NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 N 4.7128 8.4249 118.1241 52.8735 39.4132 174.0328 3 T 3.4781 8.4736 120.7113 62.8682 68.8819 171.8752 4 K 4.3677 8.9926 128.3230 54.8599 34.5600 174.6133 5 Y 4.7209 8.7820 124.4377 56.5623 39.8701 176.0737 6 N 4.7227 8.5410 120.5196 52.7450 40.8319 176.5850 7 K 3.9113 8.5570 123.8731 59.8274 32.4408 179.2397 8 E 3.8943 8.1287 118.4531 59.0425 29.3543 178.8132 9 F 4.1860 8.2555 120.3600 61.4893 39.5227 177.0918 10 L 3.6322 8.0644 118.4686 57.3982 41.2166 179.4790 11 L 3.6204 7.7448 119.2062 57.8541 41.6116 178.8149 12 Y 3.9127 7.8411 119.2804 60.7531 38.7632 178.0535 13 L 3.9725 8.0685 121.1105 57.8777 42.0031 178.6113 14 A 4.1237 8.4440 121.4853 55.0517 18.3877 179.8049 15 G 3.4362 7.7458 103.9428 47.9667 0.0000 175.7173 16 F 3.7653 7.9978 123.5436 60.6319 39.3354 177.3998 17 V 3.6610 8.4964 118.3152 66.2645 31.2130 177.7070 18 D 4.3308 8.2137 117.3637 57.2619 40.6060 178.4490 19 A 4.0653 7.4896 120.4405 54.0629 18.9444 177.8820 20 D 4.5234 8.3532 114.3416 53.7999 41.8077 176.6107 21 G 4.2527 7.7207 107.5771 45.2572 0.0000 173.4486 22 S 4.6429 8.6544 113.7304 56.9779 66.1985 172.7571 23 I 4.8597 8.5555 128.0829 59.9883 38.6395 174.8521 24 I 4.5569 8.9533 129.1667 59.2874 39.5465 174.7234 25 A 5.2435 8.7171 128.5818 50.2400 21.2861 175.2125 26 Q 4.6847 9.4005 120.7664 54.0974 33.5251 174.2745 27 I 4.9091 8.4519 121.9054 59.5799 39.4817 174.7480 28 A 4.8221 9.0855 129.3850 49.1968 21.3950 173.8053 29 P 4.6646 0.0000 0.0000 63.1135 32.6434 175.9093 30 N 4.4180 9.1218 119.2879 53.2181 42.1161 175.4595 31 Q 4.0450 9.0582 126.5777 58.5525 29.0894 177.3796 32 S 4.3477 8.3326 110.8760 59.0565 63.8016 174.6163 33 S 4.3964 7.7361 118.4330 57.4585 63.7073 174.8852 34 K 3.4656 8.4536 124.5363 59.4236 31.5458 177.8483 35 F 4.7121 7.3257 115.0495 56.9853 39.0982 176.7977 36 K 4.1610 8.3333 118.2416 57.2594 30.0831 174.7222 37 H 5.6091 7.7750 113.4316 54.2879 33.1346 172.7379 38 R 4.9797 9.3264 117.0586 54.5864 33.0339 174.1417 39 L 5.2542 8.6230 119.1521 53.3896 43.9459 176.2492 40 K 4.7672 9.0218 120.9888 54.6507 36.0985 175.2431 41 L 5.3323 8.6709 123.4262 53.3464 45.0034 176.0790 42 T 4.8323 9.1251 120.0559 61.8199 72.8677 172.4909 43 F 5.2772 9.1646 128.8583 56.8085 41.3647 174.2294 44 Q 4.7765 8.4222 126.5148 54.1460 32.9305 173.7738 45 V 4.5266 8.6264 124.5411 61.4925 34.5257 174.1965 46 T 5.0186 8.2251 124.6178 62.4466 70.4121 174.0257 47 Q 4.5881 9.0876 124.9386 54.2207 33.2925 173.2910 48 K 4.1473 8.8746 125.4678 57.4589 32.6772 177.5696 49 T 3.9746 9.0273 123.5661 66.5755 68.7343 176.1400 50 Q 4.0146 8.2715 121.4760 58.7629 29.1236 177.3331 51 R 4.5827 8.2219 116.0064 55.8323 30.6248 178.0507 52 R 3.9475 8.2000 122.1384 59.2542 29.8195 177.9523 53 W 4.3727 8.4075 116.2407 59.7940 27.7822 177.9651 54 F 3.4383 6.9820 121.1707 60.7491 38.6847 177.2335 55 L 3.9668 7.7969 118.2257 57.7209 41.3650 178.9402 56 D 4.4562 8.5152 119.3661 57.3677 40.7478 179.0135 57 K 3.9874 8.2201 119.0756 59.1804 31.9119 179.1405 58 L 3.8436 7.4901 120.7346 57.9180 41.8426 178.9878 59 V 3.6973 7.7230 118.1984 66.2600 31.2050 177.4650 60 D 4.3033 7.5942 116.1769 57.4732 41.1312 177.8189 61 E 3.9070 7.9572 117.9362 59.3861 29.5250 179.0280 62 I 3.9946 7.8660 119.1091 61.9140 37.3058 177.4429 63 G 4.0160 9.8772 106.8413 45.1465 0.0000 172.9172 64 V 4.2470 7.5959 116.5207 61.5072 33.6303 173.3495 65 G 3.7349 10.7575 107.2120 46.6146 0.0000 171.2800 66 Y 4.9003 7.1293 115.1283 56.1119 41.7404 173.6359 67 V 4.9575 8.5408 119.2227 61.2298 34.1720 174.7391 68 R 4.8094 9.1008 125.6096 54.4025 34.2501 174.5807 69 G 4.3167 8.7525 111.1458 44.3895 0.0000 174.2759 70 S 4.7913 8.8632 119.1076 57.1712 63.4538 175.7787 71 G 3.9028 8.3745 117.2126 46.6098 0.0000 175.7751 72 S 4.3899 9.2583 122.9810 