NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 4.6215 8.2993 120.0583 56.5276 33.8048 174.6916 3 V 4.4173 8.3516 122.3864 58.4934 34.9945 172.9389 4 T 4.3741 8.7990 113.3959 61.3851 70.6504 176.4427 5 F 4.0247 9.2065 124.5836 62.0061 39.3365 177.4415 6 E 4.1121 8.4079 117.3564 59.3678 29.0586 179.0591 7 Q 3.9756 7.7991 119.1214 58.8100 29.2851 177.8055 8 L 4.1350 8.0568 121.6383 58.1474 42.2010 178.8092 9 K 3.8703 8.0894 119.6621 59.3790 31.8495 178.5504 10 A 3.9224 8.1119 121.0328 55.0030 18.1812 179.4155 11 A 3.6531 7.5371 119.0110 55.0185 18.1529 180.0299 12 F 3.7989 7.2272 115.7484 60.6374 39.0538 177.2158 13 N 4.3563 8.3421 116.7937 56.6027 38.7031 176.6200 14 R 3.8678 8.2490 120.3848 59.6076 29.9601 178.6704 15 V 3.6965 7.2422 117.7767 65.3480 31.8131 177.5139 16 L 4.2279 8.4023 118.9624 58.2445 41.6698 179.6553 17 I 3.9220 8.2151 120.0797 64.3400 36.7337 178.1572 18 S 4.4546 8.2783 113.6921 59.7758 62.6660 175.3933 19 R 4.5505 7.8055 121.2933 55.7850 30.5831 176.8148 20 G 3.9067 7.8624 105.7842 45.3748 0.0000 174.6087 21 V 3.7317 7.4432 119.4404 62.0162 32.3543 175.7682 22 D 4.4494 8.7032 125.5840 54.5409 42.8660 176.9269 23 S 4.0995 8.7850 120.2740 61.7355 62.3287 176.4074 24 E 3.9368 8.3694 121.2967 59.6013 29.6031 178.6924 25 T 3.9273 8.7218 110.1255 64.6098 68.7043 176.0113 26 A 4.0328 8.7453 124.0446 55.3083 18.4558 178.9403 27 D 4.4041 8.2773 115.8155 57.5206 40.9894 178.5987 28 A 4.0100 7.7836 120.3710 55.2076 18.5005 178.9246 29 C 4.2247 8.5462 116.0389 62.6972 32.0639 175.1037 30 A 4.2851 8.4625 122.7781 55.2196 17.8297 179.1917 31 E 3.9888 8.0800 113.4985 58.0062 29.2077 178.2969 *33 F 4.2115 8.0298 117.6680 57.1936 41.1895 177.2919 34 A 4.1512 8.2056 122.3335 55.2233 18.2678 179.6242 35 R 4.0905 8.4599 116.9397 60.0347 30.2566 179.3715 36 T 3.6381 7.7760 114.6791 66.9792 68.4792 176.6661 37 T 3.7242 7.5059 117.2821 66.3887 68.0583 176.3257 38 E 4.1174 8.6068 121.0428 58.4157 29.5103 178.0672 39 S 4.3367 7.5219 113.4335 59.1638 63.1446 174.8086 40 G 3.9446 7.6214 110.2013 45.1205 0.0000 174.5462 41 V 4.1860 7.1409 120.6434 61.5300 30.5639 175.5202 42 Y 4.2094 8.3692 124.1320 59.8615 38.7241 178.1391 43 S 4.2037 8.5279 113.5200 61.2716 62.8294 174.7606 44 H 4.9462 8.3449 114.0573 55.0341 31.0956 174.2245 45 G 3.9388 8.3468 109.0961 44.9353 0.0000 176.7714 46 V 4.0823 6.0169 125.8747 64.6880 32.1477 178.7840 47 N 4.5731 8.4043 116.9773 55.2048 38.6032 175.6596 48 R 4.4095 7.8051 116.1255 56.6854 31.0856 177.5866 49 F 3.8461 8.2320 120.0667 61.5293 39.2577 174.7386 50 P 4.1324 0.0000 0.0000 65.7621 31.1657 178.3291 51 R 3.8683 8.0342 116.5690 59.4091 30.0025 177.6917 52 F 4.2355 8.4466 120.5832 61.8254 39.2671 177.1129 53 I 3.1752 7.7055 119.3841 64.1565 36.7779 178.2394 54 Q 3.8243 7.8552 120.2566 59.3991 28.8891 178.5013 55 Q 3.9852 7.9939 118.9308 58.4380 28.6208 178.5421 56 L 3.6877 7.4403 121.6259 58.2042 41.9129 178.9375 57 E 3.9258 7.9315 117.2400 59.2786 29.4692 178.5395 58 N 4.4875 7.8227 114.4320 54.2433 38.7038 176.0708 59 G 3.9012 7.9153 109.4922 45.0624 0.0000 174.4008 60 D 3.9144 7.2914 118.7801 56.5403 40.9892 177.1189 61 I 4.5424 7.3510 117.6834 59.4177 38.9036 175.4568 62 I 4.3107 8.4258 126.1819 58.5667 37.2909 174.2433 63 P 4.3226 0.0000 0.0000 65.7352 31.6131 178.2354 64 D 4.3963 8.3144 116.4188 57.2359 40.9554 176.5312 65 A 3.9968 7.7659 119.4280 52.6747 18.8025 176.6244 66 Q 4.7228 8.2605 119.3218 52.9427 32.4495 173.6850 67 P 4.6489 0.0000 0.0000 63.2117 32.1637 175.4421 68 K 4.4883 9.2748 126.6107 54.3157 34.1643 175.3490 69 R 2.7573 7.7849 128.0859 56.3557 30.1621 174.6659 70 I 4.2215 8.3864 124.7239 62.4047 38.5748 175.6133 71 T 4.7084 7.4288 117.0650 61.7583 73.1205 172.3445 72 S 4.9588 8.4961 117.8399 56.9240 64.7649 173.5341 73 L 4.5354 9.8079 126.2823 54.0242 43.3351 174.9315 74 G 3.7438 7.1155 109.2060 44.7740 0.0000 174.1678 75 A 4.2510 8.8212 125.5385 52.0905 20.9737 178.5143 76 I 5.1903 7.5271 115.8711 59.1780 41.7474 173.8495 77 E 5.2438 9.2089 126.6659 54.8049 34.6211 173.9328 78 Q 5.0749 9.1580 124.3204 54.4645 31.1693 174.4885 79 W 5.1410 9.7488 126.1627 54.8582 33.5466 174.0766 80 D 5.2522 9.1768 121.5871 52.5326 42.5563 176.8892 81 A 4.1535 9.5598 130.6263 53.3474 18.7702 177.2695 82 Q 3.8217 9.2236 113.9363 57.4971 26.7995 173.9738 83 R 3.9667 8.7000 112.2808 57.1733 28.3723 177.2635 84 S 4.9579 7.6240 111.9239 56.6133 64.3336 