NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.4226 7.8676 121.0499 61.2852 39.8613 174.2594 17 S 4.4306 8.9810 121.8205 55.6540 66.2382 172.0782 18 G 3.4134 8.3588 109.9501 47.2662 0.0000 174.9872 19 G 3.7938 9.0090 113.1726 45.2584 0.0000 172.8160 *29 D 4.5490 8.0287 117.7045 53.7522 42.6119 174.9983 30 A 4.5876 8.4757 122.6214 52.1224 19.3665 177.0539 31 I 4.9012 8.3840 113.3826 59.4250 41.5042 173.6871 32 Y 5.4465 9.7612 122.8639 56.6256 41.1319 175.2228 33 S 4.8215 8.5443 118.8909 56.4475 65.2609 173.7766 34 S 4.1820 8.4557 112.7018 61.2696 63.4716 176.0197 *39 T 4.2979 7.4148 109.7131 61.2967 70.8895 173.4247 40 G 4.0146 7.3843 110.9113 44.8899 0.0000 171.2057 41 R 5.0201 8.6937 121.3458 55.0756 33.1558 176.8638 42 C 5.1405 9.0619 122.0790 55.7469 44.6828 172.6679 43 S 5.2074 8.5882 114.7335 56.9557 66.0720 174.2413 44 L 3.2973 8.6650 125.8141 55.6057 42.3133 176.2702 45 G 4.0102 9.4467 114.8429 48.0380 0.0000 172.7711 46 F 5.1222 7.9752 115.6082 54.9025 44.4469 173.5116 47 N 5.4014 8.9065 119.4194 53.1986 39.5820 174.7634 48 V 5.2405 9.4660 116.1895 60.2130 37.0651 174.1446 48A R 5.1299 9.0258 116.5415 55.4520 33.3374 174.4928 48B S 4.5826 8.7553 114.6232 56.2502 65.2630 174.8522 48C G 3.7864 8.9189 119.9944 47.1016 0.0000 173.2836 48D S 4.4180 8.8647 117.9100 57.6852 63.2892 173.1635 49 T 4.3292 7.7961 119.3230 62.5956 69.5925 173.0964 50 Y 5.1093 8.2346 123.8121 57.0381 40.5971 174.3025 51 Y 5.3433 9.4310 119.6861 56.7597 43.5691 173.6214 52 F 5.5833 8.5615 113.9453 55.5545 41.5605 174.1155 53 L 5.0689 9.1229 121.2157 54.6598 44.0935 175.6957 54 T 4.5238 8.2838 114.4966 61.4204 71.5338 172.3496 55 A 4.2432 8.5005 124.4976 51.7751 19.2467 179.0828 56 G 3.8373 8.7978 110.6335 46.6176 0.0000 175.4919 57 H 3.7010 7.7818 114.8812 57.4933 28.3492 176.4147 58 C 4.5715 7.4248 119.0798 59.5784 35.7594 175.4569 59 T 4.4335 7.8650 110.4666 62.8168 68.8321 173.8133 60 D 4.3045 7.9803 122.8360 54.7261 41.2738 176.6257 58 G 3.9815 7.4348 109.2798 46.4784 0.0000 175.7569 59 A 4.4035 7.9550 120.6666 53.5168 18.1321 176.9133 60 T 4.0145 7.7903 116.0360 62.3261 69.9738 175.0257 65 T 4.6788 7.4183 118.9538 60.6568 70.7710 173.6206 66 W 4.9912 8.3260 123.7223 54.7195 32.8676 174.6292 67 W 5.4349 10.0444 122.7941 55.0470 32.4489 176.0958 68 A 4.4713 9.5199 123.2695 53.5599 19.5676 177.2600 *78 N 5.0788 8.2435 112.0362 52.2832 38.4153 175.6797 79 S 3.0010 7.8445 112.9967 60.6369 63.1254 175.2587 80 A 3.8878 7.6048 121.9345 52.3331 18.7066 176.8286 81 R 3.3003 7.1791 114.0836 57.4239 27.7506 176.9663 82 T 4.3515 8.1154 106.4463 61.8256 70.9687 174.1144 83 T 4.6135 8.2886 119.6697 61.7034 70.1085 174.2239 84 V 3.9448 8.6035 126.9121 63.1009 32.3136 174.7648 85 L 4.6347 8.9222 125.8402 54.8077 43.8147 176.8769 86 G 4.2373 6.7707 103.7107 45.6824 0.0000 171.0543 87 T 5.8087 7.4899 112.7969 60.1725 71.0897 174.6899 88 T 4.3243 8.7759 123.9362 64.5919 68.3943 174.0159 89 S 4.6675 8.8562 121.7949 58.8650 65.3071 174.4726 90 G 4.1696 7.6732 104.2977 45.5934 0.0000 172.4733 91 S 4.7758 8.3527 115.6332 56.9861 66.4920 172.9314 *93 S 4.4643 8.6766 120.7795 58.9716 63.1958 171.9168 94 F 5.3374 8.5980 124.3335 57.5932 42.7664 172.1146 *99A P 3.2151 0.0000 0.0000 64.2741 31.8560 175.8850 100 N 4.8078 8.8205 116.4592 53.7659 37.5119 173.9781 101 N 5.5548 7.5092 111.5186 51.8867 42.0243 174.6756 102 D 5.1234 8.8505 115.5561 53.2886 41.9077 173.4744 103 Y 5.2813 8.0850 118.6482 55.8188 42.0311 175.6962 104 G 4.4764 9.1843 106.4084 45.4154 0.0000 171.5691 105 I 4.9758 8.6286 120.1176 58.8245 41.9368 174.0587 106 V 4.4615 7.8529 127.7355 60.8008 34.3807 174.1321 107 R 4.3269 8.7339 