60.1793 63.9970 174.4262 73 V 5.0344 7.2874 111.8340 59.5434 35.5555 174.8208 74 S 5.2574 9.2364 117.5961 57.0106 67.4554 172.9293 75 N 5.4129 9.0917 118.1785 51.7758 42.7783 173.2493 76 Y 4.5988 8.9847 125.2781 57.2648 40.4205 174.1197 77 I 4.4179 7.4318 126.7923 59.0737 41.3521 174.1521 78 L 4.6820 8.8361 127.8156 53.6585 44.2792 176.8441 79 S 4.5400 8.8453 121.1273 58.8117 65.7564 175.1402 80 E 4.0349 8.2263 120.9529 56.4921 30.3703 177.4117 81 I 3.7880 8.4441 127.2816 64.3943 37.3549 178.6361 82 K 4.0234 8.0149 118.7492 59.2042 32.0435 177.5158 83 P 4.3701 0.0000 0.0000 65.4248 31.1605 178.4097 84 L 4.0813 8.3573 119.4931 58.3913 41.9839 178.4386 85 H 4.0747 8.6553 118.5298 59.4032 29.4045 176.6808 86 N 4.3947 8.5128 118.8599 56.6068 38.7805 176.6777 87 F 4.4129 8.6057 122.0553 61.5447 39.6595 177.3290 88 L 3.5890 8.2687 118.8835 57.7002 41.0730 179.5215 89 T 3.7637 7.7302 115.3045 66.8922 68.4836 176.1773 90 Q 4.1756 7.5060 117.9124 58.4218 29.1630 177.9361 91 L 4.0400 7.6613 121.6473 57.8475 41.8906 178.5587 92 Q 3.8633 7.9254 119.6170 58.7138 28.6941 176.6429 93 P 4.0353 0.0000 0.0000 64.4281 31.3374 176.8790 94 F 4.7637 7.3911 114.3770 57.4048 39.8589 176.3200 95 L 4.2289 7.3797 121.3891 54.6870 42.0590 176.5506 96 K 4.4093 9.4244 121.6574 57.7209 33.9996 177.6844 97 L 4.2966 8.3000 116.3819 55.8209 42.4690 177.5144 98 K 4.9967 8.0625 115.5350 55.3281 32.9161 177.5603 99 Q 3.9059 8.1507 122.3094 59.3240 28.8516 178.4241 100 K 3.9151 7.9316 119.9750 59.4390 32.2980 178.4987 101 Q 3.9849 8.0949 117.6803 58.9642 28.6689 178.5930 102 A 3.9982 8.0678 121.5572 55.4664 18.4026 179.5488 103 N 4.2628 8.1844 114.8286 56.1237 38.5058 177.7816 104 L 3.8229 7.9657 120.7202 57.6382 41.6125 179.5811 105 V 3.6688 7.9384 118.2111 66.0134 31.4714 178.0762 106 L 3.9777 8.0688 118.7739 57.5761 41.5629 179.4019 107 K 3.8558 8.1568 119.6260 59.4762 31.8749 178.6499 108 I 4.0807 7.9986 119.2041 64.8030 37.4259 178.0580 109 I 3.9558 8.0898 120.4559 64.6568 36.7745 178.4878 110 E 4.1054 8.3036 117.9395 58.8021 29.5802 178.4020 111 Q 4.5196 7.9838 115.8836 55.8207 29.0410 177.3568 112 L 4.0740 7.7881 121.9497 57.4917 41.5103 177.3242 113 P 4.3528 0.0000 0.0000 66.0590 31.6409 178.5634 114 S 4.3048 8.1829 112.8959 61.4679 62.5448 176.4431 115 A 4.1556 8.0174 122.7735 54.6398 18.1961 178.9567 116 K 4.4280 7.7825 114.8961 57.6297 32.4986 177.6292 117 E 4.4417 8.1216 118.9804 57.8740 30.4741 177.4645 118 S 4.8629 7.8129 112.5726 55.0682 67.2263 173.1325 119 P 2.9700 0.0000 0.0000 65.7203 31.0200 178.6455 120 D 4.1864 7.8030 118.1803 56.9281 40.8604 178.4409 121 K 3.7978 7.9819 120.2014 59.2745 32.1413 178.5456 122 F 3.9393 8.3328 121.4206 61.2150 39.2220 176.8411 123 L 3.6942 7.9262 120.0286 57.9747 41.6022 178.6161 124 E 3.5635 7.4530 118.3844 59.0790 29.8713 178.6550 125 V 2.3636 7.0094 118.1418 65.5775 31.4541 177.6843 126 C 3.8638 7.5202 116.9490 62.8829 27.8896 176.2038 127 T 4.0797 7.5193 111.1736 64.4272 68.2295 176.6962 128 W 4.4605 7.7120 122.0714 59.4633 29.0361 178.6576 129 V 3.6299 7.6784 117.9903 66.0459 31.0825 177.4394 130 D 4.3918 8.1547 118.6713 57.6923 40.8182 178.8262 131 Q 4.0200 8.1669 119.8224 58.9832 29.0244 178.2755 132 I 3.6892 7.8782 120.7899 64.4479 37.0059 178.2549 133 A 4.0183 7.9003 119.8081 55.1290 18.2066 179.2566 134 A 4.0879 7.8845 118.6341 55.1378 18.4692 179.5290 135 L 4.1366 7.5573 116.6086 56.9291 41.9557 177.4038 136 N 4.6401 7.7853 115.3872 53.0451 39.7674 175.4889 137 D 4.6377 8.0980 120.2006 53.2722 39.4267 176.7008 138 S 4.3684 7.6030 114.2350 58.0673 63.5692 173.6791 139 K 4.6378 8.5695 123.8558 56.0467 34.4334 176.8783 140 T 4.6308 7.7720 107.1679 60.9693 69.3015 173.8162 141 R 4.1363 8.0173 121.4259 56.9264 30.8688 174.6269 142 K 4.3357 8.5389 122.8470 58.0907 34.0647 176.1296 143 T 4.3308 