173.6782 85 I 3.8944 8.3746 121.0119 61.7255 37.3160 176.9840 86 G 4.3555 9.4524 114.3361 47.6458 0.0000 175.4231 87 N 5.1412 7.9649 120.9325 54.9076 37.3422 177.0988 88 L 3.9765 7.8111 119.9316 57.7491 41.9456 179.2274 89 T 3.9198 7.9326 115.3538 66.4643 68.2351 176.6628 90 A 3.3444 7.5748 121.5130 54.8231 18.2451 179.3136 91 K 4.2983 7.3288 118.3243 58.3349 33.8604 178.5596 92 K 4.0405 7.1505 120.2146 56.5486 29.4153 176.7350 *95 D 4.4143 8.0119 121.8421 53.9576 43.4120 178.1993 96 R 3.8034 7.6648 118.5209 58.8451 29.7747 178.4370 97 A 3.9195 7.5745 120.4368 55.1010 18.6102 179.4989 98 I 3.1032 7.4089 117.8403 64.1020 35.5083 178.1662 99 E 3.8774 7.8997 120.3788 59.1461 29.4454 178.9246 100 L 4.1820 7.8554 118.9065 57.7625 41.6674 179.3278 101 A 4.1252 8.2988 120.7917 55.0379 18.0406 179.3817 102 A 4.2048 7.8199 118.4950 54.8206 18.5016 178.5380 103 D 4.8517 7.6138 113.0592 54.5220 42.4973 177.1917 104 H 4.8500 8.6126 114.4360 54.9478 30.3454 173.0554 105 G 4.4101 9.6145 112.1954 44.9576 0.0000 173.5168 106 I 5.1648 7.3203 117.2772 58.9824 41.3355 174.6094 107 G 4.3357 9.3695 115.3258 44.4566 0.0000 171.1925 108 L 5.3415 8.8133 123.6069 53.1852 46.2256 174.9579 109 V 4.9837 9.2897 125.4891 61.1498 34.6692 173.6913 110 A 4.9847 9.0920 130.5433 50.3530 20.9472 175.0757 111 L 5.3766 9.0868 125.7700 53.2826 45.0218 175.7134 112 R 4.8630 8.7864 122.0069 54.1435 33.3372 175.1423 113 N 4.2869 8.5845 112.4440 54.2673 36.3325 174.7466 114 A 4.7299 7.9229 120.7284 51.3375 20.3387 176.6791 115 N 5.3173 8.2235 115.8174 51.0256 41.9624 174.3463 116 H 3.9813 8.9096 118.5348 56.7849 31.2446 173.2663 117 W 4.0178 9.0031 124.8899 58.1251 27.0576 177.5331 *119 R 3.8286 8.8480 125.2984 55.1065 30.6559 174.8438 120 G 2.8808 8.6310 113.5334 47.6021 0.0000 174.0858 121 G 3.5797 7.9626 107.1662 47.2159 0.0000 175.5247 122 S 3.7151 7.1154 117.4859 61.9137 62.5838 176.4263 123 Y 4.4250 6.3646 118.6709 60.6984 37.5835 178.5098 124 G 3.6128 7.8784 106.4934 47.3248 0.0000 175.4324 125 W 4.0435 8.5255 131.5902 60.2686 30.2026 178.0102 126 Q 4.2793 8.5263 117.5956 59.2724 27.8266 178.6463 127 A 3.9828 7.8981 122.4872 55.0272 18.4479 179.4648 128 A 4.7007 7.8803 120.6003 54.8893 18.1170 179.7104 129 E 3.7567 7.8529 116.3516 59.0462 29.5731 178.7462 130 K 4.3723 7.7780 116.0641 56.4541 32.4520 177.8029 131 G 3.7715 8.1509 108.2347 45.2416 0.0000 172.9751 132 Y 4.7454 7.5209 116.7805 56.2369 41.2120 174.6379 133 I 4.4640 8.9226 123.1779 60.9957 38.7560 175.1988 134 G 4.5117 9.2689 114.8863 44.5488 0.0000 172.3286 135 I 5.5851 8.8056 125.9861 59.8703 41.3843 174.2609 136 C 5.0980 9.3155 120.3127 57.5708 33.4376 172.5478 137 W 5.9435 8.2310 115.6126 57.3875 31.5463 172.7616 138 T 4.7095 8.2189 114.1798 60.6067 70.8960 171.9623 139 N 5.2032 8.0588 122.9090 51.9407 40.2918 172.7424 140 S 4.4609 7.8353 111.1852 57.6367 65.2379 173.5982 141 I 3.8738 8.2199 113.1184 60.3596 37.9931 175.4892 142 A 4.2151 8.6468 125.6727 52.9114 17.8648 178.4445 143 V 4.4557 8.0169 119.2434 60.8746 32.7260 174.6720 *145 P 4.6036 0.0000 0.0000 61.6914 32.5481 174.5976 146 P 4.5128 0.0000 0.0000 61.9673 31.9325 175.3431 147 W 4.4251 8.8217 130.4446 59.2717 30.7442 176.3112 148 G 3.5804 8.1908 113.5986 44.8574 0.0000 172.4336 149 A 4.6438 7.5610 121.8377 50.2187 21.4348 176.1304 150 K 4.4712 8.3095 114.8615 56.0862 33.8770 175.5152 151 E 4.5917 7.7753 121.3033 54.2030 31.4995 174.4764 152 C 4.6013 8.7103 124.1221 60.4459 28.3358 173.6558 153 R 4.6921 8.5733 120.7284 55.4366 32.9282 174.6127 154 I 4.6513 7.5985 111.2870 58.8906 40.6504 174.8945 155 G 4.4146 8.3158 110.7128 44.1976 0.0000 174.0053 156 T 3.9020 8.5758 108.5074 63.8351 69.2066 176.6684 157 N 4.7701 7.3906 113.8696 53.3834 34.8341 170.6921 158 P 4.4872 0.0000 0.0000 62.3768 33.1201 174.7140 159 L 5.2904 8.6325 126.1168 53.5099 43.9393 175.1734 160 I 5.3283 9.1638 127.3429 58.8777 40.0352 174.9750 161 V 4.8770 8.5345 125.5793 61.4454 34.0491 173.8912 162 A 5.0873 9.6883 131.1354 50.1525 21.8859 174.5653 163 I 4.7674 8.8730 123.3419 57.9052 39.5419 175.7181 164 P 4.3859 0.0000 0.0000 62.3874 30.5252 175.9311 165 S 4.4705 7.5789 114.1546 58.4170 65.3331 172.6164 166 T 4.3983 7.9449 115.9357 61.2014 70.1374 172.4368 167 P 4.4938 0.0000 0.0000 61.5041 32.3854 176.1341 168 I 4.0314 7.7377 120.1741 61.4921 37.2847 176.3280 169 T 5.0065 8.1615 123.1716 61.3743 71.5397 174.3963 *171 V 4.1151 