NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 10 F 4.8574 8.1676 115.8921 57.2547 40.4050 176.7943 11 H 3.4724 6.3342 117.2986 56.9349 28.6326 173.8920 12 E 3.9884 8.1280 121.6772 58.5630 30.4670 178.9735 13 M 4.5795 7.1553 116.5862 55.5748 31.8400 177.2983 14 R 4.6213 7.7020 116.2549 55.7021 33.8479 175.4659 15 E 4.0734 8.0717 117.5441 55.0827 30.0226 174.6950 16 P 4.3602 0.0000 0.0000 63.1890 32.5004 175.2111 17 R 4.2850 7.6031 115.8813 55.0862 33.2833 174.3047 18 I 4.0475 8.3167 121.4037 61.3157 36.8659 175.7209 19 E 4.2206 9.3314 130.2659 58.4521 30.0531 176.9293 20 K 4.6367 7.5162 115.4596 55.9824 35.8363 174.3895 21 V 4.6086 8.6732 122.8570 61.2595 33.8070 174.0886 22 V 4.4182 8.2568 129.0462 61.8837 33.3020 175.0873 23 V 4.7623 8.4349 120.5807 59.9499 34.6405 174.1272 24 H 5.7597 8.8701 124.6001 53.3759 34.2927 172.1195 25 M 4.2919 8.2247 120.3937 53.5079 34.8198 175.1590 26 G 3.7308 8.3227 112.8022 46.7090 0.0000 172.4833 27 I 3.6631 8.4057 128.7502 60.9599 36.7332 176.2509 28 G 4.4451 5.3800 127.0700 46.3698 0.0000 172.2716 29 H 4.4944 7.3102 115.4823 55.7257 32.1422 174.1218 *35 A 4.4172 7.3204 123.9178 52.0791 19.1456 179.7454 36 N 4.4731 9.2699 120.5860 56.3842 37.8119 175.5822 37 A 4.3101 7.8253 121.2494 53.0226 19.2948 178.9118 38 E 4.0325 8.1650 116.8226 59.0946 29.4615 178.8520 39 D 4.3686 8.0917 118.9178 57.4548 40.9152 178.8013 40 I 3.8082 7.6829 113.0089 63.9430 37.8311 178.1191 41 L 4.0994 7.6789 120.3091 57.4648 41.4888 179.6613 42 G 3.6169 8.1502 105.8351 47.8001 0.0000 175.6724 43 E 4.1611 7.8867 119.6177 59.0206 29.6530 178.8445 44 I 3.9794 8.0368 118.0385 63.6459 38.1389 176.0982 45 T 4.4164 9.1317 109.6178 59.6433 69.2531 174.9292 46 G 4.6745 5.8265 125.5189 45.2921 0.0000 172.0513 47 Q 4.5082 7.0808 117.6645 55.2901 30.6643 173.6258 48 M 4.4947 8.4057 116.5936 53.6969 33.6977 174.1068 49 P 4.7680 0.0000 0.0000 62.3356 32.9988 175.5949 50 V 4.4472 8.4232 120.4852 60.8070 34.4144 175.1722 51 R 4.4184 8.7974 126.3284 57.0528 31.1186 176.3270 52 T 4.4890 8.9404 119.5435 61.7785 70.8571 173.6095 53 K 5.0612 8.8938 125.6786 55.1890 33.3026 176.8108 54 A 4.6603 8.4090 124.7186 50.8419 21.0335 176.4440 55 K 4.5296 8.0657 117.4161 55.6773 35.4152 175.4738 56 R 4.2344 8.8492 124.2790 56.3353 29.6613 176.1131 57 T 4.4593 8.2181 117.4169 63.1730 69.6294 174.4947 58 V 4.5406 8.6585 124.8632 60.6035 34.6451 176.8081 59 G 3.7436 8.7449 113.8941 48.2523 0.0000 174.1133 60 E 4.2774 8.0396 119.0856 57.3172 28.8479 176.0062 61 F 4.2463 8.0116 113.2625 60.3530 39.1680 174.9241 62 D 4.8582 7.7520 115.0038 52.5761 40.1352 176.9008 63 I 3.8706 7.4969 115.2949 63.3515 38.9093 177.4427 64 R 3.8785 7.7487 121.4651 55.7639 29.5168 174.9197 65 E 3.9538 8.2480 128.7152 58.5004 30.2568 177.2547 66 G 4.0811 7.6191 115.7934 45.2688 0.0000 170.9428 67 D 4.8657 8.1327 124.4532 51.0102 43.0657 173.1263 68 P 4.4557 0.0000 0.0000 64.0039 31.4362 176.0787 69 I 4.6068 8.8267 121.6364 61.7476 41.4580 174.7514 70 G 4.4870 7.9563 106.2383 46.8029 0.0000 171.7094 71 A 5.9400 8.5185 119.3179 50.7629 22.9886 175.5501 72 K 5.0521 8.4265 116.9713 55.6578 36.9224 175.3317 73 V 4.5893 8.2812 120.2767 61.5580 34.7185 174.1877 74 T 4.5065 8.5513 119.3391 60.6201 69.5686 174.0187 75 L 4.5846 8.5750 127.8294 53.5103 43.4926 176.3210 76 R 4.8151 7.9392 120.6541 54.7182 34.3483 176.6046 77 D 4.2015 8.9405 120.1595 55.5255 39.4573 176.3856 78 E 3.9938 8.9437 122.9378 61.0202 27.8006 178.3851 79 M 