NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 L 4.2318 8.1849 122.4864 54.5261 43.0160 176.2375 5 K 4.0009 8.2352 126.1119 55.2421 33.6461 174.4526 6 L 4.7823 9.3653 126.8997 53.8212 43.7536 175.1021 7 I 4.7871 8.3078 127.7068 59.8347 40.3259 174.4327 8 H 4.9555 8.9529 124.6201 54.7829 30.3003 174.2103 9 I 4.9141 8.5405 124.7282 59.4164 40.0505 174.6283 10 F 5.4653 9.5620 125.6423 55.9260 41.9040 174.6130 11 T 5.3474 8.3979 111.5883 60.5903 72.1331 172.3472 12 D 4.8161 9.2807 121.3753 53.7079 45.2724 174.0361 13 G 4.5895 8.5677 108.2040 45.0531 0.0000 171.6569 14 S 4.8948 8.8469 114.1197 57.2125 66.4511 172.7237 15 C 5.0199 8.4907 125.0152 58.1958 34.1925 173.9628 16 L 4.3748 9.1018 127.3531 53.4680 40.8394 177.0564 17 G 4.0055 10.1676 107.1652 46.0900 0.0000 171.4124 18 N 4.6487 7.9100 118.0641 51.8989 39.5359 172.3412 19 P 5.0030 0.0000 0.0000 60.9190 33.1748 175.2300 20 G 4.4498 8.8817 102.7944 42.8708 0.0000 170.8977 21 P 4.9907 0.0000 0.0000 62.9584 32.4417 175.5489 22 G 4.5578 9.2450 108.2433 46.0797 0.0000 170.9518 23 G 5.0318 8.5024 105.7843 45.9277 0.0000 171.7187 24 Y 5.4357 7.6415 117.4075 55.3437 42.2547 174.4864 25 G 4.3937 9.0875 105.1229 45.3548 0.0000 172.5053 26 I 5.3103 8.8967 124.7411 59.8093 42.0397 174.0498 27 V 4.9049 8.9941 126.8072 61.3389 34.4740 174.0802 28 M 5.3716 9.0196 126.5677 53.6910 35.0891 174.5137 29 K 5.2104 9.1829 123.8469 54.8687 35.2646 175.1184 30 Y 4.9525 9.1716 125.7121 55.8220 42.0402 175.2941 31 K 3.2931 8.5309 127.6076 57.8686 31.6338 176.1565 32 G 3.9092 8.6126 116.0233 46.4757 0.0000 172.5072 33 H 4.5134 8.3341 119.0861 55.4376 29.3971 174.2175 34 T 5.3605 8.4935 120.8200 61.5560 71.1192 173.5605 35 K 4.7896 9.1731 124.6929 55.1469 36.2520 174.9154 36 E 5.3605 8.8262 120.5716 55.1697 32.3782 175.1863 37 M 5.1190 8.9522 121.2386 54.2070 36.9058 174.2874 38 S 4.5802 7.7883 114.4798 58.6872 66.3004 173.2228 39 G 3.7113 6.8812 103.8330 45.1555 0.0000 172.6133 40 G 4.5318 8.3382 108.5789 44.0684 0.0000 172.0982 41 F 5.1600 9.6308 122.3733 55.3707 42.6404 176.4094 42 S 4.2273 9.3622 118.2096 60.8798 64.0655 173.7825 43 L 4.8689 7.8272 122.0666 53.4803 44.3146 175.0079 44 T 4.5800 8.4172 121.8114 61.7969 70.8456 172.1108 45 T 4.8501 8.1812 108.5153 59.0385 72.3086 173.8614 46 N 4.2244 9.7137 121.4248 57.2726 38.6588 177.0732 47 N 4.1554 7.8274 117.0018 56.3373 38.6441 177.4737 48 R 3.8631 8.0139 119.5187 59.4872 29.9599 179.0291 49 M 4.1449 7.8147 118.5886 58.1940 31.8618 178.5391 50 E 4.0956 8.0690 117.9559 59.0047 29.4558 178.5831 51 L 4.1681 7.6168 120.1328 57.3469 42.3120 178.3873 52 L 3.8501 8.2617 120.5099 57.8935 41.8685 178.3038 53 A 3.7859 7.7766 120.9051 54.9010 18.3407 177.8105 54 P 4.2828 0.0000 0.0000 65.7648 31.4171 178.6969 55 I 3.6638 7.3670 118.3687 64.2621 37.1904 178.3159 56 V 3.4685 7.8000 119.0202 66.0622 31.0455 177.8391 57 A 4.0102 7.6807 119.0838 55.0318 18.4987 179.2272 58 L 4.0468 7.8643 117.1727 57.6818 41.8221 179.2914 59 E 4.0583 8.6081 117.1172 59.0800 29.3841 178.9729 60 A 4.1153 7.6863 119.6075 53.6247 18.8194 178.0490 61 L 4.1034 7.2470 117.2891 54.9894 42.1670 177.2540 62 K 4.4205 8.4926 120.5346 56.7680 33.3634 176.1161 63 E 4.7302 7.6966 114.8450 53.2070 32.6033 172.9946 64 P 4.1888 0.0000 0.0000 64.0266 31.6282 175.1560 65 C 4.7823 8.2309 117.2823 57.9150 33.5172 172.7229 66 K 4.6083 8.2435 121.9911 56.4858 32.9502 175.6316 67 I 4.8382 8.6987 128.4624 59.4921 40.4825 174.4718 68 I 4.5092 8.2112 126.9576 59.3926 39.4557 174.3274 69 L 4.7499 8.4872 129.8846 53.4954 44.0995 174.9118 70 T 5.4809 8.3527 124.0236 61.2769 70.6810 174.2974 71 S 4.8388 8.4690 119.1526 57.4019 