NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4022 8.3044 120.3269 54.8775 33.3216 174.6177 2 T 3.8052 8.3710 116.9011 62.0112 68.6693 170.7027 3 Y 4.4909 9.9445 130.9887 57.7042 40.7207 173.7360 4 I 4.7145 8.4943 127.6488 59.4751 40.1791 174.6093 5 V 4.2578 8.6796 128.5045 60.7861 33.1740 174.9412 6 G 4.0306 8.7369 117.2762 46.0128 0.0000 171.0789 7 L 5.1842 8.8932 128.5779 53.8529 44.5928 175.3340 8 T 4.8654 8.9981 120.1201 61.8455 71.0975 172.1317 9 G 4.6643 7.7700 112.6870 44.6318 0.0000 172.5320 10 G 3.8068 7.8041 110.5358 44.0341 0.0000 172.8201 11 I 3.6465 8.3714 119.8372 62.6978 38.0560 176.0899 12 G 4.0232 9.0570 113.4599 46.0060 0.0000 174.4083 13 S 4.2418 7.8716 115.4655 59.1133 63.7530 175.4209 14 G 4.2270 8.4066 111.0571 45.7675 0.0000 176.0106 15 K 3.9646 8.5869 121.4651 59.5758 32.0316 178.9754 16 T 3.9258 7.8484 115.3730 66.7886 68.1063 176.6839 17 T 3.8847 7.8720 117.0953 66.7985 68.5963 176.5467 18 I 3.8562 7.9381 121.2974 64.4376 37.0941 178.2479 19 A 4.2250 8.5902 122.0111 55.5458 18.1218 179.4513 20 N 4.4246 8.3839 116.1697 55.9003 38.3333 177.6754 21 L 3.9891 7.4313 118.5032 57.5864 41.9611 179.2529 22 F 4.2980 8.2299 117.6829 60.8264 38.5824 177.9015 23 T 4.2360 8.3530 110.9066 64.3185 68.2372 175.9957 24 D 4.4303 8.1430 121.1623 57.0271 40.8420 177.8241 25 L 4.4299 7.7239 117.0716 54.1913 41.7216 177.3496 26 G 3.8629 7.9753 107.0107 45.9026 0.0000 173.8828 27 V 3.8090 7.4607 119.7070 60.9733 32.5720 173.7467 28 P 4.4879 0.0000 0.0000 62.7149 32.8514 174.6125 29 L 5.2126 8.3360 122.2368 53.3290 45.1533 175.4347 30 V 4.3903 8.8329 125.9959 61.2271 34.0364 173.4244 31 D 5.2338 8.5841 127.4997 52.3818 43.0138 176.6900 32 A 4.0470 9.0249 128.8320 55.4770 18.3422 179.3441 33 D 4.3343 8.4652 117.4157 57.1088 40.7437 179.2385 34 V 3.6465 7.8533 118.5297 66.0215 31.8219 177.9583 35 V 3.5531 7.8917 117.7738 66.1303 31.1065 177.8426 36 A 4.0756 7.8872 119.1611 54.7258 18.2768 179.7233 37 R 4.0296 7.4803 115.5854 59.5792 30.4264 178.5994 38 E 3.9625 8.3457 118.5472 59.8198 29.2291 179.8227 39 V 3.7845 7.6838 116.6611 64.7365 31.5338 176.9032 40 V 4.3348 7.1496 110.3105 60.7292 32.0527 175.5403 41 A 4.1951 7.6488 122.9619 51.5935 18.7536 178.4737 42 K 3.7994 8.5684 120.0922 59.5663 31.9761 177.2812 43 D 4.7942 7.7952 125.2537 52.9025 40.4892 176.2309 44 S 4.7049 7.9226 118.0963 55.1513 67.2995 173.1106 45 P 4.3107 0.0000 0.0000 65.6190 31.1702 179.1180 46 L 4.0105 7.8698 117.5474 57.5537 41.5359 178.9445 47 L 4.0137 7.8630 120.2613 58.3821 42.1928 179.3437 48 S 4.1781 8.0125 113.4101 61.2665 62.8897 176.5342 49 K 4.1907 7.9267 122.5380 59.0893 31.6998 179.3468 50 I 4.2183 7.9791 120.3220 64.7377 37.1279 178.5288 51 V 3.6924 8.2536 119.2546 66.2658 31.0310 177.9095 52 E 3.9977 7.9619 117.0973 59.2799 29.3289 178.2137 53 H 4.0375 7.8530 117.0832 57.9875 29.9602 176.3391 54 F 4.4816 8.0612 118.2929 57.1967 40.4335 176.4102 55 G 4.1401 7.8512 105.1512 44.1104 0.0000 174.6978 56 A 4.0910 8.7170 123.3082 54.9039 18.6344 179.5352 57 Q 3.9625 7.8540 114.4392 58.5541 29.5184 177.3925 58 I 4.2139 7.5835 112.0561 59.1227 39.9230 173.3659 *65 L 4.1379 8.2254 121.0134 55.2935 42.6347 177.6192 66 N 4.5404 9.0517 125.0847 53.2694 38.6819 175.4828 67 R 3.8919 8.4037 128.1110 58.8764 30.3664 178.6898 68 A 3.9672 8.0207 120.1054 54.9392 18.3919 179.3011 69 A 3.8995 8.2838 119.3495 55.2189 18.3939 179.6419 70 L 3.6384 8.1051 119.0459 58.1986 42.1897 179.3557 71 R 3.8882 8.2960 118.4290 59.1408 29.7983 178.2927 72 E 3.9062 8.3066 118.2353 