4.1458 8.2611 117.8192 58.5574 31.9292 178.5740 80 A 4.3102 7.9531 120.1017 54.8533 18.8323 179.5463 81 E 3.9626 8.0959 116.5322 59.7456 29.5954 179.1943 82 E 4.0881 8.5165 116.7682 58.4223 29.6759 178.3645 83 F 4.4646 7.5762 120.3235 60.3206 39.5020 177.3498 84 L 4.1833 8.1349 117.8555 57.0067 41.2562 178.8823 85 Q 4.0876 8.0560 117.4280 57.6217 28.6610 176.6882 86 T 4.2898 7.4046 107.9502 62.4986 71.1130 175.2347 87 A 3.9549 7.8103 125.1038 54.9943 18.9940 179.1263 88 L 3.7419 7.8789 114.2911 57.5446 41.9352 178.3589 89 P 4.2149 0.0000 0.0000 65.7236 31.2825 177.2165 90 L 4.3799 7.8796 115.1396 54.6451 41.1512 176.2583 91 A 4.5640 7.8787 120.3281 51.0608 22.0631 177.0734 92 E 4.4293 8.3715 120.5351 54.1548 29.5009 176.3281 93 L 4.1377 8.1343 123.2639 54.9077 42.3461 176.5377 94 A 5.1646 8.0365 121.5056 49.9523 21.5505 177.0218 95 T 3.9233 8.5673 115.8717 66.8561 68.9614 177.6412 96 S 4.4748 8.2604 115.5935 61.6354 63.2270 175.9994 97 Q 4.2089 8.0029 116.7392 56.7622 28.1793 175.3043 98 F 5.0056 8.0396 117.5301 55.6400 40.8512 175.4450 99 D 4.6942 9.3355 124.9365 53.9671 41.7550 177.0822 100 D 4.5171 8.5564 122.9091 57.1855 41.1410 178.0811 101 T 4.1017 7.8237 114.8129 64.5419 68.7238 175.2540 102 G 4.2931 7.8269 110.5476 46.2067 0.0000 172.5278 103 N 5.2847 7.9534 116.3378 51.4298 42.5352 172.8547 104 F 4.9624 7.5977 110.2317 57.4600 41.2113 173.0500 105 S 5.0661 8.5096 113.5765 56.9649 65.7765 172.3539 106 F 4.6992 8.7372 119.0664 56.6195 41.3142 173.3172 107 G 3.8217 8.8530 104.2735 44.3991 0.0000 174.7570 *128 L 4.0102 8.0936 123.9496 54.8235 42.8015 176.4024 129 D 4.4463 8.6035 126.5917 53.9041 42.4043 175.7253 130 V 4.2534 8.3480 122.6391 61.4187 34.4102 174.0885 131 T 4.7244 8.8746 125.2327 61.5097 71.3354 173.4462 132 V 4.5984 7.8249 125.1804 60.9671 34.5756 173.5080 133 N 5.0039 9.3786 127.1183 52.0404 40.4951 173.1793 134 L 5.3126 8.3278 126.1730 53.1936 44.4430 175.9996 135 V 4.2146 7.9053 120.3239 60.8326 34.5060 172.5027 136 R 3.8141 8.8729 119.9395 55.9677 30.9634 177.4371 137 P 3.4792 0.0000 0.0000 64.4371 33.6115 177.3792 138 G 3.9987 7.7761 108.1226 45.7135 0.0000 174.4871 139 Y 4.3919 7.7371 122.5006 59.9173 39.6728 177.0716 140 R 3.7636 8.2514 119.5073 59.5044 29.7571 177.9858 141 V 3.4891 7.4034 116.3678 65.5619 31.1834 176.8920 142 A 4.5630 7.6971 118.5766 51.1925 19.4267 177.2828 143 K 4.1943 7.6223 115.8043 56.0008 33.6606 176.8765 144 R 4.2770 7.5595 115.0269 55.5201 30.7186 176.4081 145 D 4.4700 8.4857 117.4915 56.8398 41.3962 177.7710 146 K 4.0240 7.9454 118.5092 57.5048 32.6255 176.9991 147 A 3.6481 8.7489 125.3561 52.4528 16.2829 176.8020 148 S 4.5385 7.1642 111.9947 60.7839 63.7574 173.5096 149 R 4.5562 8.5328 118.2999 55.1817 33.7481 173.8187 150 S 4.3659 8.6531 120.7283 57.8930 63.2516 173.8661 151 I 3.8839 8.3600 127.9410 60.6571 37.6571 174.3146 152 P 4.4601 0.0000 0.0000 62.3800 32.1024 177.5354 153 T 3.9041 8.6885 112.2765 64.7955 68.7025 176.5082 154 K 4.0062 8.1315 120.3043 58.8623 32.1575 176.8455 155 H 4.7181 8.2402 116.3143 55.7825 30.1702 174.8822 156 R 4.2608 7.5185 117.3755 56.0083 30.7401 176.0830 157 L 4.2357 8.1154 121.8600 55.0051 43.1959 175.9787 158 N 5.1935 8.1572 118.1285 50.3157 43.3042 174.0319 159 P 4.4148 0.0000 0.0000 65.4181 31.3555 179.1593 160 A 3.8982 7.8270 119.3595 55.3498 18.5047 179.3244 161 D 4.4286 8.1017 116.1719 56.7293 40.8161 178.8977 162 A 4.0688 7.9163 121.7493 55.1198 18.6015 179.4687 163 V 3.2397 7.2646 116.6043 