NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3820 8.3044 120.3477 54.7152 33.3663 174.4732 2 E 3.9482 8.5299 123.2325 55.9460 30.5122 173.9445 3 K 5.0257 8.8880 125.9009 54.7767 35.6000 174.8331 4 S 4.8137 9.0298 117.1773 56.5734 66.4767 172.3472 5 F 5.2731 8.8464 126.4604 57.0362 40.7599 174.3708 6 I 4.5853 8.1030 127.4425 59.4874 40.2554 174.5185 7 M 4.6648 8.2448 125.7870 53.5006 35.4311 174.2037 8 I 4.3926 8.4426 128.3655 60.7212 38.4099 176.3618 9 K 4.4681 9.2814 127.7514 55.4454 33.3040 176.6407 10 P 5.0155 0.0000 0.0000 65.4985 31.1280 178.7369 11 D 4.4901 8.2101 117.0925 56.1927 39.2360 178.6862 12 G 3.5445 8.0433 107.5638 47.6980 0.0000 176.0872 13 V 3.7581 7.5960 121.2113 64.2555 31.4853 178.3763 14 Q 4.0330 8.0643 118.2856 58.5213 28.6605 177.8131 15 R 4.2662 7.7334 115.9438 55.2696 31.0974 176.1661 16 G 3.7811 7.6265 106.5150 47.4804 0.0000 174.9264 17 L 4.4271 7.6962 115.4152 54.0883 42.4296 178.2409 18 V 3.6349 7.6358 120.0964 66.0346 31.4652 177.8507 19 G 3.7536 8.0635 104.6973 48.3460 0.0000 175.1223 20 T 3.9118 7.8872 118.2451 66.2318 68.5479 176.3985 21 I 3.7855 7.8888 121.4887 64.5321 37.1294 178.3674 22 I 3.9445 7.9222 120.4659 64.6054 36.9893 178.2303 23 K 3.9740 8.5231 120.6482 59.6669 31.6479 178.5817 24 R 3.8446 8.1570 118.8510 59.5439 29.5114 178.6052 25 F 3.7266 7.9808 117.0407 60.2005 38.7493 177.6829 26 E 4.3533 8.7243 118.7610 59.5463 29.1404 179.5106 27 K 4.1611 8.1501 117.0397 58.5874 32.2164 178.8049 28 K 4.0154 7.3953 117.6370 57.4590 32.0476 177.3926 29 G 3.9326 7.9220 106.8357 45.8110 0.0000 172.8472 30 Y 5.0808 7.2834 115.3439 56.7454 40.0661 175.0973 31 K 4.6757 9.1959 122.8501 54.5561 34.3083 174.9541 32 L 3.5808 8.7829 131.0361 54.7782 42.0630 176.1828 33 I 4.7890 8.3443 118.6307 60.7969 40.2051 175.0771 34 A 4.6676 7.2469 123.9020 50.7414 22.3799 174.8995 35 I 5.1988 8.0384 121.4827 59.6887 41.3311 173.9337 36 K 4.7195 9.2590 126.2890 56.1466 36.2358 173.8115 37 M 5.2881 8.5980 122.2518 53.9269 34.0320 174.6398 38 L 4.6157 8.6414 124.4348 54.8575 44.7123 174.3951 39 N 5.0865 8.6419 118.3877 51.0371 39.0118 173.3699 40 P 4.2771 0.0000 0.0000 62.1923 32.0821 177.0591 41 T 3.8247 8.4450 113.7305 61.8826 69.6956 174.5569 42 E 3.9751 8.8597 126.0626 59.6245 29.3633 179.1704 43 E 3.9158 8.0514 116.2998 59.8328 29.7326 179.2417 44 I 3.7995 7.3544 117.1732 63.3597 37.7819 177.5895 45 L 4.0061 8.7591 122.4873 57.2024 41.7416 178.5266 46 K 4.0689 7.7749 119.7220 59.6060 31.9852 178.2318 47 E 4.1631 8.0990 117.3776 58.6056 29.2923 178.2563 48 H 4.4025 8.0721 117.7467 58.2102 30.1635 174.8821 49 Y 4.6912 7.7341 120.0429 56.9338 39.0324 176.8313 50 K 3.9120 7.7041 121.1560 59.1267 32.2851 177.2561 51 E 4.1855 7.9709 117.5284 56.9745 30.2863 176.2289 52 L 4.4238 7.3559 116.7400 53.9625 42.6678 177.7394 53 S 4.0340 8.0225 114.7588 61.6946 62.6231 175.3437 54 D 4.7440 7.2380 119.7496 53.8332 38.7024 176.0462 55 Q 4.6589 7.4713 118.3746 53.6420 32.9818 172.3208 56 P 4.4738 0.0000 0.0000 65.6955 31.4329 177.3816 57 F 5.1420 8.0788 118.5802 56.0083 37.3651 174.3099 58 F 4.6630 8.4482 125.9438 58.9818 42.2221 177.5937 59 K 3.6702 7.9937 119.4229 59.0792 31.9138 178.9694 60 N 4.0480 7.7340 116.5155 55.6696 38.4039 177.1580 61 L 3.8394 7.3680 121.4533 58.0321 42.1832 178.7414 62 V 3.6777 6.8052 106.9711 62.2972 30.9248 176.7041 63 A 4.4086 7.0502 119.3353 54.1523 20.0580 178.6879 64 Y 3.7744 7.6629 115.8484 60.0265 39.0901 177.8457 65 I 4.0562 7.7081 121.0492 64.3867 37.4010 178.2046 66 S 4.3042 8.0034 113.9731 61.3585 62.6544 176.5309 67 K 4.1525 7.5355 120.8707 58.4831 32.3239 177.6559 68 G 3.8708 6.8569 105.7343 44.3855 0.0000 171.0782 69 P 4.6528 0.0000 0.0000 62.5061 33.2963 175.3598 70 V 4.8351 8.3194 