05 0.00 0.00 7.40 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 Y 7.91 5.07 0.00 3.27 3.25 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 0.00 182 I 7.00 4.36 1.67 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.23 0.72 0.91 0.00 0.00 183 R 7.81 4.16 0.00 1.20 1.07 0.00 3.19 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.72 0.00 184 T 7.57 4.03 4.09 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 1.04 0.00 0.00 185 D 7.29 5.01 0.00 2.47 2.42 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.05 4.63 0.00 2.92 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 0.00 187 E 8.91 4.14 0.00 2.07 2.04 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 0.00 2.51 2.41 0.00 188 N 7.86 4.78 0.00 2.98 2.92 0.00 0.00 6.13 8.07 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 0.00 189 D 8.76 4.50 0.00 2.82 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 0.00 190 Q 8.11 3.91 0.00 2.19 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.87 0.00 0.00 0.00 0.00 0.00 2.45 2.51 0.00 191 D 8.95 4.48 0.00 2.94 3.09 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 0.00 192 Y 8.55 3.66 0.00 2.68 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 0.00 193 Q 8.49 3.73 0.00 2.28 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.58 0.00 0.00 0.00 0.00 0.00 2.31 2.60 0.00 194 Q 7.98 3.96 0.00 2.43 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.55 0.00 0.00 0.00 0.00 0.00 2.58 2.57 0.00 195 F 7.79 4.03 0.00 3.36 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 0.00 196 L 7.77 3.95 0.00 1.65 1.51 0.43 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 197 D 8.06 4.28 0.00 2.79 2.66 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 0.00 0.00 0.00 0.00 198 E 8.53 3.77 0.00 2.01 1.70 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 2.19 2.18 0.00 199 T 7.51 3.63 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 200 K 8.17 4.18 0.00 1.94 1.86 0.00 1.62 0.00 0.00 1.56 0.00 0.00 2.69 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.66 1.79 7.81 201 R 7.76 3.84 0.00 1.81 1.99 0.00 3.20 0.00 0.00 3.16 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.61 0.00 202 K 8.09 3.86 0.00 0.99 0.81 0.00 0.86 0.00 0.00 1.28 0.00 0.00 2.59 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.10 1.32 7.81 203 S 7.08 4.44 0.00 3.72 3.86 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 0.00 204 V 8.60 4.40 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 0.84 0.00 0.00 1.07 0.00 0.00 205 I 7.51 4.67 1.83 0.00 0.00 0.77 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 0.20 1.05 0.00 0.00 206 N 10.11 4.58 0.00 2.54 2.79 0.00 0.00 6.68 7.45 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 0.00 207 S 8.35 4.73 0.00 3.48 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 0.00 208 D 8.76 4.65 0.00 2.74 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 V 7.61 3.95 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 0.85 0.00 0.00 1.16 0.00 0.00 210 N 8.26 4.75 0.00 2.72 2.68 0.00 0.00 5.76 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 0.00 211 V 7.94 4.22 1.60 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 0.51 0.00 0.00 -0.37 0.00 0.00 212 T 7.85 4.52 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 1.17 0.00 0.00 213 V 8.11 3.89 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 1.23 0.00 0.00 0.85 0.00 0.00 214 K 8.69 4.13 0.00 1.75 1.85 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.46 1.54 7.81 215 D 7.32 4.58 0.00 2.79 2.63 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 0.00 216 R 8.39 4.87 0.00 1.79 1.83 0.00 3.10 0.00 0.00 3.44 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 217 I 9.00 5.19 2.20 0.00 0.00 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 1.69 2.19 1.13 0.00 0.00 *219 T 8.38 4.42 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 1.19 0.00 0.00 220 L 8.99 4.93 0.00 0.97 0.75 0.67 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 221 S 8.61 4.99 0.00 3.83 3.70 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 0.00 222 T 8.32 5.23 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 1.13 0.00 0.00 223 C 8.38 4.84 0.00 3.02 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.66 4.62 0.00 2.06 1.87 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 2.25 2.39 0.00 225 D 8.50 4.56 0.00 2.77 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 0.00 226 A 8.30 4.01 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.18 3.65 0.00 3.18 3.17 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 0.00 228 S 7.65 4.54 0.00 4.02 3.86 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 0.00 229 E 7.94 3.82 0.00 1.93 1.92 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 2.32 2.45 0.00 230 T 7.97 4.08 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 1.30 0.00 0.00 231 T 8.29 4.26 4.27 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 1.28 0.00 0.00 232 K 7.61 4.84 0.00 1.63 1.82 0.00 1.65 0.00 0.00 1.71 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.40 7.81 233 R 8.95 4.78 0.00 1.89 1.74 0.00 3.32 0.00 0.00 3.38 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 234 I 8.38 4.65 1.68 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.93 0.66 0.00 0.00 235 V 7.93 4.44 0.67 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 0.32 0.00 0.00 -0.17 0.00 0.00 236 V 8.55 4.46 1.62 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 0.28 0.00 0.00 0.54 0.00 0.00 237 V 8.26 4.57 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 0.92 0.00 0.00 0.77 0.00 0.00 238 A 8.19 5.43 1.24 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 0.00 239 K 9.46 4.26 0.00 1.75 1.75 0.00 1.96 0.00 0.00 1.62 0.00 0.00 2.85 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.42 7.81 240 I 8.83 4.53 2.01 0.00 0.00 0.72 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 0.62 0.91 0.00 0.00 241 I 8.91 4.41 2.08 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.44 0.97 0.00 0.00 242 K 8.92 4.30 0.00 1.97 1.81 0.00 1.81 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.29 1.00 7.81 243 V 8.30 4.46 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 0.77 0.00 0.00 0.95 0.00 0.00 244 S 7.62 4.10 0.00 3.84 3.66 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 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.