NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.2548 8.2644 123.5804 51.4698 19.9274 176.0118 3 R 4.6969 8.3448 119.7362 55.6184 31.0637 172.3728 4 I 4.0412 8.7765 126.6038 61.7781 40.1664 176.6814 5 A 4.1847 8.9197 128.2531 51.9879 19.9205 177.0956 6 G 4.2156 8.5245 108.8537 45.8716 0.0000 174.6131 7 V 3.3311 8.0645 123.5163 62.2934 29.4962 174.0450 8 E 4.7133 8.3066 118.3891 54.5785 32.2520 176.3836 9 I 4.8689 8.2222 123.9047 59.5272 40.1454 172.7818 10 P 4.5451 0.0000 0.0000 61.7835 33.5360 174.5522 11 R 4.4672 8.1648 120.0057 57.8428 31.8928 175.1001 12 N 4.5671 8.9257 120.0585 53.1564 37.3141 174.4267 13 K 4.6673 7.0060 115.6375 53.8161 35.0369 176.3302 14 R 4.2403 8.3089 119.5965 56.1960 32.2904 178.0765 15 V 3.6411 8.0299 120.3529 66.1336 31.4256 178.1444 16 D 4.8689 8.1741 118.7895 55.9622 38.8513 177.9767 17 V 3.9732 8.0130 119.0396 64.4800 31.7637 177.6033 18 A 4.0375 9.1268 121.2271 55.4280 18.2703 179.5143 19 L 4.1504 8.2694 116.2564 58.4241 42.0476 179.8131 20 T 4.3878 9.0657 117.7980 65.6703 68.0747 175.7309 21 Y 4.0830 8.6753 115.8558 58.6805 37.7944 175.3395 22 I 4.8199 7.5840 122.1017 59.2210 39.3571 174.5787 23 Y 4.2434 9.5026 126.7787 59.0935 38.9437 176.5895 24 G 3.8886 9.4892 115.0801 45.0940 0.0000 172.9188 25 I 4.2683 7.3489 119.4669 59.4375 41.2640 174.5935 26 G 3.5687 8.6512 107.4864 45.9541 0.0000 173.4630 27 K 3.6097 7.8731 123.6126 57.4856 32.7186 176.9465 28 A 3.9280 7.5829 117.8815 56.1451 17.5220 179.8563 29 R 3.9271 7.6474 114.3397 59.1182 29.9664 178.8226 30 A 4.7756 8.0421 119.9625 54.8859 18.1106 178.0503 31 K 4.2191 8.2404 117.2889 58.0866 33.0793 177.6819 32 E 3.9756 8.6994 119.3362 59.8257 29.3527 179.0425 33 A 4.3224 9.6198 120.1644 55.2177 18.8706 179.3353 34 L 4.0979 7.9973 116.0800 57.7818 41.7880 178.4214 35 E 4.2762 8.3301 120.1407 58.0159 29.9981 177.9044 36 K 4.2479 8.1245 123.3402 55.6465 31.0002 177.1297 37 T 4.0158 7.6953 111.3164 61.3134 73.2012 172.2360 38 G 3.8459 8.4468 109.5770 47.0286 0.0000 173.8772 39 I 4.4584 8.0785 117.4600 58.7781 40.4069 175.9330 40 N 4.2735 8.8305 123.4904 53.4329 39.5894 173.2572 41 P 4.0842 0.0000 0.0000 65.7969 31.7814 178.1246 42 A 3.8470 8.8001 119.5473 56.4466 18.2103 178.8215 43 T 3.5722 7.1789 106.1942 60.8069 67.3555 175.1165 44 R 4.0473 8.4540 131.6623 58.3620 28.9532 180.4270 45 V 3.2315 7.9918 114.0700 64.8187 33.1899 175.1642 46 K 3.5706 8.8423 119.9018 59.3141 32.2767 177.0797 47 D 4.7618 7.7030 117.0891 53.8045 41.3494 176.4761 48 L 4.1560 8.6471 121.2779 54.9893 42.4184 177.3525 49 T 4.3979 7.7714 119.5760 62.4979 70.9290 176.1842 50 E 4.2034 8.8197 124.3782 59.1818 29.3288 179.2302 51 A 4.0192 7.9246 120.6305 55.5332 18.4864 178.7750 52 E 4.0126 8.1917 116.9411 58.7404 29.5709 179.3744 53 V 3.5162 8.5273 118.3261 66.8688 31.8621 177.9004 54 V 3.4995 8.2441 117.0682 67.2179 31.1361 