120.4376 61.3432 35.6065 174.3259 71 V 4.3642 8.3918 127.1301 61.3057 32.8670 174.2320 72 A 4.4889 8.9583 131.2095 51.5911 20.3087 175.8971 73 M 5.3092 8.7131 119.6461 53.6820 37.3764 174.2936 74 V 4.9088 8.4583 121.0936 60.9903 34.6544 174.3395 75 W 5.2376 9.0163 127.1636 54.8371 32.5215 174.2068 76 E 5.0597 10.7202 123.9562 53.7917 32.4373 175.2723 77 G 4.8386 8.2942 114.6852 43.8578 0.0000 172.6240 78 V 3.5269 8.1794 120.2087 64.4922 32.2785 175.4468 79 D 4.6140 8.8562 125.8766 54.2952 39.7898 174.5469 80 M 3.6254 7.8860 119.9282 58.5557 32.7138 176.8141 81 V 3.5615 8.0357 118.3647 65.9960 31.7274 177.9921 82 K 3.9609 7.9563 118.8537 59.5496 32.1705 178.4322 83 Q 4.1354 8.1316 119.6853 58.9081 28.9714 178.3455 84 G 3.6568 8.3806 107.1455 47.9442 0.0000 175.6796 85 R 3.9383 8.0197 121.6313 58.6997 29.8095 178.4484 86 K 3.8895 8.1415 119.1944 59.6230 32.4917 178.5531 87 L 3.9974 8.2620 119.5661 57.4889 41.3509 179.7189 88 I 3.7908 7.8448 120.0235 64.9577 37.2895 175.5707 89 G 4.2216 8.2593 102.0471 44.6695 0.0000 172.4248 90 E 4.1701 8.3222 119.1742 56.0721 30.2995 177.2084 91 T 3.9230 8.5636 118.4491 66.5677 68.7398 174.5703 92 N 4.6160 8.0075 122.4872 51.9962 38.7879 173.6684 93 P 4.4643 0.0000 0.0000 64.3647 31.7777 177.6250 94 L 4.1028 7.9444 120.4143 57.7958 42.1518 177.5307 95 T 4.2411 7.5179 105.8601 62.1520 69.5792 174.8492 96 S 4.2841 7.7463 118.5100 57.7647 62.9598 173.0463 97 N 4.6121 8.5172 124.7961 52.9908 39.1196 174.7078 98 T 3.8800 8.0675 111.4099 62.8904 69.6231 173.4041 99 G 4.0765 9.0172 112.9623 46.3853 0.0000 175.2641 100 T 4.3280 7.4228 109.2871 60.7473 71.1211 175.7378 101 I 3.8881 8.3202 123.4118 65.0962 37.4139 179.2568 102 R 4.1731 8.3480 118.6829 58.7803 29.6578 178.8365 103 G 3.7560 8.0149 103.8934 46.2333 0.0000 174.7007 104 D 4.3541 7.6284 119.8343 54.9565 41.5139 177.1099 105 F 5.0194 8.0056 114.9806 56.9079 41.3404 174.7527 106 C 5.0509 7.8794 116.5641 57.8804 30.9471 173.3483 107 L 4.5874 8.5371 119.6381 55.3145 44.0977 176.8401 108 E 4.7600 7.7434 118.0802 53.7151 32.0428 176.9150 109 V 3.7721 8.4286 124.6751 64.4863 31.7455 177.6675 110 S 4.3076 8.1149 114.5308 60.1838 63.2722 174.2878 111 K 4.5012 7.6694 120.2163 53.9137 31.6106 175.3076 112 N 4.9452 8.0676 120.4530 52.1389 38.3663 178.8654 113 V 3.3044 8.9614 115.5225 63.8588 31.7123 172.6813 114 I 5.1408 8.8020 117.1263 59.4207 41.4401 173.9896 115 H 5.0370 9.4395 126.9815 54.3538 32.4753 173.1616 116 G 4.4123 8.1447 110.4769 44.0003 0.0000 172.4541 117 S 4.5678 8.2371 118.4904 58.7352 62.8538 174.5827 118 D 4.5748 8.9455 123.3940 55.2234 40.1876 176.7032 119 S 4.7108 7.5522 113.8334 55.5244 67.5942 174.9501 120 V 3.5713 8.4021 120.9137 66.2074 30.7633 177.8759 121 A 4.0387 7.9623 119.9711 55.3436 18.3294 179.6807 122 S 4.1438 8.1515 113.1502 61.3451 62.8245 176.7848 123 A 4.0905 8.2517 123.8432 55.4718 18.0045 179.3333 124 N 4.3889 8.2211 114.9008 56.5128 38.4505 177.9165 125 K 4.0408 7.8537 119.2616 59.5444 32.2939 179.3661 126 E 4.0452 8.3448 118.9126 59.2167 29.2746 179.3261 127 I 3.8461 8.2583 120.3843 64.6902 37.0231 178.1186 128 N 4.4015 7.7046 115.8260 56.3265 38.4395 177.1398 129 I 3.8365 7.4317 113.2349 63.0846 37.9583 177.6201 130 W 4.0593 7.7863 119.0561 56.7357 29.6004 176.4389 131 F 5.1438 7.9104 115.7226 55.3643 42.1425 174.8738 132 K 4.4138 9.5656 122.4317 55.3351 33.2749 178.1581 133 A 4.0133 8.7365 124.2044 55.5218 18.4109 179.8421 134 E 3.9812 8.2450 114.7950 59.2713 29.9495 177.8951 135 E 4.0889 8.0412 117.9457 59.1236 29.6402 177.1432 136 L 4.2426 7.5473 119.7817 54.9853 41.8835 177.1607 137 T 4.4402 8.8124 116.0460 60.8157 70.2707 174.3485 138 Q 4.7176 8.7137 124.5407 54.3284 29.8300 175.1501 139 W 5.2089 8.3421 120.1704 54.5361 