66.6308 174.0926 72 D 5.1116 8.7700 125.5097 51.0620 38.2227 175.0429 73 S 4.5407 8.1179 117.9304 56.1826 63.9025 173.5597 74 Q 3.5373 8.7432 125.7482 58.9741 28.3927 177.8098 75 Y 4.4755 8.2687 119.6747 60.9907 38.5211 178.4408 76 V 3.7833 8.7120 119.5097 65.4284 31.8959 177.6896 77 R 2.5100 6.9392 118.0692 59.2331 29.6401 177.9070 78 Q 3.3422 7.2977 118.6768 58.0668 28.7411 178.4216 79 G 2.8830 6.7688 106.8841 47.4044 0.0000 175.7136 80 I 3.9149 7.5129 114.4385 62.5028 37.9318 177.8610 81 M 4.0618 7.8255 120.6662 58.1984 31.8861 177.2142 82 T 4.2059 6.8487 110.5241 63.8240 72.0574 175.8546 83 W 3.6958 7.1800 120.6645 58.8577 29.0230 178.8159 84 I 3.5013 6.8853 119.7920 64.5084 36.5712 178.1954 85 H 4.1931 7.8020 115.6050 58.5727 28.3058 177.7123 86 G 3.3898 7.2897 107.9463 47.1309 0.0000 175.6218 87 W 4.2227 7.4563 121.4091 59.3315 29.0048 178.5184 88 K 2.7729 7.6538 119.9278 58.9942 31.2983 178.6419 89 K 3.9314 7.7008 118.8341 59.1999 31.9481 177.2815 90 N 4.8056 8.0051 115.5026 52.2960 39.6156 175.4406 91 G 4.3228 8.4197 106.5702 47.3215 0.0000 173.7415 92 W 3.7416 8.1619 109.9339 56.8599 27.7890 175.1275 93 M 4.8593 7.6079 112.1534 53.7178 33.8518 174.9789 94 T 4.0335 8.0183 111.2952 62.2821 68.5838 173.6345 95 S 4.6537 8.5122 113.9838 58.4688 64.0545 173.4750 96 N 4.9221 7.9694 117.8865 52.4071 38.6765 172.3839 97 G 4.1982 8.6960 108.5187 46.1714 0.0000 173.7541 98 T 3.7847 7.9800 109.0382 61.5392 68.7799 171.5131 99 P 4.6081 0.0000 0.0000 61.6884 32.2199 176.6123 100 V 3.3039 8.0733 114.6511 61.1349 30.9097 176.2552 101 K 3.8126 8.2942 123.5592 58.1641 32.6121 176.4982 102 N 4.2110 9.0718 121.9127 54.2567 36.3684 176.7914 103 V 3.7575 7.2728 118.6604 64.9474 31.2023 176.8464 104 D 4.2937 8.1647 119.2596 56.4295 38.7676 178.8225 105 L 3.9574 7.6213 119.3053 57.1938 41.9078 178.8756 106 W 4.4800 7.8916 118.7486 59.9023 28.9930 178.4810 107 K 3.1642 8.0178 118.5348 59.5950 31.4909 179.5611 108 R 3.9038 7.4520 116.5212 58.9567 29.9101 179.0324 109 L 4.0431 8.1040 120.3827 58.0061 42.1084 178.1541 110 D 4.6057 9.1638 118.8901 57.7017 41.0311 178.4018 111 K 4.0316 8.3863 118.4366 59.1445 32.4590 177.8522 112 A 4.3772 7.9490 119.8595 53.9144 19.0353 179.2278 113 A 4.2201 8.3100 119.7270 55.2844 18.2537 179.7110 114 Q 4.0585 7.8647 115.7194 59.1663 28.9342 178.5819 115 L 4.2432 7.3825 115.8773 55.5565 41.9132 175.7609 116 H 4.9554 7.6269 115.0690 53.8690 33.2821 172.5607 117 Q 4.5051 8.7985 120.6519 54.8023 30.4515 174.1988 118 I 4.6029 8.2726 127.3993 59.4249 40.0668 174.5513 119 D 4.6848 8.3979 127.7517 52.4102 42.5002 175.2400 120 W 4.4094 8.6839 126.6906 56.2196 30.2336 175.9218 121 R 4.4096 8.4779 124.1783 54.1896 31.9174 175.0721 122 W 5.5314 8.4587 123.2132 54.3254 30.9715 175.5357 123 V 4.7603 8.6290 123.2340 60.9869 35.2317 173.8052 124 K 4.7998 8.8863 125.0137 55.0061 34.0938 175.6668 125 G 4.6184 8.6196 110.7544 42.3437 0.0000 170.9650 *130 A 4.2355 7.6654 120.6665 52.0214 20.9902 178.8631 131 E 3.8014 7.4604 114.1898 58.6083 29.5976 179.4049 132 N 4.4757 7.9945 116.4457 56.0100 38.6150 176.9045 133 E 3.9860 8.0857 119.7561 59.3940 29.5935 179.2175 134 R 3.8485 7.8058 118.4535 59.6573 30.1929 177.9663 135 C 3.9902 8.1436 116.6496 63.5145 28.3245 175.8736 136 H 4.3397 8.5273 120.9831 58.7033 29.5055 177.2000 137 Q 3.9604 8.6462 120.3205 58.9856 28.5039 178.7756 138 L 3.9432 8.3780 119.9982 57.8239 41.5940 179.6301 139 A 4.0112 8.1344 120.5676 55.0009 18.3629 179.5857 140 R 3.7257 7.7241 116.5020 59.5008 29.9710 178.1859 141 A 3.9451 7.4894 118.3910 55.4458 18.7182 179.1820 142 A 3.9726 8.2415 118.9294 55.2492 18.2217 179.5072 143 A 4.1257 