178.0457 55 R 3.9051 8.1385 116.5055 59.2053 30.2041 178.5410 56 L 3.9308 8.5387 120.3479 58.4852 42.0090 178.6272 57 R 3.8678 8.7705 118.4260 60.0656 30.0128 177.7142 58 E 3.8295 8.1236 117.3835 60.1177 29.3164 178.6751 59 Y 4.0280 8.0674 118.7436 61.8535 37.6083 178.2843 60 V 3.1384 8.0276 119.1030 64.9661 31.3051 177.0526 61 E 4.3239 8.8220 123.6670 58.0743 30.3897 177.0774 62 N 4.7183 8.4043 115.4951 51.8947 39.4262 173.6742 63 T 4.8373 7.2853 130.9280 62.3244 67.7381 172.0277 64 W 5.3920 7.0120 118.1667 55.3624 33.3009 174.2723 65 K 4.4165 8.6732 120.1539 55.4793 32.4836 176.2753 66 L 5.0009 8.1930 122.4543 53.0877 46.4781 176.3678 67 E 3.7699 8.9187 117.4778 57.6633 30.1002 178.5256 68 G 3.9154 8.5566 108.6429 49.1128 0.0000 174.7818 69 E 3.9939 7.8965 120.3499 58.5344 29.8593 178.5356 70 L 4.1786 8.6464 121.0300 58.2653 42.3130 178.6577 71 R 3.9985 8.3458 117.3095 59.7246 29.9260 178.6772 72 A 3.9844 8.2707 120.1328 54.7191 18.0654 179.4709 73 E 3.8465 8.3178 117.8659 59.5580 30.0758 179.1979 74 V 3.7502 7.7592 111.6871 64.2961 31.7914 177.9091 75 A 3.9551 8.1775 120.4511 55.4370 18.0786 179.2457 76 A 4.1571 7.7875 115.8120 53.6789 18.3217 178.2357 77 N 4.5120 8.4360 116.3385 55.1839 38.8814 176.9541 78 I 3.6837 7.3746 120.7643 63.7949 37.8874 177.6792 79 K 3.8363 8.0535 120.3001 59.5506 31.7385 177.6127 80 R 4.0876 8.0307 119.0933 58.0630 29.3159 177.1807 81 L 4.1275 6.5566 114.1759 57.3036 40.8886 178.5691 82 M 4.4147 7.4365 116.5077 56.0450 32.6904 175.8098 83 D 4.9431 8.8967 117.9337 54.4141 41.3822 175.8895 84 I 4.7114 7.2912 112.6811 58.7734 40.4316 177.7305 85 G 4.0081 8.6140 113.5077 45.0823 0.0000 173.1806 86 C 4.2315 9.8143 121.5332 58.7833 31.9320 172.5495 87 Y 4.2349 8.7943 128.6786 61.2831 38.4147 178.0212 88 R 3.9379 8.3547 118.6336 57.9713 30.2396 176.8636 89 G 4.1508 8.5817 105.5875 46.2141 0.0000 176.1410 90 L 3.7895 8.3626 120.9207 57.6671 41.4253 179.2034 91 R 3.7505 7.7395 117.6190 59.9832 29.7665 178.5786 92 H 4.1325 7.3711 113.5772 58.7907 28.6998 177.7564 93 R 4.1152 8.2051 119.2597 59.0969 29.9578 177.5796 94 R 4.2620 8.5912 118.5723 54.3776 30.0295 174.8685 95 G 3.2400 7.2631 106.7514 45.3210 0.0000 172.5916 96 L 4.6300 7.3580 120.2936 51.5975 43.5200 174.6291 97 P 4.3510 0.0000 0.0000 63.4551 31.5236 175.8521 98 V 4.0948 8.1951 117.1243 64.2540 33.9427 176.7952 99 R 4.2045 7.6470 118.5639 55.8850 28.4406 177.5675 100 G 3.9425 7.8907 104.2584 46.2369 0.0000 170.6939 101 Q 4.5556 7.8526 122.3724 54.4608 33.3325 174.4993 102 R 4.4910 8.2314 115.7624 55.8233 30.7232 176.3444 103 T 4.5992 8.0469 105.4018 60.8422 70.2503 175.6882 104 R 3.9418 8.1176 122.4490 59.2732 30.2339 175.2307 105 T 4.6180 7.1827 105.7491 60.7673 72.6304 174.6483 106 N 3.6524 9.3790 118.1971 53.0115 37.4453 174.9057 107 A 3.7917 8.3877 118.1473 54.4106 16.6348 179.7532 108 R 4.1026 7.9633 