31.2315 174.2657 140 K 4.0269 8.7202 122.0252 55.7234 31.9661 175.8616 141 H 4.5168 8.3831 127.1173 55.8121 29.8884 175.1895 142 H 4.3153 9.2265 127.8228 59.3702 30.0598 175.6739 143 M 4.3383 7.9911 117.2494 56.4522 32.6650 177.3878 144 K 3.7951 7.6280 119.5649 59.9213 31.9065 177.7697 145 E 3.7167 8.1346 118.5940 58.4470 29.4363 177.7764 146 W 4.7257 7.9642 115.6251 56.5198 29.5997 176.4987 147 I 4.3639 7.5817 119.7325 61.5644 39.0625 174.5376 148 C 4.9372 7.8717 116.8325 57.1030 31.0732 174.0650 149 S 4.2367 8.6469 114.0389 59.3531 62.2589 174.1762 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 4.38 0.00 1.98 2.04 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.64 0.00 2 E 8.53 3.95 0.00 2.20 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 2.39 2.42 0.00 3 K 8.89 5.03 0.00 1.68 1.70 0.00 1.76 0.00 0.00 1.63 0.00 0.00 3.04 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.61 7.81 4 S 9.03 4.81 0.00 3.87 3.66 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 5 F 8.85 5.27 0.00 3.30 3.06 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 6 I 8.10 4.59 1.64 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 0.93 0.59 0.58 0.00 0.00 7 M 8.24 4.66 0.00 1.57 0.82 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.25 0.00 8 I 8.44 4.39 1.82 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.76 0.90 0.00 0.00 9 K 9.28 4.47 0.00 1.70 1.84 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.82 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.41 7.81 10 P 0.00 5.02 0.00 2.22 2.19 0.00 3.90 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 2.35 2.08 0.00 11 D 8.21 4.49 0.00 2.85 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 12 G 8.04 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 V 7.60 3.76 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 1.00 0.00 0.00 0.93 0.00 0.00 14 Q 8.06 4.03 0.00 2.06 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.97 0.00 0.00 0.00 0.00 0.00 2.48 2.60 0.00 15 R 7.73 4.27 0.00 1.90 1.90 0.00 3.29 0.00 0.00 3.46 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 16 G 7.63 3.78 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 0.00 0.00 0.00 17 L 7.70 4.43 0.00 1.49 1.26 0.65 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.64 3.63 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 1.06 0.00 0.00 0.91 0.00 0.00 19 G 8.06 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 T 7.89 3.91 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 1.23 0.00 0.00 21 I 7.89 3.79 2.12 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 1.60 0.91 1.00 0.00 0.00 22 I 7.92 3.94 2.12 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.85 1.24 0.00 0.00 23 K 8.52 3.97 0.00 1.93 2.04 0.00 1.68 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.52 7.81 24 R 8.16 3.84 0.00 2.18 1.92 0.00 3.20 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.62 0.00 25 F 7.98 3.73 0.00 2.48 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 26 E 8.72 4.35 0.00 2.28 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.96 0.00 27 K 8.15 4.16 0.00 1.78 1.86 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.52 1.61 7.81 28 K 7.40 4.02 0.00 1.71 1.40 0.00 1.51 0.00 0.00 1.27 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.25 1.36 7.81 29 G 7.92 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 Y 7.28 5.08 0.00 3.28 3.19 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 31 K 9.20 4.68 0.00 1.79 1.78 0.00 0.61 0.00 0.00 1.09 0.00 0.00 2.49 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.97 0.69 7.81 32 L 8.78 3.58 0.00 0.27 1.22 -0.08 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 33 I 8.34 4.79 1.96 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 