59.4960 29.8587 178.5950 73 R 4.0323 8.0542 118.4863 59.4729 29.6573 178.1892 74 V 3.6373 7.9694 118.4661 66.4746 31.2108 177.5742 75 F 3.6587 7.9562 117.9323 61.3013 39.0198 176.2744 76 N 4.5125 7.8073 115.4158 55.1513 38.8147 174.0041 77 H 4.7878 7.5685 116.5439 53.9812 33.4712 174.0765 78 D 4.3846 8.3525 122.1086 56.2062 40.4667 178.6368 79 E 3.9906 8.4370 121.3057 59.3695 29.8945 178.1013 80 D 4.5706 8.1161 118.2622 56.9248 41.0399 178.7972 81 K 4.0860 8.1141 118.8932 59.4046 32.0787 178.8853 82 L 3.9672 8.0939 119.2845 57.7505 41.6298 179.4989 83 W 4.0298 7.9974 128.2105 60.3254 30.5862 177.8317 84 L 4.0493 8.5282 120.3881 58.3007 41.5615 178.6607 85 N 4.1194 8.6744 116.8484 56.3390 38.1847 177.1667 86 N 4.1754 8.1389 117.4007 55.7768 37.2662 176.9678 87 L 3.8623 7.1744 121.2305 57.8380 42.2101 178.7154 88 L 4.3160 8.3637 118.9915 57.4882 41.7489 178.8778 89 H 4.1804 8.3344 116.3705 58.6098 28.7128 176.0959 90 P 4.2137 0.0000 0.0000 65.3497 31.1740 178.5552 91 A 3.9817 7.4675 117.9579 55.1279 18.2175 179.7448 92 I 3.6068 8.5018 118.9167 64.4630 37.2131 178.3298 93 R 3.9084 8.0899 119.6362 59.8552 29.8504 178.3434 94 E 3.9565 8.2134 118.0258 59.3660 29.4392 179.3765 95 R 3.9064 8.0726 118.8716 59.3756 30.0677 178.3282 96 M 4.0150 8.3604 118.9749 58.4610 32.0683 178.6336 97 K 3.7000 7.9911 118.3390 59.5240 32.2802 178.8418 98 Q 3.9206 8.0271 119.4743 59.4400 28.7227 178.9307 99 K 3.9831 7.7839 117.7313 59.3116 32.4873 179.1151 100 L 3.9739 7.9813 119.2126 57.7223 41.2994 179.4316 101 A 4.0525 7.8236 119.3134 54.6201 18.3898 178.9504 102 E 4.0520 7.8776 115.7028 57.4051 30.0254 177.2454 103 Q 4.3088 7.1887 118.4067 55.5627 29.5272 175.8436 104 T 4.4401 8.1979 109.2415 61.0447 69.8686 174.1445 105 A 4.2257 7.7192 124.8141 51.6141 19.3197 175.7740 106 P 4.6715 0.0000 0.0000 65.3949 31.9783 176.1552 107 Y 5.5768 7.7027 115.0452 54.5713 42.1200 174.2750 108 T 4.7343 9.1988 116.4371 61.7383 72.9946 172.6098 109 L 4.8284 8.6877 127.5187 53.7208 44.2160 174.9067 110 F 5.3467 9.3407 129.5304 56.5829 41.0572 173.2978 111 V 4.3642 8.6481 126.9108 61.5700 33.1227 174.9584 112 V 4.1753 8.4273 127.9898 60.6449 33.5170 173.7218 113 P 4.2061 0.0000 0.0000 65.0678 31.5296 177.9181 114 L 5.0110 7.2531 116.8857 52.8865 42.6574 178.3968 115 L 3.6951 7.6150 122.2431 58.3557 42.6374 179.1261 116 I 3.1943 7.4646 118.5489 64.0950 37.4436 178.1192 117 E 3.8978 8.0058 119.3979 59.0357 29.4160 177.9540 118 N 4.7132 8.1944 113.7052 52.1878 39.0501 174.9135 119 K 3.6693 7.4657 116.3660 57.9245 29.8898 175.8922 120 L 4.6151 7.7563 115.8167 54.6625 42.2491 179.4046 121 T 3.8127 7.5846 111.3437 64.3532 68.8094 176.2530 122 A 4.0795 7.9341 123.8523 54.4834 18.5111 178.0951 123 L 4.1815 7.8051 114.9329 55.9186 42.0933 176.4802 124 C 4.8211 7.3611 112.3949 56.1099 32.0898 173.6233 125 D 4.4653 8.4134 120.7421 56.9235 41.1154 176.7534 126 R 4.7900 7.4483 116.0969 55.3170 33.9199 173.5302 127 I 4.9602 9.3994 124.5184 59.4240 40.3933 174.1755 128 L 5.0200 9.1800 130.0268 53.6009 43.8850 174.9554 129 V 4.7453 8.6270 126.9282 61.2944 33.7049 174.5276 130 V 4.4981 8.4516 128.6074 62.0933 32.1760 174.3374 131 D 5.0352 8.9946 128.6018 52.8881 43.2078 175.5127 132 V 5.3448 8.3226 117.1740 59.4443 36.4239 174.5255 133 S 4.4491 9.5834 117.0480 57.3001 64.0249 173.6421 134 P 4.3953 0.0000 0.0000 65.9356 30.9412 178.7056 135 Q 4.0222 8.0808 117.8217 59.4529 28.9895 178.3524 136 T 3.8693 7.7396 116.2473 66.6398 68.5016 176.3484 137 Q 3.9909 8.1943 119.9919 59.1777 28.6795 179.2837 