NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 15 I 3.9851 8.0249 120.7751 60.8830 40.3912 176.2501 16 D 4.5469 7.8585 121.2583 53.4791 39.1273 174.0941 *20 T 4.4738 8.0142 119.8327 62.2029 70.4097 175.0628 21 A 4.2687 8.0843 123.2176 54.8874 18.9259 179.3501 22 E 4.1864 8.1448 116.8363 60.8105 29.8297 183.7099 23 F 4.5918 8.1745 119.8142 61.0364 39.6715 175.9362 24 D 4.3750 7.7941 115.5201 54.2826 41.0525 176.5916 25 A 4.5793 7.2036 121.0847 51.3877 19.8844 177.1295 26 L 4.0583 7.5438 117.7006 54.2552 42.0936 176.5491 27 P 4.2533 0.0000 0.0000 64.5347 31.5805 176.3501 28 V 4.6182 6.9289 111.5093 59.1128 35.0222 175.8217 29 G 4.1817 9.5626 110.4190 45.7887 0.0000 172.6608 30 A 5.4197 9.5364 124.8104 50.2082 22.6570 175.0150 31 I 5.0545 8.9519 123.3504 59.5673 41.0844 174.3010 32 Q 4.3824 8.9214 128.2119 54.2370 30.9962 174.7289 33 V 5.0592 8.5860 118.9570 59.8183 36.7255 174.3626 34 D 5.6921 8.0204 121.7922 51.2470 41.8658 177.4075 35 G 3.8624 9.0419 106.8350 48.4484 0.0000 174.6069 36 S 4.5809 8.3516 112.2417 58.1895 63.7263 175.0277 37 G 4.1389 8.5477 110.8133 45.2156 0.0000 173.6210 38 V 4.1245 7.9033 120.6506 62.4910 32.3531 174.7821 39 I 4.2725 8.7108 129.1560 62.0179 37.3747 176.0485 40 H 4.6221 9.4378 124.2255 56.5345 30.9214 175.3044 41 R 4.8819 7.7217 115.3237 54.6428 34.4805 174.5684 42 Y 4.9158 8.7549 123.9734 56.5291 41.0678 174.1152 43 N 4.5227 8.6228 127.5063 52.6949 38.9194 177.2835 44 R 3.9952 8.4478 120.3153 61.6052 29.2047 178.3342 45 T 4.0344 7.6453 114.9277 66.7279 68.5905 176.2236 46 E 3.9399 8.0184 120.8595 59.0953 29.6866 178.5721 47 S 4.4549 7.8620 115.9015 62.0522 62.2187 177.0231 48 R 4.0974 8.0173 122.7357 61.0721 29.2392 180.8040 49 L 4.5581 7.6946 117.6913 56.6066 41.8526 178.4219 50 S 4.0927 8.2550 113.1000 57.7090 64.2952 175.4242 51 G 3.8555 8.6256 109.1562 44.7971 0.0000 173.1910 52 R 4.2579 7.4684 118.8268 55.0102 31.4106 176.1406 53 I 4.1497 7.9884 122.9171 59.9813 38.4148 175.2210 54 P 4.1981 0.0000 0.0000 65.8506 30.9144 178.6481 55 E 4.0493 8.1156 116.3497 58.6098 29.5584 178.4556 56 R 4.2016 7.3207 113.8287 57.5189 30.2626 178.2343 57 V 3.7017 7.3445 118.7474 63.9027 31.6513 175.7263 58 I 3.9120 6.9281 119.8719 62.1683 37.2666 176.0201 59 G 3.9791 8.7171 114.0329 45.2501 0.0000 173.8076 60 R 4.4446 7.4692 118.3647 54.3493 32.0191 174.9642 61 N 4.9096 9.2664 119.6530 53.0277 39.8355 175.7834 62 F 3.8931 9.3558 128.9704 61.3046 39.4825 177.1941 63 F 4.1267 8.0113 118.9260 59.9603 39.1755 177.5947 64 T 4.2113 8.2612 109.4688 62.8485 69.3711 174.6342 65 E 4.4049 7.8620 118.0056 57.9321 31.7249 177.4267 66 V 3.5266 7.9343 117.2599 65.1869 32.3137 176.4044 67 A 4.3992 7.7293 121.8001 49.0819 18.4443 174.4894 68 P 4.4896 0.0000 0.0000 64.2785 31.9141 179.3849 69 C 4.3043 7.9845 112.7492 60.4382 29.8675 174.2197 70 T 4.2606 7.7138 110.1839 62.3485 68.9447 174.8762 71 N 4.7488 8.2620 121.6569 53.5919 39.0231 174.0059 72 I 4.6688 7.5000 109.1567 57.8100 40.8256 174.4787 73 P 4.3009 0.0000 0.0000 65.3538 30.7587 178.7260 74 A 4.0265 8.0946 118.4437 54.2461 18.6979 176.7286 75 F 4.5974 8.0676 116.1500 59.8515 41.5963 177.1562 76 S 3.8635 8.7188 113.8575 61.0908 63.0377 176.8511 77 G 3.5472 8.0052 109.0672 47.7528 0.0000 175.9778 78 R 3.9177 7.6155 119.2304 58.6761 29.9908 179.0509 79 F 4.0655 8.0721 120.3678 61.4998 39.4678 176.8214 80 M 3.7499 8.2177 118.1483 58.8315 31.8351 177.9551 81 D 4.3995 8.1785 119.0787 57.1129 40.7068 179.0151 82 G 3.4561 7.5110 105.2490 46.5145 0.0000 175.8332 83 V 3.4077 7.1126 120.4809 66.0552 31.3489 178.4084 84 T 3.9666 7.5673 113.9249 65.4356 68.3777 175.7262 85 S 4.5956 7.8336 114.9497 57.7114 63.4421 175.5092 86 G 3.9832 8.1110 111.6523 45.4819 0.0000 173.7296 87 T 4.4598 7.5265 116.3675 61.5981 70.3335 172.3956 88 L 4.4206 9.3502 130.2047 53.6096 43.8617 175.1728 89 D 4.7973 8.5985 125.9365 53.9094 42.7775 173.7724 90 A 4.9298 9.1768 127.3374 50.3857 23.3489 