8.0557 118.5114 55.1696 18.8270 178.7922 144 E 4.3249 8.2678 114.5394 56.4482 29.8141 176.8067 145 A 4.8891 7.7321 121.9946 52.3934 19.9506 176.5968 146 N 4.1825 7.8094 112.7242 55.0630 36.7197 173.7394 147 P 4.3866 0.0000 0.0000 63.0861 32.3764 176.4398 148 T 4.3620 8.0942 109.2321 61.7613 70.4041 174.7950 149 Q 3.9101 7.7866 124.0655 56.2639 29.5221 174.5191 150 I 4.4656 8.0856 124.4839 59.6006 39.2720 175.1051 151 D 4.6668 8.7836 127.3205 53.8595 39.7706 176.2399 152 T 4.0148 8.4622 121.4343 64.1475 67.6083 175.2345 153 G 3.7225 7.6900 108.7837 45.9902 0.0000 173.0937 154 Y 4.3119 7.7169 126.1295 57.6894 40.8539 169.3061 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 4 L 8.18 4.23 0.00 1.58 1.65 0.95 0.29 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 5 K 8.24 4.00 0.00 1.54 1.13 0.00 1.22 0.00 0.00 0.74 0.00 0.00 2.70 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.91 1.26 7.81 6 L 9.37 4.78 0.00 1.63 1.66 0.87 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 7 I 8.31 4.79 1.77 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 1.12 0.41 0.95 0.00 0.00 8 H 8.95 4.96 0.00 3.21 2.97 0.00 5.56 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 I 8.54 4.91 1.64 0.00 0.00 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 1.18 0.57 0.86 0.00 0.00 10 F 9.56 5.47 0.00 2.88 2.98 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 11 T 8.40 5.35 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 12 D 9.28 4.82 0.00 2.90 2.61 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 0.00 0.00 0.00 0.00 13 G 8.57 4.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.85 4.89 0.00 3.96 3.68 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 15 C 8.49 5.02 0.00 2.99 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 16 L 9.10 4.37 0.00 1.65 1.61 0.93 0.77 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 17 G 10.17 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 N 7.91 4.65 0.00 2.60 2.67 0.00 0.00 7.05 7.69 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 19 P 0.00 5.00 0.00 2.18 1.97 0.00 3.39 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.89 0.00 20 G 8.88 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 21 P 0.00 4.99 0.00 2.15 2.30 0.00 3.87 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.84 0.00 22 G 9.25 4.56 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 23 G 8.50 5.03 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 24 Y 7.64 5.44 0.00 3.13 3.14 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 25 G 9.09 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 0.00 0.00 0.00 0.00 26 I 8.90 5.31 2.16 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 1.23 0.87 1.00 0.00 0.00 27 V 8.99 4.90 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 1.01 0.00 0.00 0.93 0.00 0.00 28 M 9.02 5.37 0.00 2.04 1.99 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.52 0.00 29 K 9.18 5.21 0.00 1.87 1.78 0.00 1.75 0.00 0.00 1.58 0.00 0.00 2.77 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.43 1.50 7.81 30 Y 9.17 4.95 0.00 2.98 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 31 K 8.53 3.29 0.00 1.09 0.74 0.00 1.67 0.00 0.00 1.50 0.00 0.00 2.73 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.08 0.67 7.81 32 G 8.61 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 H 8.33 4.51 0.00 3.45 3.33 0.00 5.75 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 34 T 8.49 5.36 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 35 K 9.17 4.79 0.00 1.81 1.90 0.00 1.31 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.36 1.43 7.81 36 E 8.83 5.36 0.00 1.86 