1.14 0.95 0.00 0.00 34 A 7.25 4.67 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 I 8.04 5.20 1.70 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 1.41 0.91 0.84 0.00 0.00 36 K 9.26 4.72 0.00 1.97 2.13 0.00 1.36 0.00 0.00 1.81 0.00 0.00 2.21 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.45 1.47 7.81 37 M 8.60 5.29 0.00 2.05 1.99 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.52 0.00 38 L 8.64 4.62 0.00 1.78 1.75 0.90 0.72 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 39 N 8.64 5.09 0.00 2.61 2.99 0.00 0.00 6.97 8.02 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 40 P 0.00 4.28 0.00 2.22 2.36 0.00 3.97 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.13 0.00 41 T 8.45 3.82 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 1.15 0.00 0.00 42 E 8.86 3.98 0.00 1.98 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 2.39 0.00 43 E 8.05 3.92 0.00 1.87 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 2.29 2.38 0.00 44 I 7.35 3.80 1.64 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 1.34 0.19 0.44 0.00 0.00 45 L 8.76 4.01 0.00 1.60 1.83 0.93 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 46 K 7.77 4.07 0.00 2.21 1.90 0.00 1.74 0.00 0.00 1.74 0.00 0.00 3.08 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.66 1.64 7.81 47 E 8.10 4.16 0.00 1.97 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 2.40 2.26 0.00 48 H 8.07 4.40 0.00 3.36 3.72 0.00 5.90 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 Y 7.73 4.69 0.00 3.17 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 K 7.70 3.91 0.00 1.82 1.84 0.00 1.84 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.41 7.81 51 E 7.97 4.19 0.00 1.91 1.85 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 2.21 2.24 0.00 52 L 7.36 4.42 0.00 0.59 0.38 0.81 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 53 S 8.02 4.03 0.00 3.60 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 54 D 7.24 4.74 0.00 2.76 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 55 Q 7.47 4.66 0.00 2.34 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.99 0.00 0.00 0.00 0.00 0.00 2.49 2.59 0.00 56 P 0.00 4.47 0.00 2.09 2.13 0.00 3.81 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 2.04 2.16 0.00 57 F 8.08 5.14 0.00 2.94 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 58 F 8.45 4.66 0.00 3.20 3.09 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 59 K 7.99 3.67 0.00 1.84 1.77 0.00 1.74 0.00 0.00 1.76 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.56 7.81 60 N 7.73 4.05 0.00 2.01 2.43 0.00 0.00 6.81 6.74 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 61 L 7.37 3.84 0.00 1.48 1.35 0.83 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 62 V 6.81 3.68 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 0.36 0.00 0.00 0.58 0.00 0.00 63 A 7.05 4.41 1.27 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 0.00 0.00 0.00 0.00 0.00 0.00 64 Y 7.66 3.77 0.00 3.12 2.91 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 65 I 7.71 4.06 2.05 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.74 1.00 0.00 0.00 66 S 8.00 4.30 0.00 3.79 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 67 K 7.54 4.15 0.00 1.78 1.71 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.39 1.49 7.81 68 G 6.86 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 0.00 0.00 0.00 69 P 0.00 4.65 0.00 2.14 2.19 0.00 3.66 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 2.08 1.97 0.00 70 V 8.32 4.84 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 0.86 0.00 0.00 1.01 0.00 0.00 71 V 8.39 4.36 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 0.89 0.00 0.00 0.93 0.00 0.00 72 A 8.96 4.49 1.27 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 0.00 0.00 0.00 0.00 0.00 0.00 73 M 8.71 5.31 0.00 1.80 2.04 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.39 0.00 74 V 8.46 4.91 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 0.97 0.00 0.00 0.87 0.00 0.00 75 W 9.02 5.24 0.00 3.18 3.06 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 76 E 10.72 5.06 0.00 1.94 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 2.18 2.21 0.00 77 G 8.29 4.