NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.9470 8.3549 109.7375 45.1915 0.0000 173.1648 3 R 3.8943 8.4965 118.1061 55.9534 30.6673 174.4990 4 K 5.0081 8.6607 120.3440 54.8130 36.3868 174.6362 5 I 5.1518 8.6007 122.0653 59.3383 42.1360 173.9052 6 V 4.8471 8.8182 127.7363 61.1154 34.4937 173.9270 7 F 5.2548 9.2564 126.8049 55.8735 41.3236 174.7326 8 F 5.3827 9.2289 121.9009 55.8832 42.5558 174.3721 9 D 5.2713 8.5176 121.4742 52.4480 43.8011 177.1004 10 I 3.9035 8.1553 121.0089 63.7120 37.8387 176.0672 11 D 4.5632 7.8653 119.7120 55.5018 41.0251 177.8453 12 G 4.0168 8.3213 110.3801 46.3864 0.0000 173.3317 13 T 4.5345 7.0409 113.0745 64.8514 71.4631 175.6535 14 L 4.0147 7.9869 121.8234 57.0074 42.7143 177.8318 15 L 4.7592 7.7940 118.2357 53.1681 43.5924 176.7425 16 D 4.9055 8.3026 121.4925 52.5728 41.7645 176.6595 17 E 4.0335 8.7306 116.9870 59.6864 29.5817 177.6309 18 Q 4.3183 8.2288 115.2563 55.1542 28.9645 175.4989 19 K 3.9560 7.8185 116.2704 57.6521 30.2027 175.5811 20 Q 4.5363 8.5542 117.1492 54.1199 30.8163 174.7672 21 L 4.6456 8.0978 121.9935 52.8667 42.8630 174.7756 22 P 4.3737 0.0000 0.0000 62.4095 32.3048 177.3538 23 L 3.9426 8.6808 122.8066 58.1050 41.6039 180.1542 24 S 3.9734 7.9414 113.2839 61.4659 62.7673 176.5542 25 T 3.9457 7.6397 119.2740 66.4596 68.1762 176.7969 26 I 3.6728 7.6166 121.3313 64.1653 37.1197 177.9047 27 E 3.9013 8.1714 119.8933 59.2927 29.4312 178.2680 28 A 4.1955 8.4219 121.1800 55.7093 18.4584 179.5925 29 V 3.4934 8.2387 116.3842 66.1149 31.5857 178.0341 30 R 3.8511 8.0702 118.2577 59.7579 29.8279 178.5736 31 R 3.9508 8.5179 118.0134 59.2730 30.1013 178.8088 32 L 3.9092 8.1991 120.2423 58.0277 42.0268 179.3514 33 K 3.9485 8.1384 118.6353 59.3962 31.9388 179.1840 34 Q 4.1568 7.8425 115.3623 57.9913 28.6591 177.0934 35 S 4.5194 7.6372 114.2477 57.8568 62.7548 174.4409 36 G 3.9294 8.0795 108.7489 45.8750 0.0000 173.7308 37 V 4.0677 7.3759 120.5013 62.3584 32.3773 175.0845 38 Y 4.1448 9.1223 130.2853 57.5293 39.8751 174.1039 39 V 4.7881 7.7009 125.9236 61.2475 33.8521 174.1617 40 A 4.9391 8.7310 127.8528 51.0941 23.5166 174.3808 41 I 5.3125 8.7614 118.4811 59.7962 41.2770 175.4697 42 A 5.0705 9.4383 126.8590 50.8687 22.0979 175.0228 43 T 4.8585 9.1756 116.5731 61.2005 70.9185 174.7281 44 G 3.7538 8.5863 112.0835 46.8237 0.0000 174.4859 45 R 3.7127 7.5247 119.2174 55.9450 30.6627 175.6257 46 A 2.9893 7.4732 122.0288 50.1313 18.8442 175.7772 47 P 3.5610 0.0000 0.0000 65.5737 31.7661 179.9864 48 F 4.4989 7.0628 113.6964 56.3593 36.4576 175.4629 *50 F 4.7012 7.8339 110.4308 57.3661 39.7212 176.8970 51 E 3.6309 7.5628 125.1298 60.3851 29.2148 177.8577 52 H 4.1621 8.3544 114.7725 58.7258 28.4755 177.6021 53 V 3.4595 7.4450 120.3706 65.7503 31.3626 178.0401 54 R 3.9354 7.8089 117.3390 59.1053 29.6584 179.0112 55 K 3.9246 7.9855 118.4566 59.5806 32.2965 178.6243 56 Q 4.1135 8.1642 117.4942 58.6217 28.7959 178.0083 57 L 4.3424 8.0158 117.1445 53.5296 43.3515 176.2794 58 G 3.7548 8.1931 107.1132 46.7405 0.0000 174.4254 59 I 4.4410 7.5328 117.1086 59.7299 39.9357 175.6354 60 D 5.2643 8.7428 124.0890 52.9773 41.0431 175.0624 61 S 5.3098 8.0073 115.0588 57.3856 66.5895 172.9174 62 F 5.2799 9.0016 117.8993 56.3507 41.7982 172.8381 63 V 4.9018 9.5194 121.3024 61.3903 33.5128 174.7268 64 S 5.2067 9.5274 122.0722 55.9514 67.3041 173.3793 65 F 4.3413 8.9614 114.8314 58.2887 36.7124 175.7630 66 N 4.2618 9.3605 111.3046 54.5641 36.7018 175.9991 67 G 4.1342 8.3258 105.8793 45.5935 0.0000 175.4354 68 Q 4.3425 8.4280 118.2449 57.5167 29.3610 174.8666 69 Y 5.0247 7.9308 119.8589 56.4502 41.6321 173.2466 70 V 4.8212 9.0507 127.9755 60.9305 34.5394 174.2618 71 V 4.4811 8.3247 127.9021 60.8222 34.1961 173.6437 72 F 4.9669 9.1897 130.7562 56.6570 41.1990 175.3031 73 E 4.2381 8.8797 127.8446 56.4245 27.0492 176.0794 74 G 4.0051 8.4014 105.0039 45.4263 0.0000 172.2263 75 N 4.9453 7.8157 117.2100 50.9394 41.2900 174.2232 76 V 3.8483 8.1519 121.0654 62.6789 31.5657 175.4856 77 L 4.3028 8.6503 131.0788 