138 L 3.9622 8.0146 119.3380 57.7284 41.4600 179.5089 139 A 4.0226 7.9068 119.3613 55.4135 18.4575 179.6908 140 R 4.0218 8.2230 115.6514 59.3554 29.9946 179.1019 141 S 4.2283 8.3348 113.9882 59.3354 62.8388 174.0786 142 A 4.2098 6.6775 124.3770 51.0101 20.1241 176.7578 *148 N 4.7727 8.4259 116.3698 53.4607 40.9013 176.9494 149 F 4.0182 8.2544 116.0911 60.9617 38.9323 177.5488 150 E 3.9811 8.4159 117.1112 59.6458 29.3823 178.8159 151 Q 4.0198 8.2222 118.8125 59.5976 28.9910 178.7352 152 I 3.7053 8.0781 120.7702 64.3822 37.0564 178.1241 153 Q 4.0238 8.1658 120.4532 59.2448 28.6082 178.7085 154 R 3.9132 7.6660 117.7368 59.2184 30.4622 178.4929 155 I 3.8562 7.6701 119.6247 65.0544 37.0581 178.3705 156 M 4.1137 8.6653 119.3065 58.4827 31.4860 178.6392 157 N 4.4402 8.2802 116.5128 55.6161 38.7858 176.6094 158 S 4.4776 7.7500 113.2269 58.0938 63.8799 173.9944 159 Q 4.6331 6.7905 121.4893 54.0318 30.5246 175.8080 160 V 3.8126 8.3334 113.8429 61.3874 32.3247 177.2346 161 S 4.4367 8.3324 116.9061 57.8440 65.0396 174.9762 162 Q 3.9797 8.6048 122.7478 59.6488 28.6868 178.6051 163 Q 4.0092 8.0677 118.2652 59.0712 28.9469 178.5752 164 E 4.0155 8.4442 119.6540 59.3844 29.4105 179.2601 165 R 4.0221 8.1729 118.6878 59.7217 29.9315 178.5769 166 L 4.0775 8.0475 117.4613 57.7547 41.6387 179.4042 167 K 4.1610 7.8970 117.7256 58.9228 32.0419 179.1627 168 W 4.1879 8.1204 118.2582 58.2876 29.3739 176.9404 169 A 4.2863 7.2773 121.8715 52.4614 18.4846 176.8167 170 D 4.7724 8.8334 121.5406 56.0292 42.2230 176.7187 171 D 5.1135 8.6769 116.9005 52.3598 45.1584 175.3777 172 V 4.9058 8.3489 120.1177 61.2135 34.5728 174.2003 173 I 4.5620 8.6152 127.8015 59.1861 40.7213 173.3596 174 N 5.1081 8.7825 127.7327 52.1236 40.1467 173.7631 175 N 5.0188 8.7836 124.1822 53.6591 39.7482 175.1353 176 D 4.4138 8.7233 120.3271 56.6082 41.1334 177.1219 177 A 4.2800 7.6581 120.0424 51.3094 19.4805 176.7704 178 E 4.2026 8.4364 119.1090 55.9954 30.4281 178.4149 179 L 3.9357 8.7453 121.9690 58.0280 42.0498 179.4348 180 A 3.9846 8.1686 120.0870 55.2076 18.4068 178.3232 181 Q 4.2246 8.0661 112.6793 57.7509 29.5340 176.7178 182 N 4.7866 7.9208 113.7158 53.2686 39.4080 175.9896 183 L 3.9217 8.0796 122.1645 58.7956 42.1052 177.0005 184 P 4.7088 0.0000 0.0000 65.4289 31.2585 178.3334 185 H 4.2334 8.1074 114.5922 58.5896 28.6947 177.6221 186 L 4.0291 8.1847 121.2468 57.8992 41.3308 179.5802 187 Q 3.9227 8.4631 118.4358 58.9416 28.5512 178.5318 188 Q 3.9393 8.2358 120.7017 59.0295 29.0323 178.3198 189 K 3.9200 8.0360 120.7952 59.2732 32.1689 179.0318 190 V 3.4378 7.8644 118.6497 65.8767 31.3072 177.9513 191 L 3.9301 8.0553 118.9317 57.8624 41.4256 179.3937 192 E 3.9375 8.4420 118.7177 59.4142 29.3298 179.4477 193 L 3.6753 8.2894 119.4057 57.7390 41.6503 178.6900 194 H 4.5183 8.8050 120.0108 59.0106 29.7970 177.1360 195 Q 3.9699 8.3574 119.6398 58.9469 28.5448 178.7085 196 F 4.1470 8.2372 121.7205 61.5054 39.3160 176.8753 197 Y 3.9746 8.3616 116.9892 60.7238 37.4458 178.2989 198 L 4.0289 7.8479 120.1670 57.8171 41.6791 179.2612 199 Q 3.8541 7.8643 119.4066 59.2065 28.7361 178.4094 200 Q 3.5257 7.4823 118.9158 58.2455 28.3080 178.4025 201 A 3.8292 7.3974 121.2863 54.8964 18.6877 178.8584 202 E 3.9731 8.0959 117.8422 59.7627 29.5222 178.6840 203 N 4.1499 7.9235 114.8644 56.4221 38.6439 177.0935 204 K 4.1603 7.6554 118.3657 58.1420 32.1300 176.7303 205 N 4.6021 8.5515 121.8952 53.2588 39.0379 174.0907 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 1 M 8.30 4.40 0.00 1.99 2.05 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.45 0.00 2 T 8.37 3.81 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 1.20 0.00 0.00 3 Y 9.94 4.49 0.00 3.13 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 4 I 8.49 4.71 1.64 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.73 0.74 0.00 0.00 5 V 8.68 4.26 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 0.55 0.00 0.00 0.06 0.00 0.00 6 G 8.74 4.03 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 0.00 0.00 0.00 7 L 8.89 5.18 0.00 1.63 1.43 1.