NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 20 G 3.9789 8.3393 109.7448 45.8696 0.0000 173.9386 21 I 3.9818 7.6333 111.1236 60.5766 37.8360 176.4341 22 F 4.4353 7.9301 120.8190 60.1341 39.5612 178.7343 23 F 4.2412 8.1950 119.9263 60.9562 39.5710 175.4229 24 P 3.9674 0.0000 0.0000 65.0241 30.7706 178.5718 25 A 3.9212 7.2750 117.8916 55.1950 18.4603 179.3479 26 L 4.1979 7.2823 114.5497 57.3838 41.8390 178.9166 27 E 4.2657 7.9890 118.9788 58.2531 29.6658 177.4397 28 Q 4.6057 7.6558 116.6672 55.3582 29.5572 174.8739 29 N 4.7539 7.9816 115.9955 52.3644 40.1579 174.7628 30 M 4.1586 8.5412 122.1261 58.2600 31.6633 176.6699 31 M 4.3687 7.6279 117.8990 54.3322 33.1539 177.1146 32 G 3.8164 8.4705 109.5842 46.6825 0.0000 172.6351 33 A 4.8488 8.3169 122.0686 50.6380 22.2092 175.2855 34 V 4.6667 8.4623 122.2998 60.5326 33.0268 173.6433 35 L 4.9539 8.6188 129.0100 54.2509 43.7075 174.9920 36 I 5.3100 8.6396 118.2569 59.3372 41.5378 175.3753 37 N 3.5946 8.3736 121.8677 50.9980 39.5714 175.0537 38 E 3.8390 8.2218 114.9542 59.5114 29.3150 177.1063 39 N 4.7760 8.0607 114.7943 53.0384 39.2699 174.2698 40 D 4.4449 7.8347 114.9945 55.2835 39.4141 172.8602 41 E 4.7935 7.9556 118.0796 54.5271 31.1376 175.8632 42 V 3.9944 8.1601 123.5414 63.4132 31.3189 176.0306 43 M 4.4905 8.7219 127.8703 56.6826 32.7894 176.6879 44 F 5.1375 8.1446 120.3338 56.9180 43.4000 173.5773 45 F 4.8777 8.1906 127.4822 57.6121 40.2253 173.0804 46 N 4.4219 7.3757 122.9988 51.0702 38.9650 174.5564 47 P 4.3836 0.0000 0.0000 65.2385 30.8369 178.8595 48 A 4.0296 7.8126 119.5620 54.9353 18.3279 179.1853 49 A 4.1261 7.7628 118.7502 54.6496 18.1794 179.6947 50 E 4.9178 7.5118 118.8800 59.1345 29.2919 179.4357 51 K 4.0991 7.5634 116.3905 59.0278 32.2559 179.1527 52 L 4.0177 7.5322 117.5982 56.8620 41.9641 178.5619 53 W 4.7159 8.4282 116.9134 55.6575 29.6099 177.8226 54 G 3.9334 7.8734 106.4609 45.9977 0.0000 172.7287 55 Y 4.8502 7.7774 116.7555 55.6585 40.2288 175.8250 56 K 4.7030 8.4322 122.1112 55.8860 33.0896 178.5676 57 R 4.0893 8.6126 118.0247 59.2276 29.1046 179.0192 58 E 4.0074 8.1081 118.6922 59.3323 29.6122 178.4668 59 E 4.0391 7.8428 117.5500 58.3310 29.4211 177.8974 60 V 3.6131 7.2248 117.6618 63.7127 32.6885 175.8339 61 I 4.0991 7.1213 120.9533 62.3823 37.3205 174.4037 62 G 4.0871 8.6801 113.1118 45.8392 0.0000 173.7275 63 N 4.5638 7.4118 115.2395 51.8644 38.1875 173.9762 64 N 4.9311 8.1547 117.7404 53.2175 39.9738 175.4349 65 I 3.7358 8.1667 120.9489 63.1502 38.5857 177.5278 66 D 4.4556 7.6224 120.6173 57.8412 40.8631 179.0865 67 M 4.0462 7.8415 114.5782 58.1387 31.2404 177.4194 68 L 4.0264 7.4425 117.4345 56.0545 42.0584 177.1459 69 I 4.2177 7.1167 119.7013 59.4169 38.3289 174.1383 70 P 4.4426 0.0000 0.0000 62.8200 31.5185 177.8483 71 R 4.0238 8.5089 120.0084 59.1924 30.1574 178.9289 72 D 4.4506 8.0566 116.0074 54.9986 39.8696 176.4905 73 L 4.5290 7.5757 120.3914 54.5823 42.5686 177.5985 74 R 3.9409 7.6854 117.5195 59.5901 30.1134 176.1364 75 P 4.3652 0.0000 0.0000 65.2298 31.2463 178.0500 76 A 4.3163 7.9850 119.4453 54.7249 18.5441 178.9358 77 H 4.3216 8.1210 117.3239 59.0160 29.8071 175.6748 78 P 4.2221 0.0000 0.0000 65.4584 31.2344 178.0431 79 E 3.9894 7.9772 117.1511 59.1337 28.9788 178.3482 80 Y 3.9819 7.8850 117.1953 60.7913 37.7507 178.2977 81 I 3.6468 7.6250 120.5255 64.2296 37.2306 178.2222 82 R 3.9383 7.8049 119.5384 59.6001 29.3396 178.0725 83 H 4.2081 8.1770 