8.0666 116.1005 61.5506 33.1461 174.0842 172 D 5.2143 8.7546 125.0524 52.3162 44.5313 174.7213 *174 S 4.5551 7.9784 118.6499 58.1662 64.6018 175.8209 *176 S 4.2271 8.4554 112.7635 57.8432 62.8547 172.7211 *178 F 4.5055 8.3927 118.1050 57.4159 39.7946 174.2828 179 S 4.7829 8.2429 116.7493 56.9198 64.9795 174.8871 180 Y 3.9258 8.7206 119.7286 61.3366 38.1296 179.4860 181 G 3.6724 7.8303 105.4705 46.4306 0.0000 175.0650 *183 L 4.1117 8.0010 121.8159 54.4185 43.7600 178.9569 184 E 4.0525 8.2229 118.6110 59.1323 29.0578 178.7015 185 V 3.5865 7.6392 118.0011 66.2842 31.4360 177.7739 186 N 4.2819 7.9916 115.1901 56.2789 38.4618 176.8656 187 R 3.8515 7.9303 120.0553 59.8787 29.8897 178.3727 188 L 4.0168 8.0615 116.8062 57.0951 41.5654 178.4156 189 A 4.6039 7.3490 117.2441 50.4391 19.5775 176.8140 190 G 3.9376 8.1715 106.7688 47.7079 0.0000 174.0403 191 R 4.5939 7.9802 117.4309 54.0477 32.6807 174.9398 192 Q 4.4645 8.2730 122.7173 54.5835 28.8079 175.9021 193 L 3.9566 8.3350 121.4778 53.8763 42.1445 177.0342 194 P 4.5433 0.0000 0.0000 65.4348 31.5392 176.6809 195 V 4.5813 7.3607 109.7831 59.1917 35.7577 174.2017 196 D 4.5455 8.8327 121.1420 55.6775 41.0954 177.2223 197 G 4.3046 9.1688 109.5310 43.9927 0.0000 172.1464 198 G 3.9645 6.8801 108.3814 45.7137 0.0000 171.8000 199 F 5.2755 8.4517 117.9289 55.5526 41.4672 176.1345 200 D 4.8695 8.9216 123.4372 52.3001 41.4120 176.7469 201 D 4.4589 8.6387 117.6277 57.1515 40.8137 177.1025 202 E 4.3377 8.4268 116.4954 55.8447 29.8082 176.1680 203 G 3.8229 8.1604 107.0002 46.4695 0.0000 173.2646 204 N 5.2470 9.1289 116.5174 50.5508 41.0224 174.8645 205 L 4.2455 8.4285 121.2721 55.5755 42.7167 176.4901 206 T 4.6060 8.5264 114.6497 61.3317 70.5931 174.0317 207 K 4.3263 8.5519 123.9057 56.0902 33.0306 175.4637 208 E 4.4915 8.1234 121.7033 54.2803 29.7893 174.5943 209 P 4.3375 0.0000 0.0000 65.9832 31.4911 178.1473 210 G 3.8781 8.4264 103.5832 48.4253 0.0000 175.3761 211 V 3.7031 8.8712 122.0377 64.4390 31.2052 178.6217 212 I 3.9788 7.4562 119.0826 64.2818 36.8246 178.2220 213 E 4.3037 8.4643 118.4113 58.6503 29.2369 179.0523 214 K 4.1848 7.6269 119.1897 58.9881 32.6912 177.8542 215 N 4.6259 8.0100 113.8134 52.6139 37.7659 175.5394 216 R 4.1401 7.8438 118.7785 57.5461 29.0529 177.2293 217 R 4.5643 8.5121 118.4928 55.5377 28.3934 176.5632 218 I 4.0844 7.5981 119.2782 60.9401 39.3647 175.8277 219 L 4.4222 8.5921 132.0109 54.0820 42.9915 172.8096 220 P 4.6102 0.0000 0.0000 62.9202 30.0493 178.1541 *222 G 3.2767 9.0612 115.6787 45.5809 0.0000 174.8307 223 Y 2.9840 6.8714 122.9141 58.1029 37.3838 174.2299 224 W 4.2076 7.5076 131.0475 59.7864 28.0170 177.6394 225 K 4.0375 7.2779 119.4644 59.4302 31.5754 179.1692 226 G 3.6143 7.6728 104.0911 47.5976 0.0000 175.1477 227 S 4.4982 8.0413 115.2622 61.0637 62.4169 177.5161 228 G 3.9489 8.1901 106.0150 45.3292 0.0000 175.1153 *230 S 4.3265 8.0439 117.2145 58.0232 64.2258 175.9222 231 I 3.7304 7.5906 119.4921 64.6192 36.8815 178.6491 232 V 3.7953 7.5358 111.8867 64.1457 31.6404 178.3944 233 L 3.9022 7.6776 118.5627 57.3332 41.4397 179.0190 234 D 4.3549 7.9769 116.4652 54.6533 41.1384 178.0455 *236 I 4.1435 7.7687 119.3261 60.9081 39.2884 178.0652 237 A 4.0334 8.1647 121.7624 55.2638 17.9057 179.9648 238 T 3.9641 8.1102 114.4355 66.8085 68.5885 176.9634 239 L 4.0628 7.8539 120.3550 57.9623 41.6368 179.4581 240 L 4.0717 8.0612 118.2374 57.1248 41.7326 178.4337 241 S 4.5026 7.6295 109.4207 57.2015 64.1172 173.1590 242 D 4.4052 7.7274 120.3610 55.8528 40.0616 171.8561 243 G 4.3887 7.9005 108.3254 43.8731 0.0000 172.3427 244 A 4.4462 8.6788 121.8607 51.1044 19.4928 178.3742 245 S 4.9174 8.0727 118.1291 56.0030 66.7721 175.3404 246 V 3.7261 8.6163 120.7644 65.5673 31.0747 177.7547 247 A 3.9606 7.9306 119.8375 55.1296 18.4284 178.9072 248 E 3.7854 7.8978 117.2278 59.5466 29.6204 179.1472 249 V 3.7033 7.9848 118.4600 66.3872 31.3212 178.0914 250 T 3.8214 7.8106 114.3107 66.2611 68.3358 175.8319 251 Q 4.3545 7.8655 118.1077 57.0494 29.7777 176.4818 252 D 4.6093 8.5761 117.8904 54.7875 41.5343 175.9474 253 N 5.0931 7.3380 116.4503 51.0480 41.1494 175.0136 254 S 4.3534 8.7186 114.9382 60.7251 63.6578 173.0643 255 D 4.5380 7.6318 117.8739 53.4524 43.4275 174.6733 256 E 4.2400 9.3054 121.4918 55.5017 27.6265 175.3683 257 Y 4.8258 7.3156 120.3254 56.3332 41.0078 174.9658 258 G 3.8150 8.9243 107.0331 46.6335 0.0000 173.9040 259 I 4.1982 7.5817 