174.7306 91 R 5.1215 8.6159 120.1802 54.9626 33.0874 174.0555 92 F 5.0068 8.4450 119.8965 56.0218 41.6137 172.9539 93 D 5.1129 8.8167 119.9238 54.1627 42.0262 175.4264 94 F 4.9214 9.2201 123.5895 57.0318 43.8497 173.1202 95 V 4.5793 6.8237 120.7115 59.8043 33.9487 174.8253 96 F 4.8213 8.8023 125.1790 56.7438 39.9672 174.9861 97 D 4.9238 8.6917 125.5822 53.2774 39.5678 175.6912 98 F 5.0883 7.9384 122.4214 55.9308 40.9175 175.8454 99 Q 4.1514 8.7330 119.8873 59.6163 27.8874 177.6473 100 M 4.2481 7.4925 116.7652 56.3060 32.7511 175.7087 101 A 4.7439 7.4073 122.4411 49.8591 22.9615 173.8345 102 P 4.5069 0.0000 0.0000 62.5840 32.1486 176.2473 103 V 4.2130 8.2204 125.5165 61.0086 33.1255 174.6207 104 R 4.4643 8.5139 129.4773 56.3138 30.7093 175.7692 105 V 4.7782 9.2018 118.7539 59.7897 36.8940 174.0952 106 Q 4.8434 8.6568 120.6845 54.2542 31.4714 174.9134 107 I 4.8010 8.3511 124.5839 59.3237 40.4285 174.6850 108 R 4.9038 8.7267 125.6055 54.9857 33.1173 173.6009 109 M 5.4261 9.1445 126.9169 53.8453 35.0904 175.0934 110 Q 5.7958 8.7473 119.2121 56.2823 32.6286 173.2613 111 N 5.0949 9.0503 117.1301 53.4351 39.6753 174.0764 112 A 4.9877 7.9045 122.5937 50.1127 21.4858 177.2764 113 G 3.6421 9.4306 107.8534 47.6151 0.0000 174.5108 114 V 4.1139 7.4469 120.0856 60.5459 32.7590 173.5313 115 P 4.1378 0.0000 0.0000 63.7127 31.9258 176.2802 116 D 4.4386 8.5349 118.4087 54.5254 40.2759 172.9092 117 R 4.8715 6.8498 115.9384 55.3406 32.6523 174.8194 118 Y 4.8648 8.8370 119.6595 56.1075 42.9106 174.1896 119 W 5.1407 9.5474 121.5803 55.0278 32.6733 175.1327 120 I 4.8209 8.5081 123.3542 59.7423 40.1751 174.2406 121 F 5.4912 9.2240 126.8538 55.7824 41.5618 175.1780 122 V 5.0151 9.0974 123.5447 61.0188 34.3375 174.2685 123 R 4.8940 8.8371 124.4255 55.1586 32.5051 175.9592 124 K 4.2217 8.8315 120.5540 57.1823 32.8545 175.9892 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 15 I 8.02 3.99 1.63 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 1.18 0.45 0.00 0.00 16 D 7.86 4.55 0.00 2.86 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 *20 T 8.01 4.47 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 21 A 8.08 4.27 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 22 E 8.14 4.19 0.00 1.99 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 2.30 1.93 0.00 23 F 8.17 4.59 0.00 2.95 3.40 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 24 D 7.79 4.37 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 25 A 7.20 4.58 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 26 L 7.54 4.06 0.00 1.62 1.61 0.96 0.94 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 27 P 0.00 4.25 0.00 2.13 2.14 0.00 3.63 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.93 0.00 28 V 6.93 4.62 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 0.63 0.00 0.00 0.84 0.00 0.00 29 G 9.56 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 30 A 9.54 5.42 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 31 I 8.95 5.05 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 0.94 0.59 0.79 0.00 0.00 32 Q 8.92 4.38 0.00 0.93 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.62 0.00 0.00 0.00 0.00 0.00 1.71 1.16 0.00 33 V 8.59 5.06 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 0.47 0.00 0.00 1.00 0.00 0.00 34 D 8.02 5.69 0.00 3.10 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 35 G 9.04 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 36 S 8.35 4.58 0.00 4.12 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 37 G 8.55 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 38 V 7.90 4.12 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 0.91 0.00 0.00 0.97 0.00 0.00 39 I 8.71 4.27 1.97 0.00 0.00 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 1.21 0.83 1.00 0.00 0.00 40 H 9.44 4.62 0.00 2.83 3.25 0.00 5.60 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 R 7.72 4.88 0.00 1.71 2.04 0.00 3.26 0.00 0.00 3.30 