117.8687 59.0068 29.3523 176.7830 84 N 4.4307 7.9893 118.1959 56.4286 38.5235 177.2563 85 R 3.9190 7.7228 118.9012 59.2681 30.3251 178.5214 86 E 4.2517 7.9033 117.1330 58.4911 29.4980 179.3521 87 G 3.6658 7.4324 104.8956 47.4175 0.0000 173.7284 88 G 4.1378 8.0375 107.9143 44.7393 0.0000 174.0531 89 K 3.8174 7.7720 116.3527 57.1409 32.8999 176.2027 90 A 4.1153 8.6628 125.7350 55.2272 18.8304 178.0339 91 R 4.1414 7.7851 113.7137 55.7817 30.8433 176.3651 92 V 4.1529 8.3635 122.7310 61.9500 31.9820 175.3437 93 E 4.3151 8.8173 126.8410 57.4279 30.1579 176.9133 94 G 3.7846 7.9506 107.1729 45.4875 0.0000 172.5872 95 M 3.1543 8.2713 116.2860 56.3149 29.2699 177.9463 96 S 4.4110 8.0309 113.1063 59.8761 64.6179 174.8118 97 R 4.5386 7.4912 118.2056 53.6811 32.1288 175.1765 98 E 4.6194 8.4144 117.8524 56.7676 29.8767 177.0943 99 L 5.0664 8.6522 121.5496 53.1130 46.7074 175.5768 100 Q 3.9029 8.6731 123.4553 54.6819 29.0915 174.8887 101 L 4.1834 8.1546 129.5674 54.7466 43.5741 174.9296 102 E 4.7314 8.6198 126.1897 54.4402 31.7140 176.0045 103 K 4.5996 8.3995 126.5768 55.2316 33.7582 177.8354 104 K 3.7960 7.9788 120.4013 59.7247 31.8043 177.8012 105 D 4.3925 7.7789 115.5951 54.1940 39.6392 176.6813 106 G 3.9957 7.6055 107.2779 45.4489 0.0000 174.1712 107 S 4.3709 7.7415 113.6616 58.0840 63.7578 172.9330 108 K 5.0188 8.1204 119.2137 54.5312 35.4328 175.9772 109 I 4.5252 7.9271 117.0916 58.7748 41.4648 174.3982 110 W 5.0412 8.5141 122.8896 56.3320 31.1993 175.4746 111 T 5.3193 8.6643 112.4612 60.7105 72.7249 172.1338 112 R 4.7647 8.5462 120.5951 54.9690 33.1439 173.6942 113 F 4.8882 9.2813 124.6222 56.0221 41.6025 175.8886 114 A 4.7307 8.6552 124.1363 49.9350 19.3346 174.1814 115 L 4.7700 8.3272 121.8882 54.9398 43.9318 175.9601 116 S 4.7725 8.7028 120.5254 56.8383 67.3988 173.2095 117 K 4.3526 8.9061 126.5335 56.2249 33.0860 176.3300 118 V 4.1494 8.1035 126.6981 60.9402 34.0216 174.5049 119 S 4.7732 8.7143 123.4280 57.8684 61.9376 172.6451 120 A 4.4891 8.2125 129.5482 51.2221 21.6401 175.9807 121 E 3.5649 9.4801 120.9722 57.5073 26.7485 174.9852 122 G 3.9118 8.6750 103.7592 46.2258 0.0000 173.8061 123 K 4.6419 7.7958 118.2870 54.7025 36.5027 174.7355 124 V 4.3959 8.1179 119.2803 61.8153 33.0076 174.1734 125 Y 4.9283 8.2064 123.6526 55.5423 42.8060 174.0170 126 Y 5.0603 8.4467 116.7006 57.1900 42.1924 174.0094 127 L 5.1451 9.0206 127.1853 53.4701 43.8919 174.9339 128 A 5.0080 8.6652 129.3630 50.4655 20.8077 175.2852 129 L 4.8420 8.2815 121.8305 54.9183 43.1614 176.6779 130 V 4.5601 8.4785 123.5108 60.0607 34.8674 174.2796 131 R 4.8853 7.8187 120.4082 54.6642 33.6173 172.9073 132 D 4.7457 8.5718 119.2762 53.0228 41.8218 176.1894 133 A 4.8399 8.1843 130.7265 51.5836 19.2776 176.5717 134 S 4.3376 7.7077 120.6652 60.1882 62.9120 174.7707 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 20 G 8.34 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 21 I 7.63 3.98 1.62 0.00 0.00 -0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.38 0.79 0.00 0.00 22 F 7.93 4.44 0.00 3.13 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 23 F 8.20 4.24 0.00 3.00 3.07 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 24 P 0.00 3.97 0.00 2.13 2.04 0.00 3.79 0.00 0.00 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.26 0.00 25 A 7.27 3.92 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 26 L 7.28 4.20 0.00 1.60 1.95 0.87 0.97 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 