66.1224 31.4797 177.6401 164 A 3.9151 7.8177 120.2115 55.3785 17.9548 179.2111 165 F 4.0315 7.7953 117.1392 61.6344 39.5913 177.0807 166 I 3.6840 7.7081 117.7259 64.4226 37.2225 177.4030 167 E 4.3606 8.5984 121.6023 58.7323 29.0486 178.7014 168 S 4.7260 7.6516 110.2461 57.8207 63.8862 175.1735 169 T 4.6893 7.7047 116.3802 62.8722 70.1440 172.9624 170 Y 3.4999 8.4021 120.0350 58.2383 35.6113 168.9583 171 D 4.4624 7.3682 118.1682 53.1863 41.7595 173.8214 172 V 4.5620 7.9263 117.9059 60.7435 35.5328 177.8053 173 E 4.5465 8.3259 127.3586 55.0857 28.6687 177.0860 174 V 3.6871 8.6841 119.6828 63.1142 31.4672 174.8758 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 10 F 8.17 4.86 0.00 3.36 3.38 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 11 H 6.33 3.47 0.00 3.00 2.33 0.00 5.46 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 E 8.13 3.99 0.00 1.69 1.79 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 2.31 2.22 0.00 13 M 7.16 4.58 0.00 2.24 2.07 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 2.62 2.62 0.00 14 R 7.70 4.62 0.00 2.00 1.90 0.00 3.35 0.00 0.00 3.40 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.88 0.00 15 E 8.07 4.07 0.00 2.22 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.27 0.00 16 P 0.00 4.36 0.00 1.10 1.59 0.00 3.71 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 1.99 1.99 0.00 17 R 7.60 4.29 0.00 1.78 1.87 0.00 2.75 0.00 0.00 3.14 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.50 0.00 18 I 8.32 4.05 1.96 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.82 0.97 0.00 0.00 19 E 9.33 4.22 0.00 1.85 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 0.00 2.31 2.16 0.00 20 K 7.52 4.64 0.00 1.78 1.82 0.00 1.46 0.00 0.00 1.75 0.00 0.00 2.94 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.32 1.34 7.81 21 V 8.67 4.61 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 1.04 0.00 0.00 0.98 0.00 0.00 22 V 8.26 4.42 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.85 0.00 0.00 23 V 8.43 4.76 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 0.41 0.00 0.00 0.59 0.00 0.00 24 H 8.87 5.76 0.00 3.27 2.99 0.00 5.57 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 25 M 8.22 4.29 0.00 1.87 1.85 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.43 0.00 26 G 8.32 3.73 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 0.00 0.00 0.00 27 I 8.41 3.66 1.96 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.68 0.76 0.00 0.00 28 G 5.38 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 H 7.31 4.49 0.00 3.11 3.31 0.00 5.76 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 *35 A 7.32 4.42 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 N 9.27 4.47 0.00 2.84 2.96 0.00 0.00 5.87 7.26 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 37 A 7.83 4.31 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 38 E 8.17 4.03 0.00 2.15 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 2.31 2.43 0.00 39 D 8.09 4.37 0.00 2.68 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 40 I 7.68 3.81 1.88 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 1.75 0.59 0.91 0.00 0.00 41 L 7.68 4.10 0.00 1.83 1.73 0.93 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 42 G 8.15 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 43 E 7.89 4.16 0.00 1.99 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 2.35 2.50 0.00 44 I 8.04 3.98 2.04 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.81 1.13 