7.8464 114.9220 62.7767 69.3576 174.6378 144 T 4.7293 8.4796 116.9503 59.1093 73.1589 174.9087 145 S 4.0736 8.8458 115.4083 61.3381 62.6045 176.2387 146 E 3.8673 8.0242 122.8133 59.2855 29.2466 178.4973 147 T 3.8637 7.9587 115.4400 66.8481 68.3092 176.1928 148 V 3.5142 7.2928 117.8007 65.9970 31.6232 177.4670 149 R 3.9891 7.9732 116.9731 59.5410 29.9512 177.5979 150 A 4.1596 7.9246 119.1816 54.8152 19.7162 178.9813 151 V 3.9541 7.2217 116.5543 62.5861 29.9320 174.3604 152 L 3.8353 7.7076 124.0679 53.4642 41.8530 175.8813 153 D 4.7643 8.8072 120.4513 54.9455 40.8979 173.6588 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 2 N 8.42 4.71 0.00 2.73 3.02 0.00 0.00 6.95 6.65 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 3 T 8.47 3.48 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 4 K 8.99 4.37 0.00 1.60 1.60 0.00 1.82 0.00 0.00 1.70 0.00 0.00 3.10 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.32 1.48 7.81 5 Y 8.78 4.72 0.00 3.24 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 6 N 8.54 4.72 0.00 2.81 2.79 0.00 0.00 6.70 7.27 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 7 K 8.56 3.91 0.00 1.85 1.78 0.00 1.87 0.00 0.00 1.86 0.00 0.00 2.92 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.30 1.27 7.81 8 E 8.13 3.89 0.00 2.08 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 2.38 2.36 0.00 9 F 8.26 4.19 0.00 3.11 3.28 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 10 L 8.06 3.63 0.00 1.69 1.73 1.26 0.50 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 11 L 7.74 3.62 0.00 1.68 1.58 0.72 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 12 Y 7.84 3.91 0.00 3.12 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 13 L 8.07 3.97 0.00 1.32 1.26 1.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 14 A 8.44 4.12 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 0.00 0.00 0.00 0.00 0.00 15 G 7.75 3.44 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 0.00 16 F 8.00 3.77 0.00 2.90 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 V 8.50 3.66 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 1.23 0.00 0.00 1.41 0.00 0.00 18 D 8.21 4.33 0.00 2.85 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 A 7.49 4.07 1.04 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 0.00 0.00 20 D 8.35 4.52 0.00 1.95 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 G 7.72 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 0.00 0.00 0.00 0.00 22 S 8.65 4.64 0.00 3.79 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 I 8.56 4.86 1.95 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 1.69 0.94 1.00 0.00 0.00 24 I 8.95 4.56 1.89 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.80 0.92 0.00 0.00 25 A 8.72 5.24 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 26 Q 9.40 4.68 0.00 1.96 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.71 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 27 I 8.45 4.91 1.89 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 1.21 0.56 0.97 0.00 0.00 28 A 9.09 4.82 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 29 P 0.00 4.66 0.00 1.95 1.99 0.00 3.76 0.00 0.00 3.66 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 30 N 9.12 4.42 0.00 2.68 2.61 0.00 0.00 7.12 7.29 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 31 Q 9.06 4.04 0.00 2.06 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.80 0.00 0.00 0.00 0.00 0.00 2.34 2.27 0.00 32 S 8.33 4.35 0.00 3.94 3.95 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 33 S 7.74 4.40 0.00 3.90 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 34 K 8.45 3.47 0.00 1.30 1.09 0.00 1.34 0.00 0.00 0.82 0.00 0.00 2.66 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.30 0.96 7.81 35 F 7.33 4.71 0.00 2.25 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 