27 E 7.99 4.27 0.00 1.33 1.57 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 2.03 2.25 0.00 28 Q 7.66 4.61 0.00 2.12 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.52 0.00 0.00 0.00 0.00 0.00 2.24 2.24 0.00 29 N 7.98 4.75 0.00 2.93 2.89 0.00 0.00 7.24 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 M 8.54 4.16 0.00 2.14 2.16 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.54 0.00 31 M 7.63 4.37 0.00 2.00 2.14 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.45 0.00 32 G 8.47 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 33 A 8.32 4.85 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 V 8.46 4.67 2.27 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 1.23 0.00 0.00 0.94 0.00 0.00 35 L 8.62 4.95 0.00 2.11 1.82 1.12 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 36 I 8.64 5.31 1.92 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 1.67 1.29 0.98 0.00 0.00 37 N 8.37 3.59 0.00 2.54 2.84 0.00 0.00 6.76 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 38 E 8.22 3.84 0.00 2.01 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.24 0.00 39 N 8.06 4.78 0.00 2.77 2.83 0.00 0.00 6.96 8.06 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 40 D 7.83 4.44 0.00 3.02 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 41 E 7.96 4.79 0.00 2.20 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 2.32 2.37 0.00 42 V 8.16 3.99 2.15 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 1.02 0.00 0.00 0.80 0.00 0.00 43 M 8.72 4.49 0.00 2.13 2.33 0.00 0.00 0.00 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.93 0.00 44 F 8.14 5.14 0.00 3.10 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 45 F 8.19 4.88 0.00 2.86 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 46 N 7.38 4.42 0.00 2.83 2.46 0.00 0.00 6.14 7.76 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 47 P 0.00 4.38 0.00 2.14 2.13 0.00 3.68 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 2.09 2.14 0.00 48 A 7.81 4.03 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 A 7.76 4.13 0.65 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 0.00 0.00 50 E 7.51 4.92 0.00 2.27 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.47 0.00 51 K 7.56 4.10 0.00 1.77 1.85 0.00 1.68 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.59 7.81 52 L 7.53 4.02 0.00 1.52 1.25 0.74 0.68 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 53 W 8.43 4.72 0.00 4.06 3.47 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 54 G 7.87 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 55 Y 7.78 4.85 0.00 3.15 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 56 K 8.43 4.70 0.00 1.91 1.79 0.00 1.73 0.00 0.00 1.78 0.00 0.00 3.01 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.53 1.57 7.81 57 R 8.61 4.09 0.00 2.17 2.59 0.00 2.85 0.00 0.00 3.26 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.73 0.00 58 E 8.11 4.01 0.00 1.96 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 2.33 2.48 0.00 59 E 7.84 4.04 0.00 2.01 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 2.36 2.34 0.00 60 V 7.22 3.61 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 0.26 0.00 0.00 -0.03 0.00 0.00 61 I 7.12 4.10 1.86 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 1.38 0.96 0.94 0.00 0.00 62 G 8.68 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 0.00 0.00 0.00 63 N 7.41 4.56 0.00 2.65 