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.39 0.00 42 Y 8.75 4.92 0.00 2.95 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 43 N 8.62 4.52 0.00 2.14 1.42 0.00 0.00 6.74 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 44 R 8.45 4.00 0.00 1.88 1.98 0.00 3.27 0.00 0.00 3.17 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.54 0.00 45 T 7.65 4.03 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 1.24 0.00 0.00 46 E 8.02 3.94 0.00 1.95 1.50 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 1.92 2.08 0.00 47 S 7.86 4.45 0.00 4.05 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 48 R 8.02 4.10 0.00 1.96 1.83 0.00 3.31 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.54 0.00 49 L 7.69 4.56 0.00 1.86 1.99 1.03 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 50 S 8.25 4.09 0.00 3.85 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 G 8.63 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 52 R 7.47 4.26 0.00 1.83 1.67 0.00 3.03 0.00 0.00 3.09 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.50 0.00 53 I 7.99 4.15 1.82 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 1.39 0.73 0.89 0.00 0.00 54 P 0.00 4.20 0.00 2.23 2.47 0.00 3.64 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.51 0.00 55 E 8.12 4.05 0.00 1.90 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 2.43 0.00 56 R 7.32 4.20 0.00 2.02 1.99 0.00 2.99 0.00 0.00 3.09 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.50 0.00 57 V 7.34 3.70 1.58 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 0.41 0.00 0.00 0.63 0.00 0.00 58 I 6.93 3.91 1.84 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.75 1.00 0.00 0.00 59 G 8.72 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 60 R 7.47 4.44 0.00 2.02 1.77 0.00 3.12 0.00 0.00 3.03 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.71 0.00 61 N 9.27 4.91 0.00 2.69 2.69 0.00 0.00 7.14 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 F 9.36 3.89 0.00 2.70 2.29 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 63 F 8.01 4.13 0.00 3.13 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 64 T 8.26 4.21 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 1.27 0.00 0.00 65 E 7.86 4.40 0.00 2.05 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 2.17 2.22 0.00 66 V 7.93 3.53 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 0.58 0.00 0.00 0.86 0.00 0.00 67 A 7.73 4.40 0.09 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 68 P 0.00 4.49 0.00 2.20 2.27 0.00 3.82 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.87 0.00 69 C 7.98 4.30 0.00 3.24 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 T 7.71 4.26 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 0.64 0.00 0.00 71 N 8.26 4.75 0.00 2.86 2.87 0.00 0.00 6.96 7.48 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 72 I 7.50 4.67 1.99 0.00 0.00 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 1.72 0.83 1.02 0.00 0.00 73 P 0.00 4.30 0.00 2.18 2.13 0.00 3.63 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 2.12 2.16 0.00 74 A 8.09 4.03 1.37 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 0.00 0.00 0.00 75 F 8.07 4.60 0.00 2.89 3.05 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 76 S 8.72 3.86 0.00 3.61 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 77 G 8.01 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 0.00 0.00 0.00 78 R 7.62 3.92 0.00 1.84 1.95 0.00 2.72 0.00 0.00 2.55 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.48 0.00 79 F 8.07 4.07 0.00 3.24 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 80 M 8.22 3.75 0.00 2.10 1.98 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.65 0.00 81 D 8.18 4.40 0.00 2.67 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 82 G 7.51 3.46 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 0.00 83 V 7.11 3.41 1.63 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 0.88 