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 V 8.18 3.53 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 0.84 0.00 0.00 0.98 0.00 0.00 79 D 8.86 4.61 0.00 2.96 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 80 M 7.89 3.63 0.00 2.14 2.13 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.73 0.00 81 V 8.04 3.56 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 0.96 0.00 0.00 0.99 0.00 0.00 82 K 7.96 3.96 0.00 1.88 2.05 0.00 1.81 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.52 1.45 7.81 83 Q 8.13 4.14 0.00 2.67 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.48 2.46 0.00 84 G 8.38 3.66 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 85 R 8.02 3.94 0.00 2.10 1.95 0.00 3.17 0.00 0.00 3.18 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 86 K 8.14 3.89 0.00 1.97 1.86 0.00 1.83 0.00 0.00 1.67 0.00 0.00 3.18 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.62 7.81 87 L 8.26 4.00 0.00 1.67 1.33 -0.40 0.53 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 88 I 7.84 3.79 2.09 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 1.54 0.79 0.94 0.00 0.00 89 G 8.26 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 0.00 0.00 0.00 0.00 90 E 8.32 4.17 0.00 1.92 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 2.30 2.41 0.00 91 T 8.56 3.92 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 1.27 0.00 0.00 92 N 8.01 4.62 0.00 2.77 2.72 0.00 0.00 7.10 7.71 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 93 P 0.00 4.46 0.00 2.12 2.36 0.00 3.74 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 2.05 2.10 0.00 94 L 7.94 4.10 0.00 1.58 1.69 0.92 0.99 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 95 T 7.52 4.24 4.24 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 1.21 0.00 0.00 96 S 7.75 4.28 0.00 3.99 3.76 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 97 N 8.52 4.61 0.00 2.76 2.69 0.00 0.00 6.90 7.05 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 98 T 8.07 3.88 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 1.14 0.00 0.00 99 G 9.02 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 0.00 100 T 7.42 4.33 4.35 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 1.26 0.00 0.00 101 I 8.32 3.89 1.98 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 1.77 1.01 1.11 0.00 0.00 102 R 8.35 4.17 0.00 2.02 2.00 0.00 3.35 0.00 0.00 3.21 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.70 0.00 103 G 8.01 3.76 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 0.00 0.00 0.00 104 D 7.63 4.35 0.00 1.78 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 F 8.01 5.02 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 0.00 106 C 7.88 5.05 0.00 3.13 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 0.00 107 L 8.54 4.59 0.00 1.59 1.66 0.93 0.82 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 0.00 108 E 7.74 4.76 0.00 2.00 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 2.27 2.33 0.00 109 V 8.43 3.77 2.12 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 0.84 0.00 0.00 0.99 0.00 0.00 110 S 8.11 4.31 0.00 3.93 4.11 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 0.00 111 K 7.67 4.50 0.00 1.70 1.82 0.00 1.53 0.00 0.00 1.78 0.00 0.00 2.52 0.00 0.00 2.56 0.00 0.00 0.00 0.00 