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 2.22 2.32 0.00 37 M 8.95 5.12 0.00 2.06 2.05 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.53 0.00 38 S 7.79 4.58 0.00 3.70 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 G 6.88 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 G 8.34 4.53 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 0.00 41 F 9.63 5.16 0.00 2.88 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 42 S 9.36 4.23 0.00 3.91 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 43 L 7.83 4.87 0.00 1.64 1.61 0.94 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 44 T 8.42 4.58 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 1.22 0.00 0.00 45 T 8.18 4.85 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 1.00 0.00 0.00 46 N 9.71 4.22 0.00 2.78 2.81 0.00 0.00 7.52 7.28 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 47 N 7.83 4.16 0.00 2.42 1.98 0.00 0.00 7.11 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 48 R 8.01 3.86 0.00 1.70 1.82 0.00 3.15 0.00 0.00 3.01 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.55 0.00 49 M 7.81 4.14 0.00 2.23 2.14 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.79 0.00 50 E 8.07 4.10 0.00 2.20 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 2.45 2.40 0.00 51 L 7.62 4.17 0.00 1.80 1.56 0.01 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 52 L 8.26 3.85 0.00 1.73 1.50 0.79 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 53 A 7.78 3.79 1.47 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 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.28 0.00 2.54 2.57 0.00 3.74 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.26 0.00 55 I 7.37 3.66 1.92 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.71 0.86 0.00 0.00 56 V 7.80 3.47 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.65 0.00 0.00 57 A 7.68 4.01 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 58 L 7.86 4.05 0.00 1.71 1.67 0.98 0.48 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 59 E 8.61 4.06 0.00 1.88 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 2.36 2.57 0.00 60 A 7.69 4.12 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 61 L 7.25 4.10 0.00 1.76 1.61 0.63 0.81 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 62 K 8.49 4.42 0.00 1.71 1.83 0.00 1.71 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.36 1.40 7.81 63 E 7.70 4.73 0.00 1.98 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 2.11 2.23 0.00 64 P 0.00 4.19 0.00 2.15 2.06 0.00 3.71 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 1.96 1.97 0.00 65 C 8.23 4.78 0.00 2.76 2.88 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 66 K 8.24 4.61 0.00 1.93 1.62 0.00 1.53 0.00 0.00 1.71 0.00 0.00 2.79 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.34 1.35 7.81 67 I 8.70 4.84 1.61 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.18 0.53 0.00 0.00 68 I 8.21 4.51 1.63 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 0.95 0.43 0.73 0.00 0.00 69 L 8.49 4.75 0.00 0.86 0.46 0.41 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.35 5.48 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 1.37 0.00 0.00 71 S 8.47 4.84 0.00 4.09 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 72 D 8.77 5.11 0.00 2.87 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 73 S 8.12 4.54 0.00 4.21 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 Q 8.74 3.54 0.00 2.11 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.57 0.00 0.00 0.00 0.00 0.00 2.46 2.38 0.00 75 Y 8.27 4.48 0.00 3.11 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 76 V 8.71 