K 8.33 4.16 0.00 1.90 1.82 0.00 1.75 0.00 0.00 1.74 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.54 7.81 37 H 7.77 5.61 0.00 3.31 3.37 0.00 5.79 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 R 9.33 4.98 0.00 1.93 2.05 0.00 2.86 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.84 0.00 39 L 8.62 5.25 0.00 1.64 1.67 0.84 0.69 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 40 K 9.02 4.77 0.00 1.70 1.69 0.00 1.64 0.00 0.00 1.69 0.00 0.00 2.86 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.43 7.81 41 L 8.67 5.33 0.00 1.55 1.62 1.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 42 T 9.13 4.83 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 1.18 0.00 0.00 43 F 9.16 5.28 0.00 3.29 3.15 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 0.00 44 Q 8.42 4.78 0.00 1.96 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.53 0.00 0.00 0.00 0.00 0.00 2.11 2.14 0.00 45 V 8.63 4.53 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 1.32 0.00 0.00 0.80 0.00 0.00 46 T 8.23 5.02 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 1.23 0.00 0.00 47 Q 9.09 4.59 0.00 2.18 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.86 0.00 0.00 0.00 0.00 0.00 2.10 2.29 0.00 48 K 8.87 4.15 0.00 1.87 1.70 0.00 1.78 0.00 0.00 1.83 0.00 0.00 2.85 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.54 1.52 7.81 49 T 9.03 3.97 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 1.25 0.00 0.00 50 Q 8.27 4.01 0.00 2.05 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 7.48 0.00 0.00 0.00 0.00 0.00 2.46 2.49 0.00 51 R 8.22 4.58 0.00 1.86 1.53 0.00 3.03 0.00 0.00 3.11 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.58 0.00 52 R 8.20 3.95 0.00 2.11 2.04 0.00 3.18 0.00 0.00 3.30 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.70 0.00 53 W 8.41 4.37 0.00 3.69 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 F 6.98 3.44 0.00 1.51 2.51 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 55 L 7.80 3.97 0.00 1.91 1.80 1.01 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 56 D 8.52 4.46 0.00 2.95 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 57 K 8.22 3.99 0.00 1.78 1.76 0.00 1.99 0.00 0.00 1.88 0.00 0.00 2.91 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.54 1.84 7.81 58 L 7.49 3.84 0.00 1.46 1.50 0.79 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 59 V 7.72 3.70 2.33 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 1.12 0.00 0.00 1.19 0.00 0.00 60 D 7.59 4.30 0.00 2.63 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 E 7.96 3.91 0.00 1.98 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 2.14 2.38 0.00 62 I 7.87 3.99 1.79 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.43 0.58 0.00 0.00 63 G 9.88 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 0.00 0.00 0.00 64 V 7.60 4.25 2.17 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 0.75 0.00 0.00 1.01 0.00 0.00 65 G 10.76 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 66 Y 7.13 4.90 0.00 3.09 3.03 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 67 V 8.54 4.96 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 0.91 0.00 0.00 1.13 0.00 0.00 68 R 9.10 4.81 0.00 1.78 1.83 0.00 3.40 0.00 0.00 3.30 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00 69 G 8.75 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 70 S 8.86 4.79 0.00 3.78 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 G 8.37 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 0.00 0.00 0.00 72 S 9.26 4.39 0.00 4.02 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 0.00 73 V 7.29 5.03 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 0.76 0.00 0.00 0.93 0.00 0.00 74 S 9.24 5.26 0.00 3.70 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 N 9.09 5.41 0.00 