0.00 0.00 45 T 9.13 4.42 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 0.98 0.00 0.00 46 G 5.83 4.67 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 0.00 0.00 0.00 47 Q 7.08 4.51 0.00 2.15 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.57 0.00 0.00 0.00 0.00 0.00 2.19 2.24 0.00 48 M 8.41 4.49 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.52 0.00 49 P 0.00 4.77 0.00 1.91 1.95 0.00 3.59 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 2.16 2.05 0.00 50 V 8.42 4.45 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 1.03 0.00 0.00 0.96 0.00 0.00 51 R 8.80 4.42 0.00 1.72 1.84 0.00 3.34 0.00 0.00 3.29 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.60 0.00 52 T 8.94 4.49 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 1.20 0.00 0.00 53 K 8.89 5.06 0.00 1.62 1.71 0.00 1.77 0.00 0.00 1.94 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.27 7.81 54 A 8.41 4.66 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 K 8.07 4.53 0.00 1.59 1.67 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.31 1.41 7.81 56 R 8.85 4.23 0.00 1.99 2.01 0.00 3.20 0.00 0.00 3.23 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.63 0.00 57 T 8.22 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 1.24 0.00 0.00 58 V 8.66 4.54 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 1.08 0.00 0.00 0.99 0.00 0.00 59 G 8.74 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 E 8.04 4.28 0.00 2.14 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 2.31 2.34 0.00 61 F 8.01 4.25 0.00 3.03 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 62 D 7.75 4.86 0.00 2.93 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 63 I 7.50 3.87 1.94 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.75 1.05 0.00 0.00 64 R 7.75 3.88 0.00 1.73 2.06 0.00 3.19 0.00 0.00 3.09 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 65 E 8.25 3.95 0.00 1.96 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 0.00 2.28 2.30 0.00 66 G 7.62 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 67 D 8.13 4.87 0.00 2.64 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 68 P 0.00 4.46 0.00 1.93 2.04 0.00 3.59 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 2.01 2.12 0.00 69 I 8.83 4.61 2.02 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.25 0.90 0.00 0.00 70 G 7.96 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 71 A 8.52 5.94 1.17 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 0.00 0.00 72 K 8.43 5.05 0.00 1.74 1.85 0.00 1.39 0.00 0.00 1.69 0.00 0.00 2.75 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.35 1.39 7.81 73 V 8.28 4.59 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 0.87 0.00 0.00 0.85 0.00 0.00 74 T 8.55 4.51 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 1.16 0.00 0.00 75 L 8.57 4.58 0.00 1.58 1.62 0.40 0.56 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 76 R 7.94 4.82 0.00 1.62 1.77 0.00 3.34 0.00 0.00 3.23 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.62 0.00 77 D 8.94 4.20 0.00 2.88 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 78 E 8.94 3.99 0.00 2.02 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 2.42 2.43 0.00 79 M 8.26 4.15 0.00 2.01 2.32 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 2.70 2.58 0.00 80 A 7.95 4.31 1.41 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 81 E 8.10 3.96 0.00 2.19 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 2.47 2.61 0.00 82 E 