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 8 T 9.00 4.87 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 9 G 7.77 4.66 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 0.00 0.00 0.00 10 G 7.80 3.81 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 0.00 0.00 0.00 11 I 8.37 3.65 1.86 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 1.21 0.83 0.90 0.00 0.00 12 G 9.06 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 S 7.87 4.24 0.00 4.18 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 0.00 14 G 8.41 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 0.00 0.00 0.00 0.00 15 K 8.59 3.96 0.00 1.80 1.86 0.00 1.62 0.00 0.00 2.01 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.51 1.52 7.81 16 T 7.85 3.93 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 1.22 0.00 0.00 17 T 7.87 3.88 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 18 I 7.94 3.86 2.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.42 1.21 0.00 0.00 19 A 8.59 4.23 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 0.00 0.00 0.00 0.00 0.00 0.00 20 N 8.38 4.42 0.00 2.95 2.91 0.00 0.00 6.67 6.36 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 21 L 7.43 3.99 0.00 1.75 1.56 0.89 0.81 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 22 F 8.23 4.30 0.00 3.33 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 T 8.35 4.24 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 1.31 0.00 0.00 24 D 8.14 4.43 0.00 2.88 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 L 7.72 4.43 0.00 1.75 1.53 0.69 0.69 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 26 G 7.98 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 0.00 0.00 0.00 27 V 7.46 3.81 2.31 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 0.67 0.00 0.00 0.87 0.00 0.00 28 P 0.00 4.49 0.00 2.17 2.12 0.00 3.63 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.90 0.00 29 L 8.34 5.21 0.00 1.63 1.55 0.98 0.89 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 30 V 8.83 4.39 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.90 0.00 0.00 31 D 8.58 5.23 0.00 2.75 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 A 9.02 4.05 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 33 D 8.47 4.33 0.00 2.82 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 V 7.85 3.65 2.22 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 1.16 0.00 0.00 0.93 0.00 0.00 35 V 7.89 3.55 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.99 0.00 0.00 36 A 7.89 4.08 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 37 R 7.48 4.03 0.00 2.08 1.98 0.00 3.15 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.75 0.00 38 E 8.35 3.96 0.00 1.96 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 2.59 2.49 0.00 39 V 7.68 3.78 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 0.83 0.00 0.00 0.95 0.00 0.00 40 V 7.15 4.33 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 1.02 0.00 0.00 41 A 7.65 4.20 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 