129.0503 55.5508 31.2791 175.0452 108 Y 4.8174 8.4470 125.2751 58.4378 38.2319 176.0036 109 T 4.4145 9.3479 112.7404 61.2314 70.6780 173.1777 110 N 4.7189 8.2912 121.6201 53.1098 38.9194 174.5449 111 T 4.1735 8.5386 116.4381 63.0970 69.6433 175.4032 112 T 4.2820 7.8798 110.8237 62.1950 70.3108 175.0429 113 I 3.7418 7.8988 122.7764 60.0269 38.4422 173.7229 114 P 4.3163 0.0000 0.0000 62.6993 31.8854 176.9496 115 K 4.4473 7.8840 121.6670 54.1921 31.8728 174.8043 116 D 4.4570 8.3573 121.2582 54.2638 42.1864 177.7625 117 G 3.4939 8.4207 114.2676 44.7886 0.0000 171.7014 118 T 4.8448 7.1160 108.1823 60.0190 72.7303 173.1702 119 V 4.4173 8.3066 120.9448 61.4787 32.8730 176.1421 120 G 3.7634 8.0220 120.4205 46.9156 0.0000 175.2210 121 G 3.7103 8.7218 113.9437 45.8123 0.0000 172.9955 122 Q 3.9841 8.0322 122.9085 55.5074 29.0697 174.8236 123 D 4.6368 8.5546 125.5635 54.2083 42.0083 174.9103 124 I 4.8001 7.9259 126.2139 59.8626 38.9652 175.4621 125 T 4.6848 8.8940 116.2617 61.5364 70.7408 173.3121 126 S 4.6001 7.5682 115.3905 57.9269 66.1922 173.2306 127 A 5.1684 8.4443 120.5407 50.3751 21.6194 175.0933 128 A 4.6435 8.4762 120.1323 50.7567 22.9445 175.7148 129 N 4.6008 8.5704 116.3042 52.0916 39.7660 175.7882 130 A 4.2627 8.3577 125.1853 52.3166 19.4882 176.9265 131 T 4.6961 7.9542 109.1140 59.2119 72.0268 173.6959 132 V 3.7616 8.2530 123.2731 64.6297 31.8581 176.4433 133 G 3.9477 9.0263 116.2603 45.0499 0.0000 173.1630 134 M 4.2234 7.8740 120.7828 55.3615 33.4622 174.9294 135 A 4.6577 8.4847 127.8943 51.7257 19.6540 176.8360 136 V 4.5796 8.7447 115.2848 59.8644 36.6800 174.7569 137 T 4.9002 8.4911 117.3957 61.8902 72.7934 173.3248 138 R 5.6450 9.1735 124.9997 53.6307 33.4592 174.0906 139 R 5.1624 8.6930 124.2042 54.6691 33.3145 174.1199 140 G 4.4090 8.8783 112.3820 44.4144 0.0000 172.9958 141 S 4.3684 9.0856 115.6020 60.4790 63.8346 175.7413 142 T 4.2567 8.3302 118.4750 65.6611 68.8866 176.5288 143 T 4.3799 7.9818 109.0881 62.3283 70.7891 174.3035 *156 G 4.3703 7.3931 108.9951 46.9527 0.0000 172.7170 157 T 5.2617 8.5558 121.8403 62.5050 70.0918 173.9591 158 H 4.9543 9.4038 122.7555 54.2695 33.4816 172.6794 159 S 4.9832 8.4200 116.6585 56.7568 66.2862 174.1437 160 G 4.0045 7.7823 106.9136 46.1611 0.0000 172.2208 161 S 5.1009 8.5117 114.8587 56.3916 67.3474 173.7544 162 V 4.2030 8.6037 121.9814 63.1831 31.6960 176.3747 163 T 4.4742 8.7193 117.9468 62.2027 70.3102 174.0952 164 A 4.5313 7.4137 121.6324 51.4024 22.4425 174.7470 165 L 5.0187 8.3454 118.2493 52.4113 46.0735 175.4079 166 N 4.1297 8.6613 114.5687 54.6457 37.5414 173.3311 167 A 4.7618 8.3641 117.7784 51.5975 20.6426 177.4679 168 T 4.6537 8.3174 117.2466 61.8740 70.4285 174.2702 169 V 3.6881 8.1391 126.5645 60.7401 34.1220 173.6600 170 N 4.6754 8.2450 127.1275 52.2854 39.1759 173.9309 171 Y 4.3591 8.6494 124.3160 57.9726 38.5936 177.2375 172 G 3.9449 8.5592 106.2530 46.0179 0.0000 173.7637 173 G 4.0394 9.4629 104.1585 46.3263 0.0000 175.0248 174 G 3.9094 8.4795 106.2139 44.9994 0.0000 174.9218 175 D 4.4927 7.9099 121.4930 52.6962 39.9445 173.9953 176 V 4.4317 7.5680 121.1436 60.7133 34.4218 174.1604 177 V 4.6448 8.1257 120.6975 59.7126 34.5680 174.3727 178 Y 4.8159 8.5521 121.3114 56.3417 41.3914 175.3382 179 G 4.4801 8.8151 106.4787 45.9411 0.0000 173.8971 180 M 4.6980 8.1267 118.8266 54.6714 33.8745 175.6017 181 I 4.5831 9.0246 123.2531 60.6690 38.9179 174.8672 182 R 4.6995 9.1085 128.4684 55.2731 31.8895 175.0951 183 T 5.1044 8.3046 114.4910 60.0926 73.4217 173.1590 184 N 4.7447 8.3327 116.1587 52.8719 38.4123 174.4804 *190 V 4.4977 8.0496 117.7824 63.8544 32.5214 173.9139 191 C 4.6380 8.7116 120.7977 