8.52 4.09 0.00 1.99 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 2.35 2.47 0.00 83 F 7.58 4.46 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 84 L 8.13 4.18 0.00 1.98 1.80 1.10 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 85 Q 8.06 4.09 0.00 1.95 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.74 0.00 0.00 0.00 0.00 0.00 2.16 2.47 0.00 86 T 7.40 4.29 4.10 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 0.00 0.00 0.00 1.13 0.00 0.00 87 A 7.81 3.95 1.08 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 88 L 7.88 3.74 0.00 1.82 1.70 1.01 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 89 P 0.00 4.21 0.00 2.12 2.11 0.00 3.71 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 2.17 2.10 0.00 90 L 7.88 4.38 0.00 1.83 1.71 0.90 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 91 A 7.88 4.56 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 92 E 8.37 4.43 0.00 1.95 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 2.21 2.29 0.00 93 L 8.13 4.14 0.00 1.74 1.66 0.82 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 94 A 8.04 5.16 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 T 8.57 3.92 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 1.16 0.00 0.00 96 S 8.26 4.47 0.00 4.06 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 0.00 97 Q 8.00 4.21 0.00 2.68 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.09 6.82 0.00 0.00 0.00 0.00 0.00 2.49 2.45 0.00 98 F 8.04 5.01 0.00 3.19 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 99 D 9.34 4.69 0.00 2.71 2.76 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 0.00 100 D 8.56 4.52 0.00 2.73 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 0.00 101 T 7.82 4.10 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 1.22 0.00 0.00 102 G 7.83 4.29 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 0.00 103 N 7.95 5.28 0.00 2.90 2.87 0.00 0.00 6.56 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 0.00 104 F 7.60 4.96 0.00 2.80 1.71 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 0.00 105 S 8.51 5.07 0.00 3.73 3.67 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 0.00 106 F 8.74 4.70 0.00 3.17 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.85 3.82 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 0.00 0.00 0.00 *128 L 8.09 4.01 0.00 1.68 1.67 0.94 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 129 D 8.60 4.45 0.00 2.82 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 0.00 130 V 8.35 4.25 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.86 0.00 0.00 131 T 8.87 4.72 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 1.09 0.00 0.00 132 V 7.82 4.60 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 1.05 0.00 0.00 0.77 0.00 0.00 133 N 9.38 5.00 0.00 2.71 2.66 0.00 0.00 6.66 6.58 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 0.00 134 L 8.33 5.31 0.00 1.68 1.42 1.20 1.08 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 0.00 135 V 7.91 4.21 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 0.18 0.00 0.00 0.44 0.00 0.00 136 R 8.87 3.81 0.00 1.63 1.75 0.00 3.13 0.00 0.00 3.16 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.52 0.00 137 P 0.00 3.48 0.00 2.10 2.00 0.00 3.65 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.11 0.00 138 G 7.78 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 0.00 139 Y 7.74 4.39 0.00 3.31 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 0.00 140 R 8.25 