42 K 8.57 3.80 0.00 1.73 1.89 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.51 7.81 43 D 7.80 4.79 0.00 2.70 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 44 S 7.92 4.70 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 45 P 0.00 4.31 0.00 2.19 2.15 0.00 3.61 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.18 0.00 46 L 7.87 4.01 0.00 1.88 1.73 0.90 0.51 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 55 G 7.85 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 0.00 0.00 0.00 56 A 8.72 4.09 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 Q 7.85 3.96 0.00 2.08 2.21 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 2.38 2.42 0.00 58 I 7.58 4.21 1.81 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.09 0.80 0.00 0.00 *65 L 8.23 4.14 0.00 1.65 1.68 0.96 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 66 N 9.05 4.54 0.00 2.74 2.80 0.00 0.00 6.79 7.65 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 67 R 8.40 3.89 0.00 1.88 1.95 0.00 3.18 0.00 0.00 3.34 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.69 0.00 68 A 8.02 3.97 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 69 A 8.28 3.90 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 70 L 8.11 3.64 0.00 1.61 1.70 0.14 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 71 R 8.30 3.89 0.00 2.00 2.00 0.00 3.22 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.95 0.00 72 E 8.31 3.91 0.00 2.01 2.18 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 2.31 2.28 0.00 73 R 8.05 4.03 0.00 1.96 1.80 0.00 3.29 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.81 0.00 74 V 7.97 3.64 2.30 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 0.97 0.00 0.00 0.97 0.00 0.00 75 F 7.96 3.66 0.00 3.13 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 76 N 7.81 4.51 0.00 2.94 3.00 0.00 0.00 6.73 7.99 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 77 H 7.57 4.79 0.00 2.99 3.12 0.00 5.63 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 D 8.35 4.38 0.00 2.60 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 79 E 8.44 3.99 0.00 2.05 1.98 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 2.34 2.38 0.00 80 D 8.12 4.57 0.00 2.93 3.11 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 81 K 8.11 4.09 0.00 1.95 1.88 0.00 1.63 0.00 0.00 1.76 0.00 0.00 2.92 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.55 1.78 7.81 82 L 8.09 3.97 0.00 2.00 1.77 0.92 0.68 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 83 W 8.00 4.03 0.00 3.32 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 84 L 8.53 4.05 0.00 2.37 1.96 1.19 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 85 N 8.67 4.12 0.00 2.58 2.43 0.00 0.00 7.06 6.95 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 86 N 8.14 4.18 0.00 2.54 2.69 0.00 0.00 7.01 7.44 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 87 L 7.17 3.86 0.00 1.02 1.39 0.74 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 88 L 8.36 4.32 0.00 1.70 1.70 0.96 1.33 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 89 H 8.33 4.18 0.00 3.22 3.31 0.00 5.64 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 P 0.00 4.21 0.00 2.11 2.06 0.00 3.67 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.12 0.00 91 A 7.47 3.98 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 I 8.50 3.61 1.98 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 1.41 0.75 0.91 0.00 0.00 93 R 8.09 3.91 0.00 1.99 2.09 0.00 3.09 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.71 