2.64 0.00 0.00 6.60 6.80 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 64 N 8.15 4.93 0.00 2.75 2.63 0.00 0.00 6.51 7.82 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 65 I 8.17 3.74 2.01 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.16 0.91 0.00 0.00 66 D 7.62 4.46 0.00 2.80 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 67 M 7.84 4.05 0.00 1.90 1.90 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.21 0.00 68 L 7.44 4.03 0.00 1.58 1.20 0.42 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 69 I 7.12 4.22 1.97 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.82 0.81 0.00 0.00 70 P 0.00 4.44 0.00 2.28 1.95 0.00 3.55 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 2.06 2.17 0.00 71 R 8.51 4.02 0.00 1.90 1.99 0.00 3.15 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 1.67 1.76 0.00 72 D 8.06 4.45 0.00 2.78 2.79 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 0.00 0.00 0.00 73 L 7.58 4.53 0.00 1.73 1.59 0.88 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 74 R 7.69 3.94 0.00 2.06 1.96 0.00 3.55 0.00 0.00 3.47 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 75 P 0.00 4.37 0.00 2.10 2.11 0.00 3.69 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.09 0.00 76 A 7.98 4.32 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 8.12 4.32 0.00 3.33 3.33 0.00 5.62 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 P 0.00 4.22 0.00 2.20 2.09 0.00 3.80 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.16 0.00 79 E 7.98 3.99 0.00 2.07 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 2.17 2.15 0.00 80 Y 7.88 3.98 0.00 3.09 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 7.62 3.65 1.78 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 1.22 1.29 0.84 0.00 0.00 82 R 7.80 3.94 0.00 1.96 1.91 0.00 3.08 0.00 0.00 3.08 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 83 H 8.18 4.21 0.00 3.24 3.41 0.00 5.64 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 N 7.99 4.43 0.00 3.00 2.99 0.00 0.00 7.15 7.53 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 85 R 7.72 3.92 0.00 1.99 2.02 0.00 3.28 0.00 0.00 3.28 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 2.05 0.00 86 E 7.90 4.25 0.00 1.88 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.48 0.00 87 G 7.43 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 0.00 0.00 0.00 88 G 8.04 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 89 K 7.77 3.82 0.00 1.90 1.90 0.00 1.60 0.00 0.00 1.86 0.00 0.00 2.81 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.48 1.48 7.81 90 A 8.66 4.12 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 R 7.79 4.14 0.00 1.85 1.92 0.00 3.39 0.00 0.00 3.19 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.58 0.00 92 V 8.36 4.15 2.36 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 0.92 0.00 0.00 1.15 0.00 0.00 93 E 8.82 4.32 0.00 2.04 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 2.30 2.34 0.00 94 G 7.95 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 95 M 8.27 3.15 0.00 2.15 2.15 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.36 0.00 96 S 8.03 4.41 0.00 4.00 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 R 7.49 4.54 0.00 1.82 1.91 0.00 3.40 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.57 0.00 98 E 8.41 4.62 0.00 1.75 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.49 0.00 99 L 8.65 5.07 0.00 1.59 1.46 0.73 