54.8674 43.1986 172.3593 192 A 4.7201 7.7235 120.2727 51.6578 21.3805 175.4237 192A E 4.7300 9.3003 119.4787 53.4206 33.8187 173.5016 192B P 4.2402 0.0000 0.0000 64.5378 31.5215 176.1670 193 G 4.4309 8.8760 110.7606 46.8008 0.0000 174.4135 194 D 4.4786 8.5451 119.2869 55.7599 41.4891 176.6568 195 S 4.3576 7.9482 115.6201 60.4053 63.2834 175.6838 196 G 4.1758 8.8217 112.3249 46.2988 0.0000 173.8393 197 G 4.1243 8.0304 107.2631 44.8628 0.0000 171.5199 198 P 4.8268 0.0000 0.0000 62.2266 33.1429 174.7215 199 L 5.1710 9.0592 124.1863 53.6008 44.4190 174.7584 200 Y 5.4211 9.2240 123.8005 55.5812 42.7661 174.5757 201 S 4.3817 9.1511 113.9716 56.0418 64.6350 174.9566 202 G 3.9417 8.6945 120.9106 46.9587 0.0000 173.0799 *207 T 4.9519 8.3723 115.3570 60.9898 71.1468 171.4631 208 R 5.0896 7.9286 121.3652 54.8003 32.6330 175.2260 209 A 4.4591 9.0449 126.5379 51.9906 19.3638 177.1366 210 I 4.1038 9.1418 122.8038 62.6691 40.3026 175.6308 211 G 4.7396 7.8011 106.0723 45.6947 0.0000 171.1914 212 L 5.5797 8.9970 119.0380 52.8347 45.4266 176.9011 213 T 3.6779 9.2080 121.2095 64.3659 68.8864 173.7875 214 S 4.3455 8.5641 120.7755 58.1629 64.0690 174.1944 215 G 4.0415 7.3684 104.9769 46.7244 0.0000 171.5385 216 G 4.2836 7.8025 105.6023 46.3370 0.0000 170.8074 217 S 4.6264 7.9379 116.2602 57.4950 66.7809 174.3898 218 G 4.0812 9.7122 107.9301 45.5768 0.0000 171.2642 219 N 4.7940 7.8215 115.0090 52.2554 40.2269 174.4122 220 C 4.3572 9.3446 115.6689 59.2917 40.5506 175.7906 221 S 4.2440 8.3049 113.7919 61.1063 62.1591 175.0913 222 S 4.3327 8.5787 113.9471 58.7525 63.4124 175.4671 223 G 4.0024 9.7096 107.0439 45.6438 0.0000 172.7001 224 G 4.4862 7.6419 104.9348 45.8799 0.0000 171.9648 225 T 4.8492 8.4090 115.5309 61.9401 71.9779 173.8059 226 T 4.9107 8.2521 122.1965 61.6775 72.4396 172.9322 227 F 5.3920 9.4945 124.3569 55.9404 41.8425 174.8238 228 F 5.4263 9.4023 120.5320 55.7057 43.2247 173.7924 229 Q 4.7676 9.2476 124.0583 54.5343 30.6178 173.5249 230 P 4.7698 0.0000 0.0000 62.7336 32.1243 177.8228 231 V 3.7554 8.8162 124.4126 64.7395 31.3088 178.6387 232 T 3.7892 7.9036 110.3261 64.9663 68.4038 176.0228 233 E 3.8674 7.7918 120.3481 58.9049 29.5337 179.2424 234 A 2.6590 7.3972 120.3542 54.5698 18.5185 179.4708 235 L 3.8716 7.7651 117.5405 57.8385 41.1271 180.0268 235A V 3.4722 7.6536 117.9630 65.8663 31.2753 177.8943 236 A 3.8679 7.4409 119.3230 54.7843 18.2575 178.2961 237 Y 4.7024 7.3295 111.7675 56.7809 38.7612 175.8399 238 G 3.8841 7.5787 107.1172 46.9838 0.0000 173.7349 239 V 4.6860 7.5301 110.8458 59.3341 35.1225 175.7359 240 S 4.7962 8.7378 116.4019 56.9029 67.2716 174.6820 241 V 4.4150 8.3776 115.6733 61.5012 32.7362 176.0379 242 Y 4.4094 7.7054 119.0191 57.6247 37.6693 174.7397 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 16 I 7.87 4.42 1.90 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.41 1.00 0.00 0.00 17 S 8.98 4.43 0.00 4.10 3.75 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 18 G 8.36 3.41 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 0.00 0.00 0.00 0.00 19 G 9.01 3.79 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *29 D 8.03 4.55 0.00 2.66 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 30 A 8.48 4.59 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 I 8.38 4.90 1.96 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.98 0.52 0.00 0.00 32 Y 9.76 5.45 0.00 3.17 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 33 S 8.54 4.82 0.00 2.97 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 34 S 8.46 4.18 0.00 4.03 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 0.00 *39 T 7.41 4.30 4.23 