57.7528 42.7864 176.4269 78 Y 5.0686 7.5919 118.4277 56.0469 42.5301 173.7005 79 K 4.8267 7.5658 124.1265 55.7269 35.6667 175.8961 80 Q 4.4582 9.2481 126.1949 53.4002 29.3841 172.6253 81 P 4.2532 0.0000 0.0000 61.2986 32.7399 176.3019 82 L 4.2494 8.1288 120.8072 54.7395 42.7118 177.6733 83 R 4.0601 8.7287 120.8818 56.0273 30.7775 177.4072 84 R 3.9025 8.9833 121.2707 59.7751 29.0821 177.9229 85 E 3.9518 8.3210 119.9799 58.9223 29.5160 178.9550 86 K 4.1721 8.0426 117.7067 59.3028 32.1111 179.4520 87 V 3.6370 7.9972 118.8520 65.7280 31.3172 177.9547 88 R 3.3063 7.9579 118.2468 59.2634 29.9121 178.0081 89 A 4.0948 8.0294 120.4761 55.4084 18.3335 179.3836 90 L 3.7624 7.9637 118.4062 58.7382 42.1497 178.8809 91 T 3.9205 7.9778 115.7195 66.9423 68.4390 176.0037 92 E 4.0504 8.7433 120.3552 59.8138 29.1076 179.4313 93 E 4.0806 8.7798 119.1538 59.2703 29.6949 178.7114 94 A 4.7439 8.8979 122.6207 54.8971 18.3649 178.9962 95 H 4.0865 9.0199 117.1382 59.5126 29.7810 177.2613 96 K 3.9029 8.0653 119.8361 59.2831 32.0029 177.3336 97 N 4.7456 7.7270 112.9566 52.3613 38.8482 175.6963 98 G 3.8444 8.0266 108.8041 46.2643 0.0000 172.7994 99 H 5.0621 8.2631 117.3270 53.4642 30.0186 173.7310 100 P 4.7098 0.0000 0.0000 62.4048 33.3881 174.7245 101 L 5.8808 8.5785 118.4221 52.0044 46.5869 175.8455 102 V 4.5125 8.0837 120.0967 61.4313 34.5992 175.1823 103 F 4.9699 8.8509 127.7300 56.2596 41.4302 173.4945 *105 D 4.8489 8.4116 116.4370 53.8322 40.0368 175.4225 106 A 4.0076 8.7939 119.9074 54.4887 18.5150 178.9718 107 E 4.7546 7.9232 114.0236 57.0291 32.5613 176.4550 108 K 2.4800 8.4409 120.7139 55.6929 36.4340 175.4348 *110 R 4.2325 8.4597 115.2354 55.9087 31.7322 174.4088 111 A 5.0442 8.6601 124.9056 50.8629 20.7769 178.0214 112 S 4.6296 8.8508 114.8108 59.6706 64.1448 174.6580 113 I 4.5817 7.4685 121.0709 59.6923 40.6929 175.0318 114 G 3.7473 8.6837 113.9828 45.0001 0.0000 172.2268 115 D 4.1956 7.7482 116.7564 54.8628 39.8090 173.6509 116 H 4.7287 7.7579 117.5860 54.0102 32.5384 171.8060 117 P 4.2886 0.0000 0.0000 66.5078 31.2648 178.4746 118 H 4.4438 8.2113 114.1335 58.8524 28.4853 177.8685 119 I 3.3449 7.4877 120.4376 64.4200 36.9797 177.5363 120 H 4.3073 7.9864 115.9405 59.0040 28.6750 177.5505 121 V 3.8928 7.7097 118.9698 66.0675 31.7258 179.2661 122 S 3.9108 7.8125 110.3500 59.1520 62.5391 175.5659 *124 A 4.6458 8.2734 127.0636 52.9252 20.2278 179.9524 125 S 4.5396 8.1080 109.7976 61.0425 63.1140 175.2417 126 L 4.4014 8.1315 118.4569 54.4401 41.8823 176.2929 127 K 4.0473 8.5650 117.5351 57.8009 29.6421 175.8496 128 F 4.5423 8.0905 115.1548 55.3370 42.2143 175.2642 129 A 4.3922 8.3947 126.6276 51.4178 19.2533 176.7438 130 H 4.2635 8.5897 119.6965 55.3853 30.3117 173.6200 131 P 4.4820 0.0000 0.0000 61.7553 32.0794 174.3774 132 P 4.5239 0.0000 0.0000 62.8814 32.6857 175.6450 133 V 4.4988 8.2418 122.8827 61.0847 32.6417 175.4928 134 D 4.5598 9.4092 126.3994 52.2682 42.6943 173.8007 135 P 4.5849 0.0000 0.0000 64.6244 31.8065 177.5755 136 L 4.2670 7.5812 116.7443 54.2166 42.0988 178.0188 137 Y 3.8817 7.5278 123.3081 60.5552 38.7999 177.0570 138 Y 3.9998 6.8751 116.5544 59.0817 38.5622 176.5339 139 E 3.8815 6.4853 119.9199 58.9382 29.5382 177.9473 140 N 5.0060 7.3988 113.9973 52.4896 39.7478 174.0667 141 K 4.3843 7.5233 114.6872 54.7726 36.0149 176.4743 142 D 4.3070 8.3160 120.9952 53.1641 40.3496 176.1535 143 I 4.2711 7.7448 126.5762 60.2718 37.3009 176.5819 144 Y 3.8229 8.0507 123.7061 59.5489 38.2582 175.1828 145 Q 4.5415 7.3223 117.9499 54.9915 32.3649 172.9524 146 A 4.9736 8.3853 123.0912 50.1859 23.5026 174.8732 147 L 4.8880 8.4939 118.9564 52.7532 44.8920 175.4033 148 L 4.4649 8.6626 126.8567 53.6217 43.7873 175.3693 149 F 5.3697 8.9943 126.8613 55.5773 38.1910 174.7240 150 C 4.7688 7.8394 116.5709 56.9368 32.8297 173.9786 151 R 4.4870 9.2213 118.0064 54.4779 31.0450 177.9111 152 A 4.1288 8.5633 122.4860 55.7538 18.3555 179.6741 153 E 4.1929 8.1941 110.6127 57.7461 29.1529 177.1078 154 E 4.6853 8.2175 118.4021 55.6679 31.8562 