3.78 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 1.11 0.00 0.00 1.00 0.00 0.00 77 R 6.94 2.51 0.00 0.67 1.20 0.00 2.55 0.00 0.00 2.70 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.50 0.00 78 Q 7.30 3.34 0.00 1.63 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.61 0.00 0.00 0.00 0.00 0.00 1.61 1.16 0.00 79 G 6.77 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 I 7.51 3.91 1.75 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.38 0.19 0.82 0.00 0.00 81 M 7.83 4.06 0.00 1.75 1.80 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 2.27 2.54 0.00 82 T 6.85 4.21 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 0.92 0.00 0.00 83 W 7.18 3.70 0.00 1.91 1.74 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 84 I 6.89 3.50 1.84 0.00 0.00 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 1.96 0.56 0.98 0.00 0.00 85 H 7.80 4.19 0.00 3.31 3.48 0.00 5.66 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 G 7.29 3.39 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 0.00 87 W 7.46 4.22 0.00 3.09 2.69 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 88 K 7.65 2.77 0.00 1.31 1.65 0.00 1.80 0.00 0.00 1.98 0.00 0.00 2.85 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.35 1.28 7.81 89 K 7.70 3.93 0.00 1.74 1.97 0.00 1.81 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.45 7.81 90 N 8.01 4.81 0.00 2.94 2.92 0.00 0.00 7.03 9.28 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 91 G 8.42 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 0.00 0.00 0.00 92 W 8.16 3.74 0.00 3.38 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 93 M 7.61 4.86 0.00 2.12 2.25 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 2.51 2.81 0.00 94 T 8.02 4.03 4.21 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 1.17 0.00 0.00 95 S 8.51 4.65 0.00 3.97 3.97 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 96 N 7.97 4.92 0.00 2.61 2.71 0.00 0.00 7.34 7.98 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 97 G 8.70 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 0.00 0.00 0.00 0.00 98 T 7.98 3.78 4.21 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 1.20 0.00 0.00 99 P 0.00 4.61 0.00 2.03 2.01 0.00 3.68 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 2.01 2.09 0.00 100 V 8.07 3.30 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 0.53 0.00 0.00 101 K 8.29 3.81 0.00 1.73 1.73 0.00 1.89 0.00 0.00 1.88 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.56 1.49 7.81 102 N 9.07 4.21 0.00 3.18 2.84 0.00 0.00 6.89 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 V 7.27 3.76 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 1.00 0.00 0.00 0.85 0.00 0.00 104 D 8.16 4.29 0.00 2.83 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 0.00 105 L 7.62 3.96 0.00 1.59 1.44 0.75 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 106 W 7.89 4.48 0.00 3.55 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 K 8.02 3.16 0.00 1.42 1.48 0.00 1.33 0.00 0.00 1.29 0.00 0.00 2.63 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.30 0.76 7.81 108 R 7.45 3.90 0.00 1.97 1.95 0.00 3.07 0.00 0.00 3.14 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 109 L 8.10 4.04 0.00 1.79 1.98 1.16 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 110 D 9.16 4.61 0.00 3.37 3.10 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 0.00 111 K 8.39 4.03 0.00 1.92 1.88 0.00 1.84 0.00 0.00 1.72 0.00 0.00 3.07 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.49 1.50 7.81 112 A 7.95 4.38 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 A 8.31 4.22 1.64 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 