NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3586 8.3049 120.3486 54.9247 33.3708 174.9319 2 L 3.9829 8.3479 125.3346 53.8362 42.0306 175.5399 3 T 3.9227 8.8139 119.5172 64.6879 68.6132 174.1725 4 D 4.5502 7.6490 122.0598 50.9437 42.4831 172.9897 5 P 4.2278 0.0000 0.0000 65.4896 31.4619 178.1279 6 I 3.5506 7.8456 117.5358 64.2270 37.0134 178.0864 7 A 3.9041 8.1973 121.5365 55.3331 18.2090 178.5802 8 D 4.2398 8.3150 116.7348 58.1194 41.1411 178.1352 9 M 3.8563 8.4078 118.3288 59.0328 32.1890 178.0645 10 L 3.9198 8.1459 119.0495 58.4059 41.8005 180.0795 11 T 3.8212 8.0563 115.4674 66.5684 68.5325 176.8906 12 R 3.8832 8.2479 120.4228 59.5197 30.2231 179.0134 13 I 3.6118 8.0819 119.4913 64.6908 36.9071 177.8424 14 R 3.7279 7.7599 117.8075 60.4252 30.0632 177.4991 15 N 4.0310 9.0435 114.8618 56.5468 38.6091 176.9794 16 A 3.9658 8.4191 121.5266 55.9322 18.8063 179.9431 17 T 4.2525 7.8146 108.9444 64.2218 68.6819 176.9628 18 R 3.8115 8.2427 120.2430 57.8311 30.0369 177.5694 19 V 4.2875 7.1493 109.3411 60.4001 32.4971 174.7383 20 Y 3.0316 7.2063 116.1242 58.5939 35.5436 170.6405 21 K 4.2310 8.0367 117.7681 56.6415 33.2975 177.4763 22 E 4.3916 8.9295 121.3429 58.6613 30.3242 175.1995 23 S 5.4896 7.9527 112.3098 58.4112 66.1862 172.2858 24 T 4.4563 6.9100 119.3833 62.8504 71.1759 172.7992 25 D 5.4884 8.5586 128.0694 53.2912 43.5799 176.1627 26 V 4.6327 8.0587 113.1530 59.0399 36.4567 172.9382 27 P 3.6288 0.0000 0.0000 62.6595 31.6056 176.1814 28 A 4.3416 8.2133 126.1861 51.8326 19.6492 177.1951 29 S 4.4492 8.5643 109.8644 56.6570 64.6559 177.2292 30 R 3.6176 7.7229 121.2999 59.3605 29.9920 178.1229 31 F 4.4314 8.3245 119.4774 61.9140 39.5846 177.9932 32 K 3.6159 8.1532 117.6236 59.2249 31.8375 178.7657 33 E 3.5382 8.4354 119.7858 59.4570 29.7224 178.5139 34 E 3.9826 8.7386 118.7145 59.7554 29.4881 179.7426 35 I 3.7423 7.4551 119.1885 64.1997 37.1524 178.1063 36 L 3.8374 7.5999 119.8257 57.9753 41.3514 179.5037 37 R 4.0797 7.9491 117.6693 59.7435 30.0750 179.0128 38 I 3.7083 7.4140 117.6542 64.4246 37.1516 177.9827 39 L 4.0469 8.3366 121.4127 58.4761 41.6525 179.0423 40 A 4.0412 8.7404 120.5186 55.1988 18.4252 179.2514 41 R 3.6482 8.2359 116.6272 59.7856 30.1190 177.5407 42 E 4.0323 8.8009 115.5965 57.2151 29.8073 176.6100 43 G 3.6351 8.7017 107.5559 46.7181 0.0000 174.2412 44 F 4.7867 8.2329 117.9820 57.0130 40.8213 176.5246 45 I 4.7678 7.3649 112.8643 58.5150 40.3594 176.3638 46 K 4.0669 8.9256 121.9642 57.7801 32.2421 176.1924 47 G 3.9535 6.6511 103.5289 44.4299 0.0000 171.6750 48 Y 5.5429 7.9069 116.7060 56.4820 41.0432 173.5561 49 E 4.5371 9.0902 116.5746 54.9264 33.3432 174.7562 50 R 4.7046 8.5803 120.2541 56.6498 31.3289 176.3019 51 V 4.5237 8.4586 121.1149 61.8988 35.7690 172.5170 52 D 5.2954 8.8497 127.4775 53.2104 42.6864 175.4984 53 V 4.1021 8.8991 123.7217 62.0597 33.4170 174.7022 54 D 4.4384 10.1231 125.3016 55.0994 39.5990 174.0686 55 G 4.0746 8.6934 106.2479 44.2257 0.0000 174.2510 56 K 4.5812 8.1178 119.8470 53.3850 34.4572 173.3524 57 P 4.8066 0.0000 0.0000 63.6895 32.1780 174.4711 58 Y 5.0540 9.1590 125.3970 56.3215 41.6770 175.0070 59 L 4.9028 8.5056 119.5813 53.7640 45.1664 175.9814 60 R 4.2023 8.8706 123.9240 56.3994 31.3692 176.0167 61 V 4.6020 8.6998 123.7163 61.3159 34.3547 173.7203 62 Y 4.7529 9.6059 127.3134 56.8693 38.9969 175.4507 63 L 4.6027 8.6260 124.9893 54.0721 43.1042 176.4162 64 K 4.6091 8.0169 121.2397 54.9962 35.1814 