113.6936 59.9786 40.1698 174.1979 260 S 5.2816 9.0850 117.9355 56.9045 65.6366 173.8208 261 Q 4.5291 8.9330 121.7470 54.0219 33.3131 174.0134 262 I 4.4550 7.8355 122.7872 59.2315 40.3150 174.5664 263 F 5.0439 8.7443 124.6967 55.6723 42.2706 174.2079 264 I 5.2258 9.2067 123.9855 59.4600 41.2340 174.3263 265 A 5.2406 9.0159 127.1575 50.2719 22.7224 174.9449 266 I 5.0596 8.5295 121.1000 59.4287 41.1725 174.6898 267 E 4.2812 9.1819 128.7204 56.4722 30.0637 175.8474 268 V 4.1607 8.1565 123.9194 64.6908 33.3317 177.3945 269 D 4.6252 8.0072 117.4432 57.2317 40.6154 177.5996 270 K 4.3272 7.8841 115.4611 56.7006 32.2761 176.8763 271 L 4.7253 8.0691 117.9694 54.2809 43.6342 176.3103 272 I 4.5169 7.2474 116.9414 58.2172 41.0317 174.3905 273 D 4.6351 8.6029 126.4645 53.8388 42.7330 177.8022 274 G 3.6668 8.5942 109.3847 47.7817 0.0000 174.3008 275 P 4.2591 0.0000 0.0000 65.4752 31.3774 178.9493 276 T 3.8469 7.8376 114.0464 66.4282 68.4415 176.6390 277 R 3.8565 8.2762 121.2845 59.4972 30.1279 178.3670 278 D 4.3408 8.2780 118.5794 57.0218 40.7024 178.6557 279 A 3.9207 8.2948 121.6162 55.1507 18.4098 179.7411 280 K 3.8518 8.1634 116.9810 59.7623 31.9501 179.6642 281 L 4.0230 7.5940 117.6389 57.7779 41.5528 179.0814 282 Q 4.1062 7.8583 118.9345 58.9914 29.4113 177.8166 283 R 4.1006 8.3671 120.0471 58.9330 30.0827 177.6158 284 I 4.1297 7.2591 118.0976 62.1068 36.9006 177.1455 *286 D 4.7808 7.9276 121.8163 54.6698 42.6343 177.2795 287 Y 4.2020 7.8897 118.5434 60.5758 39.1951 177.6197 288 V 3.6873 7.9854 119.8026 65.9098 31.9134 178.2158 289 T 3.9372 7.8905 109.5840 63.9981 68.7242 175.2491 290 S 4.5842 8.0580 115.3335 57.8044 63.4069 174.2194 291 A 3.9641 7.5425 124.6815 51.8190 18.6172 177.5436 292 E 3.9405 8.5317 122.5862 56.4762 30.1599 177.0739 293 R 4.2753 8.3083 124.6315 55.5264 31.2322 176.4723 294 A 4.0958 8.3485 122.5515 53.9583 19.1858 177.2937 295 D 4.5201 7.6793 114.4512 52.2980 42.7903 174.9468 296 E 4.0829 8.8938 128.7352 58.9263 29.5520 177.4134 297 N 4.7926 8.5207 113.7421 52.6581 38.7755 174.4488 298 Q 4.4017 8.2950 118.2074 53.5693 29.9831 175.5083 299 A 4.0606 8.4041 125.8930 52.1420 19.0305 176.8101 300 I 4.0874 8.0530 121.4279 60.3796 37.5112 176.1657 301 R 4.2822 8.3568 125.1512 55.3180 31.1131 176.1575 302 L 4.4328 8.0646 121.9978 52.2601 43.2457 174.3874 303 P 4.2588 0.0000 0.0000 64.5901 31.3761 177.3733 304 G 4.3146 8.7379 110.5549 45.8253 0.0000 174.0551 305 H 4.7091 7.8620 115.5062 56.7511 29.0259 176.4427 306 E 4.2012 7.7599 118.5928 57.8922 30.0007 177.6985 307 F 4.5451 7.6775 118.7654 59.2613 39.1203 177.1711 308 T 4.2825 7.8941 109.9753 64.5560 69.1650 176.6070 309 T 4.0094 7.8020 115.2931 64.4784 67.5546 176.2642 310 L 4.0114 7.8437 120.9136 57.7219 41.6490 179.3215 311 L 4.1549 7.8571 119.7751 57.5685 41.8632 178.7541 312 A 3.9928 7.6006 118.8264 55.4154 18.7832 179.1590 313 E 4.0755 8.7330 117.3620 59.6808 29.5692 179.3937 314 N 4.5566 8.3339 116.4989 55.5831 38.3595 176.0919 315 R 4.6477 7.7858 118.4420 56.1599 31.2842 176.9679 316 R 4.6261 7.8763 117.5550 56.9182 34.9104 175.0877 317 N 4.7597 8.1276 112.0529 52.3022 39.0857 175.3300 318 G 4.0597 7.5347 104.7267 45.2425 0.0000 173.3563 319 I 4.1991 7.8913 119.2579 60.3881 38.0821 175.7269 320 T 4.5751 8.5385 121.8688 62.1315 68.7696 174.0973 321 V 4.4742 7.8538 126.0372 60.3954 34.1590 175.3645 322 D 4.4432 8.5048 124.7409 54.3640 42.6013 177.0103 323 D 4.4501 8.7247 127.0303 57.6490 41.0612 179.1224 324 S 4.1782 8.5573 114.9054 61.4101 62.8878 176.7630 325 V 3.6676 8.0394 121.4977 65.4913 31.4283 177.6500 326 W 4.0904 8.4105 128.0287 60.4848 30.4827 177.8972 327 A 4.0406 8.4907 120.9129 54.8804 17.5577 179.5524 328 K 3.9019 7.8059 117.6907 59.4895 32.6493 178.9952 329 I 3.9198 7.6796 120.3105 64.4565 37.0452 178.3840 330 Q 3.7759 7.7954 118.6415 58.7663 28.5994 178.6940 331 A 4.8740 8.1525 123.1508 54.4224 18.0887 179.5993 332 L 3.9945 7.4445 116.5502 57.5528 41.7161 178.9172 333 L 4.2119 7.6864 117.4221 56.1966 42.0038 176.7589 334 E 4.1220 7.9131 123.6861 56.6364 29.4147 176.6071 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 2 K 8.30 4.62 0.00 1.57 1.74 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.88 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.30 1.39 7.81 3 V 8.35 4.42 1.47 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 0.59 0.00 0.00 0.74 0.00 0.00 4 T 8.80 4.37 