0.00 94 E 8.21 3.96 0.00 2.02 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 2.48 2.44 0.00 95 R 8.07 3.91 0.00 2.00 2.07 0.00 3.14 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.71 0.00 96 M 8.36 4.01 0.00 2.10 2.34 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.88 2.82 0.00 97 K 7.99 3.70 0.00 1.90 1.80 0.00 1.65 0.00 0.00 1.53 0.00 0.00 2.85 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.37 1.60 7.81 98 Q 8.03 3.92 0.00 2.34 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.39 0.00 99 K 7.78 3.98 0.00 1.86 1.82 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.66 7.81 100 L 7.98 3.97 0.00 1.59 1.48 -0.19 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 101 A 7.82 4.05 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 E 7.88 4.05 0.00 2.20 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.45 0.00 103 Q 7.19 4.31 0.00 2.13 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.75 0.00 0.00 0.00 0.00 0.00 2.51 2.39 0.00 104 T 8.20 4.44 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 1.24 0.00 0.00 105 A 7.72 4.23 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 0.00 106 P 0.00 4.67 0.00 2.25 2.18 0.00 3.53 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 2.19 2.14 0.00 107 Y 7.70 5.58 0.00 3.28 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 0.00 108 T 9.20 4.73 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 1.18 0.00 0.00 109 L 8.69 4.83 0.00 1.72 1.51 0.59 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 110 F 9.34 5.35 0.00 2.83 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 0.00 111 V 8.65 4.36 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 0.88 0.00 0.00 0.92 0.00 0.00 112 V 8.43 4.18 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 -0.36 0.00 0.00 113 P 0.00 4.21 0.00 2.00 2.05 0.00 3.56 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.05 0.00 114 L 7.25 5.01 0.00 1.56 1.53 0.87 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 115 L 7.61 3.70 0.00 1.61 1.44 0.69 0.87 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 0.00 116 I 7.46 3.19 1.57 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.07 0.34 0.00 0.00 117 E 8.01 3.90 0.00 1.99 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 118 N 8.19 4.71 0.00 2.72 2.73 0.00 0.00 7.06 8.35 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 0.00 119 K 7.47 3.67 0.00 1.89 1.85 0.00 1.69 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.33 1.37 7.81 120 L 7.76 4.62 0.00 1.58 1.69 0.84 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 121 T 7.58 3.81 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 0.44 0.00 0.00 122 A 7.93 4.08 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 0.00 123 L 7.81 4.18 0.00 1.87 1.57 0.92 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 124 C 7.36 4.82 0.00 3.19 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 0.00 125 D 8.41 4.47 0.00 1.63 2.34 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 0.00 126 R 7.45 4.79 0.00 1.88 1.62 0.00 3.49 0.00 0.00 3.79 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.96 0.00 127 I 9.40 4.96 1.99 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.67 0.93 0.00 0.00 128 L 9.18 5.02 0.00 1.84 1.54 1.12 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 129 V 8.63 4.75 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 0.90 0.00 0.00 0.97 0.00 0.00 130 V 8.45 4.50 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.99 0.00 0.00 131 D 8.99 5.04 0.00 2.85 