174.5105 65 Y 4.7738 8.5752 122.8558 56.1603 42.5312 174.5681 66 G 4.1580 8.6164 110.7882 45.1084 0.0000 171.3851 67 P 4.8581 0.0000 0.0000 60.9734 34.0749 175.3816 68 R 4.2940 8.5413 120.8142 57.1851 30.5187 175.6525 69 R 4.7823 8.5590 123.0554 54.3219 33.8804 175.8649 70 Q 4.1276 8.5886 120.3844 55.9910 30.0554 176.7733 71 G 3.8523 8.2939 107.3408 44.5007 0.0000 171.4842 72 P 4.4498 0.0000 0.0000 62.3260 32.6068 175.1845 73 D 4.2521 8.3996 116.5244 54.9087 38.5982 171.0938 74 P 4.7174 0.0000 0.0000 61.9193 32.2001 177.0451 75 R 3.8447 7.4978 119.1751 56.0826 30.1686 174.9961 76 P 4.9014 0.0000 0.0000 62.0125 32.5450 175.3376 77 E 4.4159 8.8141 122.0936 56.3569 31.5092 174.7205 78 Q 4.9773 8.2574 120.6296 54.1517 30.1396 176.5356 79 V 3.7562 8.6494 124.0547 66.0466 31.9801 177.0586 80 I 4.2880 7.2662 121.6455 59.8238 35.6231 174.8481 81 H 4.2037 8.6029 120.7832 58.3126 29.3507 175.5611 82 H 4.4978 7.6763 117.9244 54.2491 33.2518 172.6884 83 I 4.3329 7.9452 124.9557 60.3688 39.6563 173.2197 84 R 4.6576 8.2629 129.5641 54.0799 33.3749 174.7920 85 R 3.8614 8.7312 124.6420 57.1066 30.4010 174.4455 86 I 4.3200 8.3736 119.7333 62.5372 39.2026 175.9146 87 S 4.2698 7.7867 120.7217 59.0254 63.4470 173.7514 88 K 4.5963 8.4126 123.2934 54.2069 36.2516 174.2739 89 P 4.2997 0.0000 0.0000 63.6589 31.8727 175.7868 90 G 3.8576 9.1233 105.1790 45.9143 0.0000 172.4498 91 R 3.6199 7.5581 115.7513 55.6044 29.6327 173.4049 92 R 4.2713 7.2960 120.0770 55.6761 31.4940 176.5034 93 V 4.1791 8.3726 121.3215 61.2653 34.0292 173.9395 94 Y 5.4984 8.3865 124.5085 56.6485 41.4879 175.3760 95 V 4.7200 8.7958 113.9282 60.0804 36.8451 175.0457 96 G 4.1751 9.5442 113.6072 44.4478 0.0000 175.1824 97 V 3.8188 8.3752 118.9403 64.4592 31.3130 178.8308 98 K 4.0773 8.1149 118.9828 58.7975 31.9687 177.3232 99 E 4.4248 8.4051 116.0024 55.8529 30.1217 176.2948 100 I 3.6710 7.2138 119.6280 61.0709 37.4776 174.3206 101 P 4.3914 0.0000 0.0000 62.4542 31.9728 176.0423 102 R 4.2534 8.0728 119.3053 54.1349 30.7630 175.5309 103 V 3.4958 8.1617 126.0329 63.5028 31.3178 174.7128 104 R 3.8337 8.0457 128.5954 59.5552 26.2538 176.9700 105 R 3.7166 8.6535 111.7737 56.9385 28.3620 177.6138 106 G 4.0499 8.2837 109.3216 45.7776 0.0000 175.4127 107 L 4.2096 8.7043 118.3524 55.8848 41.6772 176.3332 108 G 4.6406 7.9149 106.1435 44.8382 0.0000 171.1287 109 I 5.1345 8.8853 112.5399 59.7777 41.8437 174.3158 110 A 5.0670 8.7051 123.1115 50.9951 21.9316 175.5842 111 I 4.5316 8.4401 123.9871 61.4928 38.7846 175.4293 112 L 5.2247 8.8677 126.0670 54.1831 44.3147 174.9811 113 S 5.0907 8.7866 116.2926 57.6138 64.2175 172.9871 114 T 4.9752 9.2340 116.8845 59.5543 72.2824 174.8651 115 S 4.3815 8.8886 115.3257 60.2220 63.1398 174.9413 116 K 4.3012 7.6842 119.4480 56.1437 32.1535 175.3123 117 G 3.6828 8.3238 106.6268 44.0970 0.0000 172.3869 118 V 4.6834 8.1349 119.1499 61.7412 32.1758 175.5155 119 L 5.0618 8.9066 127.6438 54.1560 44.7027 175.6022 120 T 4.5560 9.2982 111.5993 61.4246 70.0267 175.0562 121 D 4.4154 8.5348 120.2076 56.5997 39.2013 178.9357 122 R 3.9528 7.9134 119.0475 59.1216 30.2200 178.6069 123 E 4.0083 8.4849 118.3353 59.2161 29.3200 179.4053 124 A 3.9862 8.1345 120.8820 55.2430 18.3204 179.7243 125 R 3.8573 8.2571 116.2820 59.6323 30.4062 178.0139 126 K 4.0547 8.4558 120.3701 59.3236 32.0184 178.0307 127 L 4.2328 8.2700 118.1242 54.5443 42.1960 177.1555 128 G 3.9644 7.9646 106.9320 46.9303 0.0000 173.4478 