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 1.18 0.00 0.00 40 G 7.38 4.01 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 0.00 0.00 0.00 41 R 8.69 5.02 0.00 1.54 1.72 0.00 2.96 0.00 0.00 2.73 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.31 0.00 42 C 9.06 5.14 0.00 2.88 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 43 S 8.59 5.21 0.00 3.77 3.62 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 44 L 8.67 3.30 0.00 1.26 1.39 0.33 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 45 G 9.45 4.01 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 0.00 0.00 0.00 46 F 7.98 5.12 0.00 2.96 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 N 8.91 5.40 0.00 2.69 3.05 0.00 0.00 6.73 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 48 V 9.47 5.24 2.33 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 0.91 0.00 0.00 1.14 0.00 0.00 48A R 9.03 5.13 0.00 1.24 1.57 0.00 2.21 0.00 0.00 2.92 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.34 0.00 48B S 8.76 4.58 0.00 3.90 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 48C G 8.92 3.79 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48D S 8.86 4.42 0.00 3.95 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 49 T 7.80 4.33 4.40 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 0.74 0.00 0.00 50 Y 8.23 5.11 0.00 2.89 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 51 Y 9.43 5.34 0.00 2.84 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 52 F 8.56 5.58 0.00 3.01 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 53 L 9.12 5.07 0.00 1.83 1.78 1.04 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 54 T 8.28 4.52 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 0.96 0.00 0.00 55 A 8.50 4.24 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 G 8.80 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 57 H 7.78 3.70 0.00 2.42 1.31 0.00 5.55 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 58 C 7.42 4.57 0.00 3.14 3.45 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 59 T 7.86 4.43 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 1.22 0.00 0.00 60 D 7.98 4.30 0.00 3.05 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 58 G 7.43 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 59 A 7.95 4.40 1.46 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 0.00 0.00 0.00 0.00 0.00 0.00 60 T 7.79 4.01 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 65 T 7.42 4.68 3.45 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 0.09 0.00 0.00 66 W 8.33 4.99 0.00 3.29 3.22 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 F 8.60 5.34 0.00 2.93 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *99A P 0.00 3.22 0.00 2.06 1.17 0.00 3.67 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.82 0.00 100 N 8.82 4.81 0.00 2.93 3.13 0.00 0.00 7.24 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 0.00 101 N 7.51 5.55 0.00 2.47 2.48 0.00 0.00 6.59 8.06 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 0.00 102 D 8.85 5.12 0.00 2.89 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 0.00 103 Y 8.08 5.28 0.00 3.04 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 0.00 104 G 9.18 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 I 8.63 4.98 1.24 0.00 0.00 0.14 0.00 0.00 0.00 0.00 0.00 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0.00 1.30 0.83 0.94 0.00 0.00 114 P 0.00 4.32 0.00 2.04 1.92 0.00 3.65 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.07 0.00 115 K 7.88 4.45 0.00 1.34 1.58 0.00 1.07 0.00 0.00 0.83 0.00 0.00 2.48 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 1.00 7.81 116 D 8.36 4.46 0.00 2.60 