3.76 0.00 1.92 1.94 0.00 3.25 0.00 0.00 3.26 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.68 0.00 141 V 7.40 3.49 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 1.00 0.00 0.00 0.99 0.00 0.00 142 A 7.70 4.56 1.10 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 0.00 0.00 0.00 0.00 0.00 0.00 143 K 7.62 4.19 0.00 1.57 1.74 0.00 1.62 0.00 0.00 1.53 0.00 0.00 2.85 0.00 0.00 3.09 0.00 0.00 0.00 0.00 0.69 1.32 7.81 144 R 7.56 4.28 0.00 1.89 1.91 0.00 3.08 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.69 0.00 145 D 8.49 4.47 0.00 2.67 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 0.00 146 K 7.95 4.02 0.00 1.80 1.71 0.00 1.80 0.00 0.00 1.81 0.00 0.00 2.87 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.51 1.42 7.81 147 A 8.75 3.65 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 0.00 148 S 7.16 4.54 0.00 3.88 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 0.00 149 R 8.53 4.56 0.00 1.85 1.73 0.00 3.08 0.00 0.00 3.09 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.54 0.00 150 S 8.65 4.37 0.00 3.92 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 0.00 151 I 8.36 3.88 1.99 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 1.49 1.19 1.04 0.00 0.00 152 P 0.00 4.46 0.00 2.22 1.99 0.00 3.66 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.09 0.00 153 T 8.69 3.90 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 1.23 0.00 0.00 154 K 8.13 4.01 0.00 1.79 1.96 0.00 1.64 0.00 0.00 1.66 0.00 0.00 3.05 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.47 1.51 7.81 155 H 8.24 4.72 0.00 3.07 3.45 0.00 5.94 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 0.00 156 R 7.52 4.26 0.00 2.04 1.86 0.00 3.43 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.75 0.00 157 L 8.12 4.24 0.00 1.52 1.88 0.83 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 158 N 8.16 5.19 0.00 2.99 2.67 0.00 0.00 6.82 8.03 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 0.00 159 P 0.00 4.41 0.00 2.16 2.16 0.00 3.61 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 2.15 2.38 0.00 160 A 7.83 3.90 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 0.00 161 D 8.10 4.43 0.00 2.71 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 0.00 162 A 7.92 4.07 1.71 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 0.00 163 V 7.26 3.24 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 0.66 0.00 0.00 0.22 0.00 0.00 164 A 7.82 3.92 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 F 7.80 4.03 0.00 2.99 3.31 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 0.00 166 I 7.71 3.68 1.87 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.10 0.96 0.00 0.00 167 E 8.60 4.36 0.00 1.99 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 0.00 2.25 2.29 0.00 168 S 7.65 4.73 0.00 3.92 3.87 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 0.00 169 T 7.70 4.69 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 1.32 0.00 0.00 170 Y 8.40 3.50 0.00 3.02 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 0.00 171 D 7.37 4.46 0.00 2.81 2.76 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 0.00 172 V 7.93 4.56 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 0.84 0.00 0.00 0.90 0.00 0.00 173 E 8.33 4.55 0.00 1.97 1.12 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 2.36 2.22 0.00 174 V 8.68 3.69 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 0.92 0.00 0.00 0.86 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.