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 1.20 0.00 0.00 5 F 9.21 4.02 0.00 3.18 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 6 E 8.41 4.11 0.00 2.09 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 2.63 2.42 0.00 7 Q 7.80 3.98 0.00 2.06 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.96 0.00 0.00 0.00 0.00 0.00 2.44 2.45 0.00 8 L 8.06 4.13 0.00 1.82 1.51 0.99 0.07 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 9 K 8.09 3.87 0.00 1.35 1.74 0.00 1.85 0.00 0.00 1.71 0.00 0.00 3.11 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.44 1.48 7.81 10 A 8.11 3.92 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 A 7.54 3.65 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 F 7.23 3.80 0.00 3.07 2.67 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 13 N 8.34 4.36 0.00 2.97 2.84 0.00 0.00 6.91 7.20 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 14 R 8.25 3.87 0.00 2.07 1.87 0.00 3.09 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 15 V 7.24 3.70 2.60 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 1.18 0.00 0.00 1.10 0.00 0.00 16 L 8.40 4.23 0.00 2.04 1.84 1.18 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 17 I 8.22 3.92 1.96 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.08 0.93 0.00 0.00 18 S 8.28 4.45 0.00 4.06 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 19 R 7.81 4.55 0.00 1.89 1.88 0.00 3.28 0.00 0.00 3.18 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.65 0.00 20 G 7.86 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 21 V 7.44 3.73 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 0.90 0.00 0.00 0.98 0.00 0.00 22 D 8.70 4.45 0.00 2.85 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 23 S 8.79 4.10 0.00 3.94 3.89 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 24 E 8.37 3.94 0.00 2.10 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 2.40 2.39 0.00 25 T 8.72 3.93 4.30 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 1.34 0.00 0.00 26 A 8.75 4.03 1.53 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 0.00 0.00 27 D 8.28 4.40 0.00 2.87 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 28 A 7.78 4.01 1.43 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 0.00 0.00 0.00 29 C 8.55 4.22 0.00 3.18 3.29 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 30 A 8.46 4.29 1.57 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 0.00 0.00 31 E 8.08 3.99 0.00 2.36 2.24 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 2.39 2.50 0.00 *33 F 8.03 4.21 0.00 2.64 1.57 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 34 A 8.21 4.15 0.98 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 35 R 8.46 4.09 0.00 1.79 1.98 0.00 3.26 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 1.90 0.00 36 T 7.78 3.64 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 1.07 0.00 0.00 37 T 7.51 3.72 4.45 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 1.20 0.00 0.00 38 E 8.61 4.12 0.00 2.22 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 0.00 2.32 2.43 0.00 39 S 7.52 4.34 0.00 3.79 3.52 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.62 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 41 V 7.14 4.19 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 0.99 0.00 0.00 0.83 0.00 0.00 42 Y 8.37 4.21 0.00 3.20 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 43 S 8.53 4.20 0.00 4.00 4.12 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 44 H 8.34 4.95 0.00 3.16 3.37 0.00 5.68 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 G 8.35 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 46 V 6.02 4.08 2.46 0.00 0.00 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 1.22 0.00 0.00 47 N 8.40 4.57 0.00 3.05 3.04 0.00 0.00 6.91 7.80 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 48 R 7.81 4.41 0.00 2.26 2.11 0.00 3.20 0.00 0.00 3.17 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.76 0.00 49 F 8.23 3.85 0.00 2.83 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 50 P 0.00 4.13 0.00 2.24 2.13 0.00 3.91 0.00 0.00 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.30 0.00 51 R 8.03 3.87 0.00 1.96 2.18 0.00 3.27 0.00 0.00 3.29 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.83 0.00 52 F 8.45 4.24 0.00 3.25 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 53 I 7.71 3.18 1.67 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 -0.08 0.74 0.00 0.00 54 Q 7.86 3.82 0.00 2.21 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.80 0.00 0.00 0.00 0.00 0.00 2.32 2.40 0.00 55 Q 7.99 3.99 0.00 2.19 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.59 0.00 0.00 0.00 0.00 0.00 2.39 2.57 0.00 56 L 7.44 3.69 0.00 1.15 1.38 0.81 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 57 E 7.93 3.93 0.00 2.00 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 2.25 2.39 0.00 58 N 7.82 4.49 0.00 2.76 2.80 0.00 0.00 7.28 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 59 G 7.92 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 0.00 0.00 0.00 60 D 7.29 3.91 0.00 2.65 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 61 I 7.35 4.54 1.70 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 1.57 0.55 0.92 0.00 0.00 62 I 8.43 4.31 1.87 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 1.26 1.09 0.98 0.00 0.00 63 P 0.00 4.32 0.00 2.05 2.17 0.00 3.66 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 2.01 2.11 0.00 64 D 8.31 4.40 0.00 2.65 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 65 A 7.77 4.00 1.36 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 0.00 0.00 0.00 0.00 0.00 0.00 66 Q 8.26 4.72 0.00 2.04 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.83 0.00 0.00 0.00 0.00 0.00 2.43 2.31 0.00 67 P 0.00 4.65 0.00 2.10 2.14 0.00 3.70 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.12 0.00 68 K 9.27 4.49 0.00 1.90 1.65 0.00 1.60 0.00 0.00 1.51 0.00 0.00 2.78 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.20 1.26 7.81 69 R 7.78 2.76 0.00 0.67 0.99 0.00 2.88 0.00 0.00 2.96 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.50 0.00 70 I 8.39 4.22 1.91 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.00 0.89 0.00 0.00 71 T 7.43 4.71 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 1.19 0.00 0.00 72 S 8.50 4.96 0.00 3.78 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 L 9.81 4.54 0.00 1.67 1.68 0.93 0.85 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 74 G 7.12 3.74 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 0.00 0.00 0.00 75 A 8.82 4.25 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 76 I 7.53 5.19 1.89 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.63 0.93 0.00 0.00 77 E 9.21 5.24 0.00 2.27 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 0.00 2.29 2.34 0.00 78 Q 9.16 5.07 0.00 2.12 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.66 0.00 0.00 0.00 0.00 0.00 2.29 2.46 0.00 79 W 9.75 5.14 0.00 3.19 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 80 D 9.18 5.25 0.00 2.68 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 A 9.56 4.15 1.43 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 0.00 0.00 0.00 82 Q 9.22 3.82 0.00 2.21 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.71 0.00 0.00 0.00 0.00 0.00 2.37 2.62 0.00 83 R 8.70 3.97 0.00 1.96 2.15 0.00 3.51 0.00 0.00 3.42 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.72 0.00 84 S 7.62 4.96 0.00 4.11 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 85 I 8.37 3.89 1.98 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.01 1.16 0.00 0.00 86 G 9.45 4.36 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 N 7.96 5.14 0.00 2.92 3.01 0.00 0.00 6.75 6.67 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 88 L 7.81 3.98 0.00 1.68 1.79 1.07 0.87 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 89 T 7.93 3.92 4.33 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 1.13 0.00 0.00 90 A 7.57 3.34 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 K 7.33 4.30 0.00 1.95 1.97 0.00 1.66 0.00 0.00 1.54 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.39 1.56 7.81 92 K 7.15 4.04 0.00 1.67 1.50 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.35 1.53 7.81 *95 D 8.01 4.41 0.00 2.83 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 96 R 7.66 3.80 0.00 1.47 1.41 0.00 3.26 0.00 0.00 3.25 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.59 0.00 97 A 7.57 3.92 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 98 I 7.41 3.10 1.74 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.81 0.21 0.00 0.00 99 E 7.90 3.88 0.00 2.20 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 0.00 2.30 2.32 0.00 100 L 7.86 4.18 0.00 1.88 1.66 1.05 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 101 A 8.30 4.13 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 