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 0.00 132 V 8.32 5.34 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 0.99 0.00 0.00 0.94 0.00 0.00 133 S 9.58 4.45 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 0.00 134 P 0.00 4.40 0.00 2.19 2.17 0.00 3.62 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 2.13 2.16 0.00 135 Q 8.08 4.02 0.00 2.14 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.91 0.00 0.00 0.00 0.00 0.00 2.45 2.49 0.00 136 T 7.74 3.87 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 1.22 0.00 0.00 137 Q 8.19 3.99 0.00 2.32 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.80 0.00 0.00 0.00 0.00 0.00 2.50 2.61 0.00 138 L 8.01 3.96 0.00 1.92 1.81 1.05 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 139 A 7.91 4.02 1.38 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 0.00 0.00 0.00 0.00 0.00 0.00 140 R 8.22 4.02 0.00 1.84 2.00 0.00 3.33 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.81 0.00 141 S 8.33 4.23 0.00 3.84 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 0.00 142 A 6.68 4.21 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *148 N 8.43 4.77 0.00 2.70 2.70 0.00 0.00 6.84 8.13 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 0.00 149 F 8.25 4.02 0.00 3.12 3.16 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 0.00 150 E 8.42 3.98 0.00 2.08 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.46 0.00 151 Q 8.22 4.02 0.00 2.15 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.91 0.00 0.00 0.00 0.00 0.00 2.45 2.51 0.00 152 I 8.08 3.71 1.99 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 1.37 0.77 0.90 0.00 0.00 153 Q 8.17 4.02 0.00 2.32 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.48 0.00 154 R 7.67 3.91 0.00 1.99 1.99 0.00 3.30 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.85 0.00 155 I 7.67 3.86 2.02 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 1.53 0.97 0.90 0.00 0.00 156 M 8.67 4.11 0.00 2.02 2.24 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.59 0.00 157 N 8.28 4.44 0.00 2.83 2.89 0.00 0.00 7.01 8.20 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 0.00 158 S 7.75 4.48 0.00 4.03 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 0.00 159 Q 6.79 4.63 0.00 2.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.95 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 160 V 8.33 3.81 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 0.68 0.00 0.00 0.92 0.00 0.00 161 S 8.33 4.44 0.00 4.07 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 0.00 162 Q 8.60 3.98 0.00 2.16 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.94 0.00 0.00 0.00 0.00 0.00 2.45 2.62 0.00 163 Q 8.07 4.01 0.00 2.16 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.68 0.00 0.00 0.00 0.00 0.00 2.46 2.47 0.00 164 E 8.44 4.02 0.00 2.19 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 2.38 2.53 0.00 165 R 8.17 4.02 0.00 2.08 2.19 0.00 3.12 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.69 0.00 166 L 8.05 4.08 0.00 1.81 1.75 0.99 1.29 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 0.00 167 K 7.90 4.16 0.00 1.81 1.78 0.00 1.83 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.82 7.81 168 W 8.12 4.19 0.00 3.49 3.22 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 0.00 169 A 7.28 4.29 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 0.00 170 D 8.83 4.77 0.00 2.83 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 0.00 171 D 8.68 5.11 0.00 2.72 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 