0.00 0.00 -0.52 0.00 0.00 84 T 7.57 3.97 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 85 S 7.83 4.60 0.00 3.98 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 86 G 8.11 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 87 T 7.53 4.46 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 88 L 9.35 4.42 0.00 1.61 1.90 0.93 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 89 D 8.60 4.80 0.00 2.74 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 90 A 9.18 4.93 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 91 R 8.62 5.12 0.00 1.81 1.82 0.00 3.28 0.00 0.00 3.28 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 92 F 8.44 5.01 0.00 3.14 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 93 D 8.82 5.11 0.00 2.65 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 F 9.22 4.92 0.00 3.05 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 95 V 6.82 4.58 1.91 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 0.52 0.00 0.00 0.86 0.00 0.00 96 F 8.80 4.82 0.00 2.50 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 0.00 0.00 0.00 0.00 97 D 8.69 4.92 0.00 2.67 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 98 F 7.94 5.09 0.00 3.13 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 99 Q 8.73 4.15 0.00 2.07 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 7.13 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 100 M 7.49 4.25 0.00 2.06 2.08 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.52 0.00 101 A 7.41 4.74 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 P 0.00 4.51 0.00 1.93 1.97 0.00 3.66 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.07 0.00 103 V 8.22 4.21 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 1.10 0.00 0.00 1.06 0.00 0.00 104 R 8.51 4.46 0.00 1.82 1.79 0.00 3.19 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.60 0.00 105 V 9.20 4.78 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 0.69 0.00 0.00 0.50 0.00 0.00 106 Q 8.66 4.84 0.00 1.90 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.38 2.41 0.00 107 I 8.35 4.80 0.56 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.28 0.29 0.00 0.00 108 R 8.73 4.90 0.00 1.94 1.93 0.00 3.36 0.00 0.00 3.21 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.89 0.00 109 M 9.14 5.43 0.00 2.13 2.08 0.00 0.00 0.00 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.58 0.00 110 Q 8.75 5.80 0.00 2.28 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.90 0.00 0.00 0.00 0.00 0.00 2.56 2.48 0.00 111 N 9.05 5.09 0.00 2.73 2.85 0.00 0.00 6.70 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 0.00 112 A 7.90 4.99 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 0.00 113 G 9.43 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 V 7.45 4.11 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 0.93 0.00 0.00 0.91 0.00 0.00 115 P 0.00 4.14 0.00 2.03 1.92 0.00 3.78 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.03 0.00 116 D 8.53 4.44 0.00 2.85 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 0.00 117 R 6.85 4.87 0.00 1.66 1.41 0.00 2.97 0.00 0.00 2.95 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.50 0.00 118 Y 8.84 4.86 0.00 3.15 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 0.00 119 W 9.55 5.14 0.00 3.17 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 0.00 0.00 0.00 120 I 8.51 4.82 1.66 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.69 1.04 0.00 0.00 121 F 9.22 5.49 0.00 3.05 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 0.00 122 V 9.10 5.02 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 1.22 0.00 0.00 123 R 8.84 4.89 0.00 1.88 1.97 0.00 2.82 0.00 0.00 3.19 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.51 0.00 124 K 8.83 4.22 0.00 2.05 2.08 0.00 1.60 0.00 0.00 1.73 0.00 0.00 2.94 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.37 1.43 7.81 * Residues marked with a * may have inaccurate shift predictions.