0.00 102 A 7.82 4.20 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 111 L 9.09 5.38 0.00 1.90 1.80 1.05 0.72 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 0.00 112 R 8.79 4.86 0.00 1.93 2.14 0.00 3.00 0.00 0.00 3.53 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.61 0.00 113 N 8.58 4.29 0.00 3.12 2.97 0.00 0.00 6.65 7.16 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 0.00 114 A 7.92 4.73 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 0.00 115 N 8.22 5.32 0.00 3.03 2.90 0.00 0.00 6.77 8.16 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 0.00 116 H 8.91 3.98 0.00 3.27 3.38 0.00 5.66 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 W 9.00 4.02 0.00 3.54 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 *119 R 8.85 3.83 0.00 1.70 1.56 0.00 2.83 0.00 0.00 2.88 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.42 0.00 120 G 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0.00 0.00 0.00 0.00 0.00 0.00 184 E 8.22 4.05 0.00 2.13 2.14 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 2.33 2.34 0.00 185 V 7.64 3.59 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 0.98 0.00 0.00 1.02 0.00 0.00 186 N 7.99 4.28 0.00 2.73 3.00 0.00 0.00 6.65 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 0.00 187 R 7.93 3.85 0.00 1.91 2.18 0.00 3.11 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.70 0.00 188 L 8.06 4.02 0.00 1.83 1.73 0.93 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 189 A 7.35 4.60 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 G 8.17 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 0.00 191 R 7.98 4.59 0.00 1.71 1.88 0.00 3.22 0.00 0.00 3.20 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.52 0.00 192 Q 8.27 4.46 0.00 2.05 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.75 0.00 0.00 0.00 0.00 0.00 2.30 2.30 0.00 193 L 8.33 3.96 0.00 1.48 1.34 0.14 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 194 P 0.00 4.54 0.00 2.25 2.24 0.00 3.62 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 2.34 2.17 0.00 195 V 7.36 4.58 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 0.71 0.00 0.00 0.98 0.00 0.00 196 D 8.83 4.55 0.00 2.67 2.60 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 0.00 197 G 9.17 4.30 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 0.00 198 G 6.88 3.96 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 0.00 0.00 0.00 199 F 8.45 5.28 0.00 3.09 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 0.00 200 D 8.92 4.87 0.00 2.86 2.89 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0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.96 1.26 0.00 0.00 237 A 8.16 4.03 1.36 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 0.00 0.00 0.00 0.00 0.00 0.00 238 T 8.11 3.96 4.30 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 1.31 0.00 0.00 239 L 7.85 4.06 0.00 1.73 1.74 0.96 0.67 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 0.00 240 L 8.06 4.07 0.00 1.82 1.75 0.96 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 241 S 7.63 4.50 0.00 4.04 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 0.00 242 D 7.73 4.41 0.00 2.80 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 0.00 243 G 7.90 4.39 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 0.00 244 A 8.68 4.45 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 278 D 8.28 4.34 0.00 2.84 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 0.00 279 A 8.29 3.92 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 0.00 280 K 8.16 3.85 0.00 1.88 1.85 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.60 7.81 281 L 7.59 4.02 0.00 1.93 1.72 0.91 0.84 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 0.00 282 Q 7.86 4.11 0.00 2.25 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 7.01 0.00 0.00 0.00 0.00 0.00 2.37 2.60 0.00 283 R 8.37 4.10 0.00 1.95 2.04 0.00 3.08 0.00 0.00 3.08 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.61 0.00 284 I 7.26 4.13 2.05 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 1.52 1.20 0.95 0.00 0.00 *286 D 7.93 4.78 0.00 2.88 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 7.89 4.20 0.00 3.12 3.18 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 0.00 288 V 7.99 3.69 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 0.89 0.00 0.00 0.99 0.00 0.00 289 T 7.89 3.94 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 