177.6954 155 E 4.1404 8.2779 117.7055 58.1485 29.3494 178.5628 156 E 3.8325 7.5248 119.6987 59.5172 29.2560 177.7457 157 P 4.1016 0.0000 0.0000 64.7370 31.4979 178.2332 158 Y 4.5100 7.3828 115.0583 61.1707 37.6829 178.4970 159 V 3.3109 7.3496 117.7166 65.9858 31.6496 177.6088 160 R 4.0245 7.8929 117.0062 59.4589 30.0938 177.5319 161 N 4.5035 8.5975 113.3262 53.4557 40.3321 175.0541 162 Y 5.4740 8.0472 117.1524 54.5983 38.5955 174.3129 163 P 4.3675 0.0000 0.0000 65.3830 32.4201 178.2838 164 E 4.1657 8.1387 115.6765 57.4456 29.8916 175.7243 165 F 5.8238 8.0616 118.0743 56.0343 42.3642 174.8635 166 R 4.9648 8.9725 118.6897 54.5480 33.9840 174.6533 167 F 5.2139 9.1511 120.4476 55.7162 41.8937 174.9399 168 V 4.3601 8.6358 123.2886 60.7788 33.8753 174.4271 169 R 4.4476 8.7698 129.3401 55.9540 30.4766 176.0058 170 W 4.9370 8.0605 120.8250 56.0127 29.6132 174.2876 171 H 4.3814 7.1743 116.7513 55.2125 31.7081 173.6528 172 D 4.3155 8.1800 123.9182 57.1909 40.8978 179.1701 173 V 4.3095 7.6477 110.5425 60.3261 32.4243 174.5085 174 S 4.5692 7.3337 112.7747 57.2925 66.0364 172.9278 175 T 4.8256 8.5021 120.4073 60.3163 71.2858 172.4144 176 D 4.9044 9.2991 128.0080 54.1858 42.4652 175.5432 177 V 3.9451 8.6487 123.7173 61.2663 33.1383 174.4420 178 L 4.8892 8.3941 128.4561 51.8579 45.1974 174.3766 179 P 4.8317 0.0000 0.0000 62.9172 31.9046 176.3617 180 A 4.1707 8.7696 124.7234 55.2901 18.4796 178.8842 181 G 3.6886 8.0400 102.7240 46.0633 0.0000 173.6004 182 G 4.1323 9.4580 108.0456 45.3904 0.0000 173.7237 183 S 4.6449 8.0100 113.2479 56.1593 66.4605 176.7890 184 K 3.9121 8.7673 122.2483 59.4945 31.7358 179.4422 185 A 3.3430 8.4153 121.4979 54.9496 18.0028 179.2730 186 E 3.6810 7.6534 116.2504 58.5540 29.6865 178.9869 187 G 3.6159 7.3074 105.0148 47.7178 0.0000 175.5901 188 I 3.4650 7.8372 122.1812 63.0711 38.5107 178.1370 189 R 4.2201 7.5334 121.0056 56.4362 25.9786 176.3807 *192 I 4.1206 7.5933 115.5104 60.2630 39.8891 178.6496 193 E 3.9162 7.9442 121.8993 58.7530 29.6256 178.5714 194 K 3.8659 7.7397 118.6197 58.3975 32.3934 176.9505 195 L 3.9698 7.4920 118.3762 54.6429 42.4101 176.9610 196 G 3.8500 7.4572 104.5071 46.4617 0.0000 173.6613 197 I 4.2147 7.7997 120.0921 60.0295 38.5134 174.6641 198 D 4.9333 8.0026 121.1340 52.2705 43.5811 177.0320 199 K 4.1572 8.2388 127.7915 59.4472 32.3501 178.6464 200 K 3.7894 8.0755 116.1843 59.4255 32.7372 176.9530 201 D 4.6941 8.8771 119.4282 54.1880 41.2753 175.3343 202 V 4.9835 7.7120 120.8485 61.6223 33.6290 174.2899 203 Y 5.3005 9.2389 123.9907 56.5236 42.0521 174.3771 204 A 5.3763 8.7171 121.4705 50.9947 23.3430 175.1991 205 F 5.3051 9.5601 120.3949 55.8132 42.0545 175.0450 206 G 4.3436 8.9122 109.5654 45.3101 0.0000 171.6148 207 D 4.7800 10.1305 115.7050 53.6999 44.0705 175.2261 208 G 4.4086 8.0650 106.6882 43.0868 0.0000 173.7402 209 L 3.6485 8.5568 119.2013 58.1257 41.2437 179.3030 210 N 4.4938 8.1329 114.4504 55.5696 39.0417 175.3046 211 D 4.6941 8.5626 119.2151 55.0767 41.6035 177.8917 212 I 3.9009 7.5452 121.5378 64.2963 37.0724 177.7402 213 E 3.9750 8.0569 115.2707 57.8394 29.6276 178.4713 *215 L 4.2918 7.8106 120.0302 55.2555 43.7009 178.2411 216 S 4.2432 8.3876 112.9654 61.0474 62.5563 175.0655 217 F 4.2169 8.0032 121.3375 60.8684 39.3340 176.2179 218 V 3.7353 7.6602 112.1384 60.6585 32.1095 176.1417 219 G 3.5647 8.3870 109.2714 49.2606 0.0000 173.5392 220 T 4.5296 7.9045 117.3990 61.5385 71.8859 173.1141 221 G 4.1827 9.5807 115.3286 44.7643 0.0000 170.9295 222 V 4.7718 8.9974 126.7650 61.1393 33.2769 173.6773 223 A 4.2419 8.7429 135.0000 52.1037 20.8643 176.9115 *225 G 3.9472 8.9426 100.4281 44.7869 0.0000 172.2435 226 N 4.8547 7.8222 116.5738 51.9260 39.7253 175.5038 227 A 4.4475 7.8021 119.8844 51.2794 19.3490 177.7638 228 H 4.2240 8.0822 119.3557 56.2232 30.6628 176.3405 229 E 3.9216 8.5283 124.3533 59.7015 29.4077 178.8472 230 E 4.2549 8.3120 115.4547 57.7031 29.8342 177.6689 231 V 3.9670 8.1134 119.7892 64.9323 32.4362 178.2269 232 K 4.1695 8.0365 118.9612 59.3447 32.3394 