129 V 4.5643 8.2232 110.1187 59.2531 35.9807 175.3927 130 G 4.2924 9.0204 108.7760 45.5918 0.0000 171.1927 131 G 3.8338 7.4048 104.3476 45.9217 0.0000 170.5017 132 E 4.7419 7.8054 122.9956 55.9283 30.6017 177.3297 133 L 4.1847 8.9490 131.1233 55.7309 42.7653 177.4902 134 I 4.0299 8.7342 128.1534 63.6752 38.2925 175.5915 135 C 4.8992 7.9615 114.2530 57.9882 33.4454 172.5054 136 E 4.9783 8.0473 119.7350 55.1297 32.3162 175.2689 137 V 4.2248 7.9386 115.4071 62.2086 36.0355 172.0172 138 W 4.8582 8.2343 124.9413 57.2117 28.1771 174.2209 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 4.36 0.00 1.99 2.03 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.57 0.00 2 L 8.35 3.98 0.00 1.75 1.60 0.95 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 3 T 8.81 3.92 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 1.20 0.00 0.00 4 D 7.65 4.55 0.00 2.68 2.46 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 5 P 0.00 4.23 0.00 2.20 2.08 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 2.13 2.19 0.00 6 I 7.85 3.55 2.00 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.07 0.77 0.00 0.00 7 A 8.20 3.90 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 D 8.31 4.24 0.00 2.73 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 9 M 8.41 3.86 0.00 2.10 1.96 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 2.50 2.48 0.00 10 L 8.15 3.92 0.00 1.79 1.65 0.84 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 11 T 8.06 3.82 4.38 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 1.17 0.00 0.00 12 R 8.25 3.88 0.00 1.88 1.98 0.00 3.29 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 1.64 1.80 0.00 13 I 8.08 3.61 1.95 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.19 0.82 0.00 0.00 14 R 7.76 3.73 0.00 1.83 2.00 0.00 3.21 0.00 0.00 3.12 7.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.58 0.00 15 N 9.04 4.03 0.00 2.82 2.76 0.00 0.00 7.00 7.12 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 16 A 8.42 3.97 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 17 T 7.81 4.25 4.47 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 1.10 0.00 0.00 18 R 8.24 3.81 0.00 1.84 1.94 0.00 3.02 0.00 0.00 3.25 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 19 V 7.15 4.29 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 0.72 0.00 0.00 0.96 0.00 0.00 20 Y 7.21 3.03 0.00 2.98 2.54 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 21 K 8.04 4.23 0.00 1.86 1.86 0.00 1.73 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.66 1.53 7.81 22 E 8.93 4.39 0.00 2.09 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 2.57 2.46 0.00 23 S 7.95 5.49 0.00 3.35 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 24 T 6.91 4.46 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 1.20 0.00 0.00 25 D 8.56 5.49 0.00 2.59 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 26 V 8.06 4.63 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 0.79 0.00 0.00 0.85 0.00 0.00 27 P 0.00 3.63 0.00 1.74 1.63 0.00 3.59 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.90 0.00 28 A 8.21 4.34 1.24 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 0.00 0.00 29 S 8.56 4.45 0.00 3.97 3.89 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 0.00 0.00 0.00 30 R 7.72 3.62 0.00 1.91 2.00 0.00 3.36 0.00 0.00 3.30 7.