1.26 0.00 0.00 290 S 8.06 4.58 0.00 3.99 4.04 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 0.00 0.00 0.00 291 A 7.54 3.96 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 0.00 292 E 8.53 3.94 0.00 1.90 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 2.27 2.32 0.00 293 R 8.31 4.28 0.00 1.82 1.90 0.00 3.24 0.00 0.00 3.49 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.72 0.00 294 A 8.35 4.10 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 0.00 295 D 7.68 4.52 0.00 2.64 2.48 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 0.00 296 E 8.89 4.08 0.00 1.95 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 2.30 2.36 0.00 297 N 8.52 4.79 0.00 2.72 2.78 0.00 0.00 6.79 7.25 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 0.00 298 Q 8.30 4.40 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.89 0.00 0.00 0.00 0.00 0.00 2.47 2.44 0.00 299 A 8.40 4.06 1.23 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 0.00 0.00 0.00 0.00 0.00 0.00 300 I 8.05 4.09 1.84 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 1.38 0.83 0.87 0.00 0.00 301 R 8.36 4.28 0.00 1.76 1.81 0.00 3.16 0.00 0.00 3.19 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 302 L 8.06 4.43 0.00 1.26 1.20 0.91 0.97 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 0.00 303 P 0.00 4.26 0.00 2.25 2.21 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 2.07 1.97 0.00 304 G 8.74 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 0.00 0.00 0.00 0.00 305 H 7.86 4.71 0.00 3.21 3.38 0.00 5.67 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 306 E 7.76 4.20 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 1.47 1.89 0.00 307 F 7.68 4.55 0.00 3.06 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.89 4.28 4.34 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 1.45 0.00 0.00 309 T 7.80 4.01 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 1.25 0.00 0.00 310 L 7.84 4.01 0.00 1.89 1.83 0.97 0.51 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 0.00 311 L 7.86 4.15 0.00 1.86 1.82 0.91 0.77 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 0.00 312 A 7.60 3.99 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 0.00 313 E 8.73 4.08 0.00 2.13 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 2.59 2.51 0.00 314 N 8.33 4.56 0.00 3.04 2.91 0.00 0.00 6.98 7.76 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 0.00 315 R 7.79 4.65 0.00 1.84 1.92 0.00 3.11 0.00 0.00 3.08 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.75 0.00 316 R 7.88 4.63 0.00 1.71 1.87 0.00 3.19 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 1.51 1.65 0.00 317 N 8.13 4.76 0.00 2.77 2.78 0.00 0.00 7.07 7.04 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 0.00 318 G 7.53 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 0.00 0.00 0.00 319 I 7.89 4.20 2.04 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.68 1.07 0.00 0.00 320 T 8.54 4.58 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 1.13 0.00 0.00 321 V 7.85 4.47 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 1.03 0.00 0.00 1.07 0.00 0.00 322 D 8.50 4.44 0.00 2.76 2.60 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 0.00 323 D 8.72 4.45 0.00 2.75 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 0.00 324 S 8.56 4.18 0.00 4.08 4.16 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 0.00 325 V 8.04 3.67 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 1.24 0.00 0.00 1.10 0.00 0.00 326 W 8.41 4.09 0.00 3.56 3.24 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 0.00 327 A 8.49 4.04 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 0.00 328 K 7.81 3.90 0.00 1.96 2.05 0.00 1.84 0.00 0.00 1.75 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.49 7.81 329 I 7.68 3.92 1.68 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.12 0.67 0.00 0.00 330 Q 7.80 3.78 0.00 2.02 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 1.60 2.13 0.00 331 A 8.15 4.87 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 0.00 332 L 7.44 3.99 0.00 1.79 1.72 0.90 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 333 L 7.69 4.21 0.00 1.70 1.69 0.84 0.97 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 0.00 334 E 7.91 4.12 0.00 2.25 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 2.32 2.24 0.00 * Residues marked with a * may have inaccurate shift predictions.