178.8062 233 R 3.8599 7.9573 118.3984 59.6605 29.7976 177.8214 234 V 3.8427 7.1242 107.4971 62.0763 31.8714 176.4164 235 A 4.3490 7.6503 123.3907 51.9213 19.0687 177.2648 236 D 4.7280 8.8030 119.8123 55.4153 41.8134 176.7027 237 F 4.6231 7.7167 118.9997 57.0272 42.9632 172.5383 238 V 4.5037 7.3300 125.3246 61.6134 33.1073 174.7918 239 T 4.7677 8.1635 123.6268 60.5235 69.4371 173.7975 240 K 4.2966 8.5120 121.6178 54.9834 33.2161 174.9041 241 P 4.5177 0.0000 0.0000 62.1013 31.8220 178.2625 242 V 3.8847 8.3872 119.7834 64.9084 31.1890 177.2077 243 D 4.4837 8.1060 118.4458 55.8946 40.1742 175.8413 244 K 4.6123 8.1249 119.4333 56.2787 32.8409 176.1519 245 E 4.0331 8.4475 112.3870 57.3826 27.7043 177.5053 246 G 4.1296 7.6363 107.6318 47.5460 0.0000 176.0496 247 I 3.7880 7.8517 121.8155 63.7208 37.1777 178.0072 248 W 4.0894 8.2920 128.6408 60.7004 30.5724 176.8552 249 Y 4.2286 9.0418 119.9269 60.8723 38.2555 178.6562 250 G 3.8429 8.6420 106.3359 48.0571 0.0000 175.7203 251 L 4.0206 8.1941 121.8038 57.0463 41.4034 179.5565 252 K 3.5245 7.6510 119.7765 59.4949 31.9616 178.6929 253 Q 3.4611 7.5386 117.5472 58.9411 28.6893 178.5881 254 L 4.0810 7.3855 116.5168 54.1263 41.6914 176.8397 255 Q 3.4762 8.2884 117.6619 56.8626 26.8410 174.8563 256 L 4.0868 7.7619 120.3305 56.1296 42.1504 177.2485 257 I 4.0081 7.1799 115.6997 60.7880 37.6281 174.9645 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 G 8.35 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 3 R 8.50 3.89 0.00 1.89 1.90 0.00 3.36 0.00 0.00 3.27 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 4 K 8.66 5.01 0.00 1.70 1.76 0.00 1.68 0.00 0.00 1.85 0.00 0.00 2.79 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.60 1.46 7.81 5 I 8.60 5.15 1.92 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 1.90 1.03 0.00 0.00 6 V 8.82 4.85 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 0.23 0.00 0.00 0.77 0.00 0.00 7 F 9.26 5.25 0.00 3.02 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 F 9.23 5.38 0.00 2.97 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 D 8.52 5.27 0.00 2.75 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 10 I 8.16 3.90 1.71 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.45 0.86 0.00 0.00 11 D 7.87 4.56 0.00 2.68 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 12 G 8.32 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 13 T 7.04 4.53 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 1.52 0.00 0.00 14 L 7.99 4.01 0.00 1.66 1.59 0.85 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 15 L 7.79 4.76 0.00 1.70 1.56 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 16 D 8.30 4.91 0.00 2.87 2.84 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 17 E 8.73 4.03 0.00 1.97 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.41 0.00 18 Q 8.23 4.32 0.00 2.14 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.81 0.00 0.00 0.00 0.00 0.00 2.32 2.43 0.00 19 K 7.82 3.96 0.00 1.95 1.95 0.00 1.72 0.00 0.00 1.75 0.00 0.00 3.04 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.42 7.81 20 Q 8.55 4.54 0.00 2.31 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.84 0.00 0.00 0.00 0.00 0.00 2.29 2.40 0.00 21 L 8.10 4.65 0.00 1.54 1.54 0.83 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 22 P 0.00 4.37 0.00 2.18 1.93 0.00 3.67 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.09 0.00 23 L 8.68 3.94 0.00 1.66 1.62 0.88 0.80 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 24 S 7.94 3.97 0.00 3.90 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 T 7.64 3.95 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 0.96 0.00 0.00 26 I 7.62 3.67 1.98 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 1.47 0.75 0.88 0.00 0.00 27 E 8.17 3.90 0.00 2.10 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 2.21 2.22 0.00 28 A 8.42 4.20 1.48 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 29 V 8.24 3.49 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 0.95 0.00 0.00 0.79 