0.00 172 V 8.35 4.91 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 0.81 0.00 0.00 0.97 0.00 0.00 173 I 8.62 4.56 1.95 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.59 1.05 0.00 0.00 174 N 8.78 5.11 0.00 2.78 2.70 0.00 0.00 6.82 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 0.00 175 N 8.78 5.02 0.00 2.72 2.83 0.00 0.00 7.25 9.27 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 0.00 176 D 8.72 4.41 0.00 2.90 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 A 7.66 4.28 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 E 8.44 4.20 0.00 2.22 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.28 0.00 179 L 8.75 3.94 0.00 1.71 1.74 0.93 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 180 A 8.17 3.98 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 0.00 181 Q 8.07 4.22 0.00 2.04 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.77 0.00 0.00 0.00 0.00 0.00 2.33 2.40 0.00 182 N 7.92 4.79 0.00 2.86 2.87 0.00 0.00 6.80 6.68 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 0.00 183 L 8.08 3.92 0.00 1.88 1.70 0.91 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 184 P 0.00 4.71 0.00 2.11 2.03 0.00 4.00 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.01 0.00 185 H 8.11 4.23 0.00 3.47 3.32 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 0.00 186 L 8.18 4.03 0.00 1.90 1.72 0.94 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 187 Q 8.46 3.92 0.00 2.19 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.80 0.00 0.00 0.00 0.00 0.00 2.33 2.41 0.00 188 Q 8.24 3.94 0.00 2.13 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.82 0.00 0.00 0.00 0.00 0.00 2.36 2.49 0.00 189 K 8.04 3.92 0.00 1.93 1.94 0.00 1.57 0.00 0.00 1.55 0.00 0.00 2.98 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.51 7.81 190 V 7.86 3.44 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 -0.16 0.00 0.00 0.79 0.00 0.00 191 L 8.06 3.93 0.00 1.83 1.70 0.89 1.18 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 0.00 192 E 8.44 3.94 0.00 2.09 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.39 0.00 193 L 8.29 3.68 0.00 1.89 1.38 1.10 0.76 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 0.00 194 H 8.80 4.52 0.00 3.37 3.55 0.00 5.83 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 Q 8.36 3.97 0.00 2.27 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.58 0.00 0.00 0.00 0.00 0.00 2.40 2.52 0.00 196 F 8.24 4.15 0.00 2.93 2.93 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 0.00 197 Y 8.36 3.97 0.00 1.95 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 0.00 0.00 0.00 0.00 198 L 7.85 4.03 0.00 1.85 1.70 0.87 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 199 Q 7.86 3.85 0.00 2.10 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.82 0.00 0.00 0.00 0.00 0.00 2.30 2.31 0.00 200 Q 7.48 3.53 0.00 1.10 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 1.16 1.61 0.00 201 A 7.40 3.83 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 0.00 0.00 0.00 0.00 0.00 0.00 202 E 8.10 3.97 0.00 2.05 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.37 0.00 203 N 7.92 4.15 0.00 2.75 2.83 0.00 0.00 7.15 7.18 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 0.00 204 K 7.66 4.16 0.00 1.92 1.91 0.00 1.77 0.00 0.00 1.76 0.00 0.00 3.12 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.52 1.76 7.81 205 N 8.55 4.60 0.00 2.70 2.66 0.00 0.00 6.81 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 * Residues marked with a * may have inaccurate shift predictions.