0.00 114 Q 7.86 4.06 0.00 2.07 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.89 0.00 0.00 0.00 0.00 0.00 2.65 2.69 0.00 115 L 7.38 4.24 0.00 1.78 1.58 0.93 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 116 H 7.63 4.96 0.00 2.95 3.14 0.00 5.82 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 Q 8.80 4.51 0.00 2.10 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.74 0.00 0.00 0.00 0.00 0.00 2.21 2.27 0.00 118 I 8.27 4.60 1.74 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.73 -0.21 0.00 0.00 119 D 8.40 4.68 0.00 2.75 2.41 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 0.00 120 W 8.68 4.41 0.00 2.92 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 0.00 0.00 0.00 121 R 8.48 4.41 0.00 1.53 1.74 0.00 3.19 0.00 0.00 3.12 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.61 0.00 122 W 8.46 5.53 0.00 3.22 3.13 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 0.00 123 V 8.63 4.76 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 1.12 0.00 0.00 1.00 0.00 0.00 124 K 8.89 4.80 0.00 1.92 1.83 0.00 1.60 0.00 0.00 1.74 0.00 0.00 2.86 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.36 1.44 7.81 125 G 8.62 4.62 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 *130 A 7.67 4.24 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 0.00 131 E 7.46 3.80 0.00 1.16 1.13 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 1.79 2.09 0.00 132 N 7.99 4.48 0.00 2.89 2.95 0.00 0.00 7.17 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 0.00 133 E 8.09 3.99 0.00 2.17 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 2.41 2.37 0.00 134 R 7.81 3.85 0.00 1.89 2.01 0.00 3.15 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.70 0.00 135 C 8.14 3.99 0.00 3.29 3.24 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 0.00 136 H 8.53 4.34 0.00 3.32 3.48 0.00 5.64 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 0.00 137 Q 8.65 3.96 0.00 2.39 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.56 0.00 0.00 0.00 0.00 0.00 2.37 2.45 0.00 138 L 8.38 3.94 0.00 1.82 1.70 0.95 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 139 A 8.13 4.01 1.45 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 0.00 140 R 7.72 3.73 0.00 1.89 1.86 0.00 3.10 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 1.60 1.61 0.00 141 A 7.49 3.95 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 0.00 142 A 8.24 3.97 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 0.00 143 A 8.06 4.13 1.36 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 0.00 144 E 8.27 4.32 0.00 2.01 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 0.00 2.28 2.39 0.00 145 A 7.73 4.89 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 0.00 146 N 7.81 4.18 0.00 2.88 2.86 0.00 0.00 6.85 7.32 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 0.00 147 P 0.00 4.39 0.00 2.14 1.97 0.00 3.72 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 2.00 1.99 0.00 148 T 8.09 4.36 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 1.19 0.00 0.00 149 Q 7.79 3.91 0.00 1.84 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 7.00 0.00 0.00 0.00 0.00 0.00 2.31 2.23 0.00 150 I 8.09 4.47 1.94 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 1.41 1.32 0.95 0.00 0.00 151 D 8.78 4.67 0.00 2.60 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 T 8.46 4.01 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 1.26 0.00 0.00 153 G 7.69 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 Y 7.72 4.31 0.00 2.84 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 * Residues marked with a * may have inaccurate shift predictions.