0.00 0.00 30 R 8.07 3.85 0.00 2.00 2.15 0.00 3.17 0.00 0.00 3.42 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 31 R 8.52 3.95 0.00 1.96 1.96 0.00 3.42 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.02 0.00 32 L 8.20 3.91 0.00 2.01 1.74 0.81 0.82 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 33 K 8.14 3.95 0.00 1.99 1.80 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.38 1.52 7.81 34 Q 7.84 4.16 0.00 2.24 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.86 0.00 0.00 0.00 0.00 0.00 2.56 2.36 0.00 35 S 7.64 4.52 0.00 3.88 4.05 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 0.00 0.00 0.00 36 G 8.08 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 V 7.38 4.07 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.86 0.00 0.00 38 Y 9.12 4.14 0.00 3.11 2.79 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 39 V 7.70 4.79 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 0.99 0.00 0.00 0.93 0.00 0.00 40 A 8.73 4.94 1.16 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 0.00 0.00 41 I 8.76 5.31 2.11 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 1.30 1.19 0.68 0.00 0.00 42 A 9.44 5.07 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 T 9.18 4.86 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 0.52 0.00 0.00 44 G 8.59 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 0.00 0.00 0.00 45 R 7.52 3.71 0.00 1.59 1.77 0.00 2.96 0.00 0.00 3.11 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.39 0.00 46 A 7.47 2.99 0.36 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 47 P 0.00 3.56 0.00 2.40 2.13 0.00 3.27 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.31 0.00 48 F 7.06 4.50 0.00 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0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 58 G 8.19 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 0.00 0.00 0.00 59 I 7.53 4.44 1.94 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.72 1.06 0.00 0.00 60 D 8.74 5.26 0.00 2.72 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 61 S 8.01 5.31 0.00 3.93 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 62 F 9.00 5.28 0.00 3.30 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 V 9.52 4.90 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 1.07 0.00 0.00 0.96 0.00 0.00 64 S 9.53 5.21 0.00 4.08 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 65 F 8.96 4.34 0.00 3.30 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 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3.26 3.25 0.00 5.65 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 P 0.00 4.71 0.00 1.88 2.01 0.00 3.86 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.37 0.00 101 L 8.58 5.88 0.00 1.21 0.96 0.87 0.35 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 0.00 102 V 8.08 4.51 2.28 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 1.10 0.00 0.00 0.98 0.00 0.00 103 F 8.85 4.97 0.00 3.10 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 *105 D 8.41 4.85 0.00 3.11 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 0.00 106 A 8.79 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 E 7.92 4.75 0.00 1.94 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 2.29 2.28 0.00 108 K 8.44 2.48 0.00 1.38 1.17 0.00 1.51 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 1.97 2.13 0.00 118 H 8.21 4.44 0.00 3.30 3.51 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 0.00 119 I 7.49 3.34 1.52 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 0.28 0.00 0.00 120 H 7.99 4.31 0.00 3.32 3.40 0.00 5.86 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 V 7.71 3.89 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 0.93 0.00 0.00 1.01 0.00 0.00 122 S 7.81 3.91 0.00 3.48 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *124 A 8.27 4.65 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 0.00 125 S 8.11 4.54 0.00 4.19 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 0.00 126 L 8.13 4.40 0.00 1.83 1.99 0.84 