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 100 Q 8.67 3.90 0.00 1.31 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.96 0.00 0.00 0.00 0.00 0.00 1.63 1.16 0.00 101 L 8.15 4.18 0.00 1.65 1.26 -0.29 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 102 E 8.62 4.73 0.00 1.96 1.87 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 2.22 2.28 0.00 103 K 8.40 4.60 0.00 1.96 1.68 0.00 1.64 0.00 0.00 1.51 0.00 0.00 2.80 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.55 1.27 7.81 104 K 7.98 3.80 0.00 0.79 1.44 0.00 1.40 0.00 0.00 1.55 0.00 0.00 3.02 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.28 1.08 7.81 105 D 7.78 4.39 0.00 2.78 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 0.00 106 G 7.61 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 0.00 0.00 0.00 107 S 7.74 4.37 0.00 3.99 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 0.00 108 K 8.12 5.02 0.00 1.40 1.32 0.00 1.55 0.00 0.00 1.53 0.00 0.00 3.00 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.28 1.28 7.81 109 I 7.93 4.53 1.79 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 1.06 0.60 0.83 0.00 0.00 110 W 8.51 5.04 0.00 3.35 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 T 8.66 5.32 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 1.10 0.00 0.00 112 R 8.55 4.76 0.00 1.90 1.77 0.00 3.18 0.00 0.00 3.26 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.67 0.00 113 F 9.28 4.89 0.00 2.94 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 0.00 114 A 8.66 4.73 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 0.00 115 L 8.33 4.77 0.00 1.82 1.69 1.17 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 116 S 8.70 4.77 0.00 3.83 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 0.00 117 K 8.91 4.35 0.00 1.84 1.84 0.00 1.79 0.00 0.00 1.57 0.00 0.00 2.79 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.26 0.99 7.81 118 V 8.10 4.15 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 0.77 0.00 0.00 1.00 0.00 0.00 119 S 8.71 4.77 0.00 3.90 3.77 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.21 4.49 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.48 3.56 0.00 2.22 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 0.00 2.09 2.15 0.00 122 G 8.67 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 0.00 123 K 7.80 4.64 0.00 1.96 1.67 0.00 1.73 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.37 1.61 7.81 124 V 8.12 4.40 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.00 0.00 0.90 0.00 0.00 125 Y 8.21 4.93 0.00 2.97 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 0.00 126 Y 8.45 5.06 0.00 3.03 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 0.00 127 L 9.02 5.15 0.00 1.92 1.64 1.13 0.95 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 0.00 128 A 8.67 5.01 1.67 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 0.00 129 L 8.28 4.84 0.00 1.72 1.61 0.96 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 130 V 8.48 4.56 1.68 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 0.19 0.00 0.00 0.37 0.00 0.00 131 R 7.82 4.89 0.00 1.80 1.89 0.00 2.98 0.00 0.00 3.24 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.57 0.00 132 D 8.57 4.75 0.00 2.65 2.59 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 0.00 133 A 8.18 4.84 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 0.00 134 S 7.71 4.34 0.00 4.00 3.83 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