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.71 0.00 31 F 8.32 4.43 0.00 3.02 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 32 K 8.15 3.62 0.00 1.92 1.67 0.00 1.64 0.00 0.00 1.59 0.00 0.00 3.02 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.31 1.35 7.81 33 E 8.44 3.54 0.00 1.92 2.09 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 2.37 2.34 0.00 34 E 8.74 3.98 0.00 2.24 2.09 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 2.41 2.63 0.00 35 I 7.46 3.74 1.71 0.00 0.00 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.35 0.75 0.00 0.00 36 L 7.60 3.84 0.00 1.18 1.20 0.29 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 37 R 7.95 4.08 0.00 2.11 2.06 0.00 3.19 0.00 0.00 3.24 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.80 0.00 38 I 7.41 3.71 2.01 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 1.45 0.67 0.99 0.00 0.00 39 L 8.34 4.05 0.00 1.94 1.78 0.84 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 40 A 8.74 4.04 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 41 R 8.24 3.65 0.00 1.84 2.24 0.00 3.30 0.00 0.00 3.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.66 0.00 42 E 8.80 4.03 0.00 2.24 1.96 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 2.56 2.58 0.00 43 G 8.70 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 0.00 0.00 0.00 0.00 44 F 8.23 4.79 0.00 3.26 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.36 4.77 2.17 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 1.53 1.17 0.96 0.00 0.00 46 K 8.93 4.07 0.00 2.00 1.94 0.00 1.78 0.00 0.00 1.73 0.00 0.00 2.90 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.51 1.56 7.81 47 G 6.65 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 0.00 0.00 0.00 48 Y 7.91 5.54 0.00 3.27 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 49 E 9.09 4.54 0.00 2.04 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.44 0.00 50 R 8.58 4.70 0.00 1.79 1.98 0.00 3.28 0.00 0.00 3.21 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.79 0.00 51 V 8.46 4.52 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 0.94 0.00 0.00 1.01 0.00 0.00 52 D 8.85 5.30 0.00 2.76 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 53 V 8.90 4.10 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.76 0.00 0.00 54 D 10.12 4.44 0.00 2.74 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 55 G 8.69 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 K 8.12 4.58 0.00 2.04 1.80 0.00 1.62 0.00 0.00 1.77 0.00 0.00 3.13 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.42 7.81 57 P 0.00 4.81 0.00 2.11 2.26 0.00 3.84 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 2.02 1.84 0.00 58 Y 9.16 5.05 0.00 3.09 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 59 L 8.51 4.90 0.00 1.57 1.61 0.81 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 60 R 8.87 4.20 0.00 1.79 1.34 0.00 3.08 0.00 0.00 3.05 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.76 0.00 61 V 8.70 4.60 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 0.99 0.00 0.00 0.98 0.00 0.00 62 Y 9.61 4.75 0.00 3.10 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 63 L 8.63 4.60 0.00 1.58 1.21 0.88 0.74 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 64 K 8.02 4.61 0.00 1.77 1.55 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.30 1.45 7.81 65 Y 8.58 4.77 0.00 3.09 3.17 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 66 G 8.62 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 0.00 0.00 0.00 67 P 0.00 4.86 0.00 2.13 2.20 0.00 3.76 