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 127 K 8.56 4.05 0.00 1.89 1.93 0.00 1.67 0.00 0.00 1.90 0.00 0.00 3.05 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.57 7.81 128 F 8.09 4.54 0.00 3.17 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 0.00 129 A 8.39 4.39 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 H 8.59 4.26 0.00 3.01 3.17 0.00 5.76 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 P 0.00 4.48 0.00 2.05 1.96 0.00 3.56 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.15 0.00 132 P 0.00 4.52 0.00 2.03 1.96 0.00 3.54 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.09 0.00 133 V 8.24 4.50 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 0.68 0.00 0.00 0.99 0.00 0.00 134 D 9.41 4.56 0.00 2.74 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 0.00 135 P 0.00 4.58 0.00 2.16 2.23 0.00 3.75 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 2.09 2.39 0.00 136 L 7.58 4.27 0.00 1.56 1.40 0.86 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 137 Y 7.53 3.88 0.00 3.02 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 Y 6.88 4.00 0.00 2.88 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 E 6.49 3.88 0.00 1.66 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.47 0.00 140 N 7.40 5.01 0.00 2.44 2.63 0.00 0.00 6.65 7.61 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 0.00 141 K 7.52 4.38 0.00 1.33 1.38 0.00 1.54 0.00 0.00 1.48 0.00 0.00 2.64 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.71 0.21 7.81 142 D 8.32 4.31 0.00 2.57 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 0.00 0.00 0.00 143 I 7.74 4.27 1.82 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 1.40 1.04 1.08 0.00 0.00 144 Y 8.05 3.82 0.00 1.43 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 Q 7.32 4.54 0.00 1.94 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.81 0.00 0.00 0.00 0.00 0.00 2.19 2.44 0.00 146 A 8.39 4.97 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 L 8.49 4.89 0.00 1.61 1.06 1.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 148 L 8.66 4.46 0.00 1.55 1.40 0.43 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 149 F 8.99 5.37 0.00 2.88 3.02 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 0.00 0.00 0.00 150 C 7.84 4.77 0.00 2.82 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 R 9.22 4.49 0.00 2.02 2.10 0.00 3.16 0.00 0.00 3.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.53 0.00 152 A 8.56 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 153 E 8.19 4.19 0.00 1.95 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.39 0.00 154 E 8.22 4.69 0.00 2.16 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 2.26 2.23 0.00 155 E 8.28 4.14 0.00 2.08 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.27 0.00 156 E 7.52 3.83 0.00 2.03 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.45 0.00 157 P 0.00 4.10 0.00 1.68 1.94 0.00 3.54 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.04 0.00 158 Y 7.38 4.51 0.00 2.89 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 V 7.35 3.31 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 0.45 0.00 0.00 160 R 7.89 4.02 0.00 2.05 1.89 0.00 3.26 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 161 N 8.60 4.50 0.00 2.57 2.32 0.00 0.00 6.86 5.96 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 0.00 162 Y 8.05 5.47 0.00 3.59 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 P 0.00 4.37 0.00 2.19 2.20 0.00 3.74 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.91 0.00 164 E 8.14 4.17 0.00 2.08 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 0.00 1.62 1.84 0.00 165 F 8.06 5.82 0.00 3.16 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 0.00 166 R 8.97 4.96 0.00 1.64 1.82 0.00 3.32 0.00 0.00 3.31 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.77 0.00 167 F 9.15 5.21 0.00 2.88 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 0.00 168 V 8.64 4.36 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.97 0.00 0.00 169 R 8.77 4.45 0.00 