2.59 2.56 0.00 0.00 7.01 7.16 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 76 Y 8.98 4.60 0.00 3.08 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 77 I 7.43 4.42 0.65 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 0.89 0.23 0.60 0.00 0.00 78 L 8.84 4.68 0.00 1.67 1.69 0.96 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 79 S 8.85 4.54 0.00 3.94 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 80 E 8.23 4.03 0.00 2.10 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 2.44 2.46 0.00 81 I 8.44 3.79 1.93 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 1.71 0.62 0.99 0.00 0.00 82 K 8.01 4.02 0.00 1.85 1.90 0.00 1.70 0.00 0.00 1.84 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.56 1.57 7.81 83 P 0.00 4.37 0.00 2.25 2.20 0.00 3.75 0.00 0.00 3.76 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 84 L 8.36 4.08 0.00 1.95 1.95 1.16 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 85 H 8.66 4.07 0.00 3.38 3.50 0.00 5.64 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 N 8.51 4.39 0.00 2.99 3.12 0.00 0.00 6.92 7.23 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 87 F 8.61 4.41 0.00 3.22 3.26 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 0.00 88 L 8.27 3.59 0.00 1.63 1.58 0.98 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 89 T 7.73 3.76 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 1.19 0.00 0.00 90 Q 7.51 4.18 0.00 2.29 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.99 0.00 0.00 0.00 0.00 0.00 2.47 2.62 0.00 91 L 7.66 4.04 0.00 0.95 1.11 0.79 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 92 Q 7.93 3.86 0.00 2.09 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.57 0.00 0.00 0.00 0.00 0.00 2.25 2.49 0.00 93 P 0.00 4.04 0.00 0.84 1.64 0.00 3.55 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.91 0.00 94 F 7.39 4.76 0.00 3.11 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 L 7.38 4.23 0.00 1.67 1.64 0.93 1.21 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 96 K 9.42 4.41 0.00 1.74 1.80 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.36 1.37 7.81 97 L 8.30 4.30 0.00 1.75 1.69 0.88 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 98 K 8.06 5.00 0.00 1.92 1.80 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 3.31 0.00 0.00 0.00 0.00 1.36 1.29 7.81 99 Q 8.15 3.91 0.00 2.24 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.91 0.00 0.00 0.00 0.00 0.00 2.50 2.56 0.00 100 K 7.93 3.92 0.00 1.82 1.76 0.00 1.74 0.00 0.00 1.78 0.00 0.00 2.90 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.48 1.48 7.81 101 Q 8.09 3.98 0.00 2.35 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.68 0.00 0.00 0.00 0.00 0.00 2.62 2.50 0.00 102 A 8.07 4.00 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 0.00 103 N 8.18 4.26 0.00 2.71 2.77 0.00 0.00 7.09 6.51 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 0.00 104 L 7.97 3.82 0.00 1.83 1.72 0.93 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 105 V 7.94 3.67 2.26 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 1.18 0.00 0.00 1.05 0.00 0.00 106 L 8.07 3.98 0.00 1.83 1.65 0.81 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 107 K 8.16 3.86 0.00 1.64 1.58 0.00 0.94 0.00 0.00 1.16 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.41 1.15 7.81 108 I 8.00 4.08 2.15 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.10 1.01 0.00 0.00 109 I 8.09 3.96 2.15 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.04 1.00 0.00 0.00 110 E 8.30 4.11 0.00 2.13 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 2.38 2.49 0.00 111 Q 7.98 4.52 0.00 2.40 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.76 0.00 0.00 0.00 0.00 0.00 2.76 3.07 0.00 112 L 7.79 4.07 0.00 1.86 1.81 1.