1.17 1.32 7.81 112 N 8.07 4.95 0.00 2.90 3.01 0.00 0.00 6.19 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 0.00 113 V 8.96 3.30 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 0.79 0.00 0.00 0.98 0.00 0.00 114 I 8.80 5.14 1.88 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.00 1.00 0.00 0.00 115 H 9.44 5.04 0.00 3.27 3.03 0.00 5.77 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 0.00 116 G 8.14 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 S 8.24 4.57 0.00 3.90 3.92 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 0.00 0.00 0.00 118 D 8.95 4.57 0.00 2.81 2.83 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 0.00 0.00 0.00 119 S 7.55 4.71 0.00 4.19 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 0.00 120 V 8.40 3.57 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 1.06 0.00 0.00 0.95 0.00 0.00 121 A 7.96 4.04 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 0.00 122 S 8.15 4.14 0.00 4.10 3.99 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 0.00 123 A 8.25 4.09 1.51 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 0.00 0.00 124 N 8.22 4.39 0.00 2.80 2.92 0.00 0.00 7.14 7.25 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 0.00 125 K 7.85 4.04 0.00 2.00 1.88 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.49 7.81 126 E 8.34 4.05 0.00 2.29 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 2.46 2.54 0.00 127 I 8.26 3.85 1.96 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.88 1.02 0.00 0.00 128 N 7.70 4.40 0.00 2.94 2.89 0.00 0.00 7.15 7.21 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 0.00 129 I 7.43 3.84 1.67 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.25 0.91 0.00 0.00 130 W 7.79 4.06 0.00 2.97 2.81 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 0.00 131 F 7.91 5.14 0.00 3.20 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 0.00 132 K 9.57 4.41 0.00 2.10 1.78 0.00 1.71 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.40 7.81 133 A 8.74 4.01 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 0.00 134 E 8.25 3.98 0.00 1.94 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 2.32 2.43 0.00 135 E 8.04 4.09 0.00 2.42 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 2.57 2.41 0.00 136 L 7.55 4.24 0.00 1.48 1.60 0.92 0.66 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 0.00 137 T 8.81 4.44 4.27 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 0.00 0.00 0.00 1.28 0.00 0.00 138 Q 8.71 4.72 0.00 2.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.77 0.00 0.00 0.00 0.00 0.00 2.32 2.36 0.00 139 W 8.34 5.21 0.00 3.48 2.91 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 0.00 140 K 8.72 4.03 0.00 1.79 1.87 0.00 1.81 0.00 0.00 1.68 0.00 0.00 2.83 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.43 1.43 7.81 141 H 8.38 4.52 0.00 2.66 3.01 0.00 5.75 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 H 9.23 4.32 0.00 3.24 3.48 0.00 5.97 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 M 7.99 4.34 0.00 2.07 2.11 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.66 0.00 144 K 7.63 3.80 0.00 1.94 1.73 0.00 1.62 0.00 0.00 1.61 0.00 0.00 3.04 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.48 7.81 145 E 8.13 3.72 0.00 1.82 1.46 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 1.92 2.23 0.00 146 W 7.96 4.73 0.00 3.38 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 0.00 147 I 7.58 4.36 1.87 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.74 0.88 0.00 0.00 148 C 7.87 4.94 0.00 3.05 2.82 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 0.00 149 S 8.65 4.24 0.00 3.93 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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