1.87 1.83 0.00 3.18 0.00 0.00 3.26 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.75 0.00 170 W 8.06 4.94 0.00 3.49 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 0.00 171 H 7.17 4.38 0.00 2.09 1.81 0.00 5.70 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 D 8.18 4.32 0.00 2.61 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 0.00 173 V 7.65 4.31 1.80 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 0.58 0.00 0.00 0.92 0.00 0.00 174 S 7.33 4.57 0.00 3.28 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 0.00 175 T 8.50 4.83 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 1.31 0.00 0.00 176 D 9.30 4.90 0.00 2.78 2.51 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 0.00 177 V 8.65 3.95 1.75 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 0.05 0.00 0.00 0.65 0.00 0.00 178 L 8.39 4.89 0.00 1.49 1.47 0.90 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 179 P 0.00 4.83 0.00 2.15 2.08 0.00 3.73 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.01 0.00 180 A 8.77 4.17 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 0.00 181 G 8.04 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 G 9.46 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 S 8.01 4.64 0.00 4.41 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 0.00 184 K 8.77 3.91 0.00 1.85 1.79 0.00 1.64 0.00 0.00 1.79 0.00 0.00 3.04 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.50 1.49 7.81 185 A 8.42 3.34 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 E 7.65 3.68 0.00 1.81 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 2.17 2.13 0.00 187 G 7.31 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 0.00 0.00 0.00 188 I 7.84 3.47 1.61 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.21 0.24 0.67 0.00 0.00 189 R 7.53 4.22 0.00 1.59 1.78 0.00 3.10 0.00 0.00 3.24 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.72 0.00 *192 I 7.59 4.12 2.08 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.06 1.16 0.00 0.00 193 E 7.94 3.92 0.00 1.97 1.90 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 2.24 2.20 0.00 194 K 7.74 3.87 0.00 1.47 1.39 0.00 1.51 0.00 0.00 1.43 0.00 0.00 2.93 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.37 0.65 7.81 195 L 7.49 3.97 0.00 1.36 1.50 0.70 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 196 G 7.46 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 I 7.80 4.21 1.87 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 1.27 0.55 0.99 0.00 0.00 198 D 8.00 4.93 0.00 2.62 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 0.00 0.00 0.00 0.00 199 K 8.24 4.16 0.00 1.68 1.59 0.00 1.49 0.00 0.00 1.38 0.00 0.00 2.13 0.00 0.00 2.54 0.00 0.00 0.00 0.00 0.77 0.97 7.81 200 K 8.08 3.79 0.00 1.81 1.85 0.00 1.57 0.00 0.00 1.65 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.53 1.43 7.81 201 D 8.88 4.69 0.00 2.89 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 0.00 202 V 7.71 4.98 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 1.33 0.00 0.00 1.10 0.00 0.00 203 Y 9.24 5.30 0.00 2.87 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 A 8.72 5.38 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 205 F 9.56 5.31 0.00 3.19 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 206 G 8.91 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 0.00 0.00 0.00 0.00 207 D 10.13 4.78 0.00 2.72 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 208 G 8.06 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 0.00 0.00 0.00 0.00 209 L 8.56 3.65 0.00 1.72 1.75 0.75 0.39 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 0.00 210 N 8.13 4.49 0.00 2.71 2.84 0.00 0.00 6.93 8.47 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 0.00 211 D 8.56 4.69 0.00 2.76 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 0.00 212 I 7.55 3.90 1.94 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.80 0.92 0.00 0.00 213 E 8.06 3.98 0.00 2.13 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 2.36 2.35 0.00 *215 L 