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 113 P 0.00 4.35 0.00 2.06 2.17 0.00 3.83 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 2.07 2.23 0.00 114 S 8.18 4.30 0.00 3.91 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 A 8.02 4.16 1.49 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 0.00 116 K 7.78 4.43 0.00 1.94 1.91 0.00 1.73 0.00 0.00 1.77 0.00 0.00 3.10 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.58 1.78 7.81 117 E 8.12 4.44 0.00 2.09 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 2.53 2.48 0.00 118 S 7.81 4.86 0.00 4.01 3.94 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 0.00 0.00 0.00 119 P 0.00 2.97 0.00 2.10 2.11 0.00 3.72 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 120 D 7.80 4.19 0.00 2.73 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 0.00 121 K 7.98 3.80 0.00 1.85 1.91 0.00 1.36 0.00 0.00 1.53 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.45 7.81 122 F 8.33 3.94 0.00 3.06 2.64 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 0.00 123 L 7.93 3.69 0.00 1.89 1.64 0.87 0.92 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 0.00 124 E 7.45 3.56 0.00 1.78 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 1.47 2.00 0.00 125 V 7.01 2.36 1.61 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 0.86 0.00 0.00 0.43 0.00 0.00 126 C 7.52 3.86 0.00 2.88 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 0.00 127 T 7.52 4.08 4.23 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 1.12 0.00 0.00 128 W 7.71 4.46 0.00 3.56 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 0.00 129 V 7.68 3.63 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.92 0.00 0.00 130 D 8.15 4.39 0.00 3.01 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 0.00 131 Q 8.17 4.02 0.00 2.25 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.45 0.00 132 I 7.88 3.69 2.05 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 1.48 0.85 0.94 0.00 0.00 133 A 7.90 4.02 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 0.00 134 A 7.88 4.09 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 0.00 135 L 7.56 4.14 0.00 1.81 1.73 0.95 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 136 N 7.79 4.64 0.00 2.86 2.77 0.00 0.00 7.03 7.57 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 0.00 137 D 8.10 4.64 0.00 2.64 2.62 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 0.00 138 S 7.60 4.37 0.00 3.95 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 0.00 139 K 8.57 4.64 0.00 1.71 1.76 0.00 1.73 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.32 1.57 7.81 140 T 7.77 4.63 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 0.00 141 R 8.02 4.14 0.00 1.80 1.87 0.00 3.18 0.00 0.00 3.15 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 142 K 8.54 4.34 0.00 1.71 1.75 0.00 1.83 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.32 1.42 7.81 143 T 7.85 4.33 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 1.30 0.00 0.00 144 T 8.48 4.73 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 0.00 145 S 8.85 4.07 0.00 3.97 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 E 8.02 3.87 0.00 2.08 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 2.30 2.39 0.00 147 T 7.96 3.86 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 1.26 0.00 0.00 148 V 7.29 3.51 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 0.94 0.00 0.00 0.81 0.00 0.00 149 R 7.97 3.99 0.00 1.90 2.09 0.00 3.35 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 150 A 7.92 4.16 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 V 7.22 3.95 2.31 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 0.81 0.00 0.00 1.05 0.00 0.00 152 L 7.71 3.84 0.00 1.82 1.43 0.95 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 153 D 8.81 4.76 0.00 2.86 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