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.97 0.00 68 R 8.54 4.29 0.00 1.80 1.86 0.00 3.13 0.00 0.00 3.19 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.74 0.00 69 R 8.56 4.78 0.00 1.77 1.78 0.00 3.20 0.00 0.00 3.20 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.65 0.00 70 Q 8.59 4.13 0.00 2.04 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.89 0.00 0.00 0.00 0.00 0.00 2.36 2.30 0.00 71 G 8.29 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 0.00 0.00 0.00 0.00 72 P 0.00 4.45 0.00 2.19 2.07 0.00 3.92 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 73 D 8.40 4.25 0.00 2.78 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 74 P 0.00 4.72 0.00 2.20 2.22 0.00 3.88 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.89 0.00 75 R 7.50 3.84 0.00 1.82 1.68 0.00 3.46 0.00 0.00 3.24 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.46 0.00 76 P 0.00 4.90 0.00 2.09 2.18 0.00 2.91 0.00 0.00 4.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.82 0.00 77 E 8.81 4.42 0.00 2.13 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 2.43 2.36 0.00 78 Q 8.26 4.98 0.00 1.86 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.93 6.83 0.00 0.00 0.00 0.00 0.00 2.39 2.25 0.00 79 V 8.65 3.76 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 0.95 0.00 0.00 0.95 0.00 0.00 80 I 7.27 4.29 1.78 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 1.29 0.90 0.70 0.00 0.00 81 H 8.60 4.20 0.00 2.89 3.27 0.00 5.84 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 7.68 4.50 0.00 1.65 1.31 0.00 5.63 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 83 I 7.95 4.33 1.63 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 1.09 0.55 0.76 0.00 0.00 84 R 8.26 4.66 0.00 2.01 1.78 0.00 3.15 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.54 0.00 85 R 8.73 3.86 0.00 1.70 1.82 0.00 3.34 0.00 0.00 3.22 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 86 I 8.37 4.32 2.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.75 0.89 0.00 0.00 87 S 7.79 4.27 0.00 3.87 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 88 K 8.41 4.60 0.00 1.73 1.62 0.00 1.74 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.35 1.53 7.81 89 P 0.00 4.30 0.00 2.17 2.06 0.00 3.90 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 1.98 1.96 0.00 90 G 9.12 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 R 7.56 3.62 0.00 1.88 2.02 0.00 3.29 0.00 0.00 3.30 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.33 0.00 92 R 7.30 4.27 0.00 1.67 1.26 0.00 3.30 0.00 0.00 3.28 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.58 0.00 93 V 8.37 4.18 1.96 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 1.02 0.00 0.00 0.88 0.00 0.00 94 Y 8.39 5.50 0.00 2.88 2.74 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 95 V 8.80 4.72 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 0.82 0.00 0.00 1.02 0.00 0.00 96 G 9.54 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 0.00 0.00 0.00 97 V 8.38 3.82 2.09 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 0.82 0.00 0.00 0.99 0.00 0.00 98 K 8.11 4.08 0.00 1.78 1.92 0.00 1.74 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.45 1.47 7.81 99 E 8.41 4.42 0.00 2.01 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 2.28 2.27 0.00 100 I 7.21 3.67 1.89 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 1.38 0.76 0.93 0.00 0.00 101 P 0.00 4.39 0.00 2.19 2.06 0.00 3.72 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 102 R 8.07 4.25 0.00 1.74 1.85 0.00 3.23 0.00 0.00 3.14 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.56 0.00 103 V 8.16 3.50 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 1.03 0.00 0.00 1.05 0.00 0.00 104 R 8.05 3.83 0.00 1.90 1.64 0.00 2.79 0.00 0.00 2.