7.81 4.29 0.00 1.79 1.82 1.05 0.91 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 0.00 216 S 8.39 4.24 0.00 3.88 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 F 8.00 4.22 0.00 3.00 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 0.00 218 V 7.66 3.74 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 1.02 0.00 0.00 219 G 8.39 3.56 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 0.00 0.00 0.00 220 T 7.90 4.53 3.54 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 1.18 0.00 0.00 221 G 9.58 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 0.00 222 V 9.00 4.77 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 0.00 0.00 0.83 0.00 0.00 0.41 0.00 0.00 223 A 8.74 4.24 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 *225 G 8.94 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 0.00 226 N 7.82 4.85 0.00 2.72 2.83 0.00 0.00 6.83 7.35 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 0.00 227 A 7.80 4.45 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 228 H 8.08 4.22 0.00 3.21 3.21 0.00 5.80 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 E 8.53 3.92 0.00 1.94 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.24 0.00 230 E 8.31 4.25 0.00 2.05 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 2.43 2.28 0.00 231 V 8.11 3.97 2.28 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 1.00 0.00 0.00 1.01 0.00 0.00 232 K 8.04 4.17 0.00 1.97 1.81 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.51 1.62 7.81 233 R 7.96 3.86 0.00 1.92 1.98 0.00 3.26 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 1.65 1.62 0.00 234 V 7.12 3.84 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 0.71 0.00 0.00 1.02 0.00 0.00 235 A 7.65 4.35 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 0.00 236 D 8.80 4.73 0.00 2.62 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 0.00 237 F 7.72 4.62 0.00 3.04 2.79 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 0.00 238 V 7.33 4.50 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 0.75 0.00 0.00 0.83 0.00 0.00 239 T 8.16 4.77 4.79 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 1.58 0.00 0.00 240 K 8.51 4.30 0.00 1.85 1.67 0.00 1.69 0.00 0.00 1.62 0.00 0.00 2.31 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.20 0.84 7.81 241 P 0.00 4.52 0.00 2.19 1.98 0.00 3.60 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.07 0.00 242 V 8.39 3.88 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 1.01 0.00 0.00 243 D 8.11 4.48 0.00 2.82 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 244 K 8.12 4.61 0.00 1.75 1.70 0.00 1.84 0.00 0.00 1.62 0.00 0.00 2.87 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.33 1.36 7.81 245 E 8.45 4.03 0.00 2.34 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 2.27 2.30 0.00 246 G 7.64 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 247 I 7.85 3.79 1.83 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 1.52 0.60 0.59 0.00 0.00 248 W 8.29 4.09 0.00 3.63 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 0.00 249 Y 9.04 4.23 0.00 3.24 3.23 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 0.00 250 G 8.64 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 0.00 251 L 8.19 4.02 0.00 1.67 1.52 0.90 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 252 K 7.65 3.52 0.00 1.48 1.45 0.00 1.38 0.00 0.00 1.60 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.18 0.96 7.81 253 Q 7.54 3.46 0.00 1.61 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.85 0.00 0.00 0.00 0.00 0.00 1.60 2.04 0.00 254 L 7.39 4.08 0.00 1.50 1.61 0.91 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 255 Q 8.29 3.48 0.00 2.03 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.79 6.98 0.00 0.00 0.00 0.00 0.00 2.30 2.23 0.00 256 L 7.76 4.09 0.00 1.54 1.47 0.01 0.19 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 0.00 257 I 7.18 4.01 1.60 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.06 0.72 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.