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 G 8.42 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 T 7.12 4.84 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 119 V 8.31 4.42 1.42 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 0.79 0.00 0.00 0.60 0.00 0.00 120 G 8.02 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 0.00 0.00 0.00 121 G 8.72 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 T 7.95 4.70 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 0.00 132 V 8.25 3.76 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 0.80 0.00 0.00 0.94 0.00 0.00 133 G 9.03 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 0.00 134 M 7.87 4.22 0.00 2.14 1.96 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.45 0.00 135 A 8.48 4.66 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 0.00 136 V 8.74 4.58 1.82 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 0.67 0.00 0.00 0.75 0.00 0.00 137 T 8.49 4.90 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 1.06 0.00 0.00 138 R 9.17 5.64 0.00 1.88 1.82 0.00 3.22 0.00 0.00 3.58 7.05 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167 A 8.36 4.76 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 0.00 168 T 8.32 4.65 4.19 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 0.97 0.00 0.00 169 V 8.14 3.69 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 -0.09 0.00 0.00 -0.28 0.00 0.00 170 N 8.25 4.68 0.00 2.56 2.56 0.00 0.00 7.23 7.54 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 0.00 171 Y 8.65 4.36 0.00 3.20 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 0.00 172 G 8.56 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 0.00 173 G 9.46 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 0.00 0.00 0.00 174 G 8.48 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 0.00 175 D 7.91 4.49 0.00 2.88 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 0.00 176 V 7.57 4.43 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.37 0.00 0.00 0.86 0.00 0.00 177 V 8.13 4.64 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 0.88 0.00 0.00 0.85 0.00 0.00 178 Y 8.55 4.82 0.00 2.80 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 0.00 179 G 8.82 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 M 8.13 4.70 0.00 2.17 2.16 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.67 0.00 181 I 9.02 4.58 2.18 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.83 0.97 0.00 0.00 182 R 9.11 4.70 0.00 2.03 1.81 0.00 3.17 0.00 0.00 3.24 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.99 0.00 183 T 8.30 5.10 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 1.24 0.00 0.00 184 N 8.33 4.74 0.00 2.78 3.01 0.00 0.00 7.02 8.82 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 *190 V 8.05 4.50 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 1.15 0.00 0.00 0.89 0.00 0.00 191 C 8.71 4.64 0.00 2.99 3.04 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 0.00 192 A 7.72 4.72 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 192A E 9.30 4.73 0.00 1.92 1.78 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 2.20 2.23 0.00 192B P 0.00 4.24 0.00 2.02 2.03 0.00 3.64 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 193 G 8.88 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 D 8.55 4.48 0.00 2.79 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 0.00 195 S 7.95 4.36 0.00 3.87 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 0.00 196 G 8.82 4.18 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 0.00 197 G 8.03 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 0.00 0.00 0.00 198 P 0.00 4.83 0.00 1.77 0.95 