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.60 0.00 105 R 8.65 3.72 0.00 1.77 2.02 0.00 3.17 0.00 0.00 3.16 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.63 0.00 106 G 8.28 4.05 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 0.00 0.00 0.00 107 L 8.70 4.21 0.00 1.42 1.72 0.88 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 108 G 7.91 4.64 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 0.00 109 I 8.89 5.13 1.98 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.94 1.13 0.00 0.00 110 A 8.71 5.07 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 0.00 111 I 8.44 4.53 1.85 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 1.42 0.56 0.91 0.00 0.00 112 L 8.87 5.22 0.00 1.91 1.74 0.96 0.62 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 0.00 113 S 8.79 5.09 0.00 4.16 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 0.00 114 T 9.23 4.98 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 115 S 8.89 4.38 0.00 3.98 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 0.00 116 K 7.68 4.30 0.00 1.79 1.86 0.00 1.68 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.39 1.36 7.81 117 G 8.32 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 0.00 0.00 0.00 118 V 8.13 4.68 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 1.22 0.00 0.00 119 L 8.91 5.06 0.00 1.74 1.72 0.97 0.44 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 0.00 120 T 9.30 4.56 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 121 D 8.53 4.42 0.00 2.96 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 0.00 122 R 7.91 3.95 0.00 1.90 2.03 0.00 3.15 0.00 0.00 3.35 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.74 0.00 123 E 8.48 4.01 0.00 2.03 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 2.35 2.36 0.00 124 A 8.13 3.99 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 R 8.26 3.86 0.00 1.96 2.10 0.00 3.28 0.00 0.00 3.16 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 126 K 8.46 4.05 0.00 2.02 1.90 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.49 7.81 127 L 8.27 4.23 0.00 1.67 1.71 0.93 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 128 G 7.96 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 0.00 0.00 0.00 129 V 8.22 4.56 2.09 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 0.79 0.00 0.00 0.95 0.00 0.00 130 G 9.02 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 G 7.40 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 0.00 0.00 0.00 132 E 7.81 4.74 0.00 2.43 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 1.99 0.00 133 L 8.95 4.18 0.00 1.78 1.54 0.93 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 134 I 8.73 4.03 2.04 0.00 0.00 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 1.58 0.92 0.90 0.00 0.00 135 C 7.96 4.90 0.00 3.13 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 0.00 136 E 8.05 4.98 0.00 1.92 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.26 0.00 137 V 7.94 4.22 1.76 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 -0.09 0.00 0.00 0.71 0.00 0.00 138 W 8.23 4.86 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