0.00 3.82 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.59 0.00 199 L 9.06 5.17 0.00 1.29 1.51 0.17 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 200 Y 9.22 5.42 0.00 3.21 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 S 9.15 4.38 0.00 3.79 3.72 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 0.00 202 G 8.69 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 *207 T 8.37 4.95 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 0.00 208 R 7.93 5.09 0.00 1.95 1.86 0.00 3.11 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.57 0.00 209 A 9.04 4.46 0.40 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 0.00 210 I 9.14 4.10 1.98 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 1.36 0.93 0.89 0.00 0.00 211 G 7.80 4.74 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 0.00 212 L 9.00 5.58 0.00 1.76 1.67 1.11 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 213 T 9.21 3.68 4.44 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 1.01 0.00 0.00 214 S 8.56 4.35 0.00 4.01 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 0.00 215 G 7.37 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 0.00 0.00 0.00 216 G 7.80 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 0.00 0.00 0.00 0.00 217 S 7.94 4.63 0.00 3.98 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 G 9.71 4.08 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 0.00 0.00 0.00 219 N 7.82 4.79 0.00 3.14 2.91 0.00 0.00 7.45 8.27 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 0.00 220 C 9.34 4.36 0.00 3.00 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 0.00 221 S 8.30 4.24 0.00 3.83 4.01 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 0.00 222 S 8.58 4.33 0.00 3.87 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 0.00 223 G 9.71 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 G 7.64 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 225 T 8.41 4.85 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 0.83 0.00 0.00 226 T 8.25 4.91 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 0.64 0.00 0.00 227 F 9.49 5.39 0.00 2.91 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 0.00 228 F 9.40 5.43 0.00 3.06 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 0.00 229 Q 9.25 4.77 0.00 2.38 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.98 0.00 0.00 0.00 0.00 0.00 2.80 2.60 0.00 230 P 0.00 4.77 0.00 2.28 2.03 0.00 3.79 0.00 0.00 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.17 0.00 231 V 8.82 3.76 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 0.75 0.00 0.00 0.89 0.00 0.00 232 T 7.90 3.79 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 1.22 0.00 0.00 233 E 7.79 3.87 0.00 2.30 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 2.33 2.34 0.00 234 A 7.40 2.66 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 L 7.77 3.87 0.00 1.76 1.81 0.81 0.64 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 235A V 7.65 3.47 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 0.94 0.00 0.00 0.91 0.00 0.00 236 A 7.44 3.87 0.88 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 0.00 237 Y 7.33 4.70 0.00 2.85 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 0.00 238 G 7.58 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 0.00 239 V 7.53 4.69 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 0.53 0.00 0.00 0.94 0.00 0.00 240 S 8.74 4.80 0.00 3.77 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 241 V 8.38 4.41 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.45 0.00 0.00 0.86 0.00 0.00 242 Y 7.71 4.41 0.00 3.10 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.