118.7408 60.6780 30.5578 177.8984 109 T 3.7968 7.8955 111.1996 65.4705 67.1812 174.9549 110 R 4.1584 7.7695 118.6600 58.4431 30.5061 177.8846 111 K 4.4613 6.7639 118.7938 61.9970 32.8308 174.9506 112 G 3.8350 8.4045 104.1337 43.6962 0.0000 171.7086 113 P 4.3960 0.0000 0.0000 61.9497 32.0759 176.3407 114 R 3.9691 8.4200 120.1373 56.8123 30.1367 178.0150 115 K 4.2963 8.2431 125.1358 54.9974 30.6954 174.8780 116 T 3.9854 7.7836 116.6056 63.3081 69.5869 173.2833 117 V 3.6407 8.2563 128.1682 62.7089 30.8894 174.6593 118 A 4.2809 8.9914 129.7640 50.9004 22.8921 178.6501 119 G 3.8571 8.1569 103.8020 45.5660 0.0000 171.9697 120 K 4.6551 8.2833 117.5731 54.5064 34.6755 176.1041 121 K 4.5889 8.2664 121.6199 55.0233 35.5422 176.1323 122 K 4.4221 8.3526 122.0118 55.3199 33.7764 174.6615 123 A 4.2270 7.5520 118.5104 51.3610 21.3698 173.5765 124 P 4.2403 0.0000 0.0000 63.2476 31.3203 178.2651 125 R 4.2466 8.4573 123.4413 56.0097 29.2038 176.5201 126 K 4.1236 7.9778 124.7009 57.6899 32.2265 175.4369 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 A 8.26 4.25 1.28 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 0.00 0.00 3 R 8.34 4.70 0.00 1.88 1.87 0.00 3.02 0.00 0.00 3.90 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 4 I 8.78 4.04 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 1.38 1.00 0.97 0.00 0.00 5 A 8.92 4.18 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 6 G 8.52 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 7 V 8.06 3.33 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 0.94 0.00 0.00 8 E 8.31 4.71 0.00 2.11 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.50 0.00 9 I 8.22 4.87 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 1.48 0.40 0.90 0.00 0.00 10 P 0.00 4.55 0.00 1.90 1.97 0.00 4.04 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 1.85 1.90 0.00 11 R 8.16 4.47 0.00 1.88 1.75 0.00 3.26 0.00 0.00 3.31 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.43 0.00 12 N 8.93 4.57 0.00 2.90 3.00 0.00 0.00 6.80 7.61 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 13 K 7.01 4.67 0.00 1.64 1.68 0.00 1.76 0.00 0.00 1.77 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.37 1.34 7.81 14 R 8.31 4.24 0.00 1.88 2.15 0.00 3.14 0.00 0.00 3.28 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.80 0.00 15 V 8.03 3.64 2.11 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 1.04 0.00 0.00 0.97 0.00 0.00 16 D 8.17 4.87 0.00 2.88 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 17 V 8.01 3.97 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 1.20 0.00 0.00 0.98 0.00 0.00 18 A 9.13 4.04 1.26 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 0.00 0.00 19 L 8.27 4.15 0.00 1.75 1.88 1.03 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 20 T 9.07 4.39 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 21 Y 8.68 4.08 0.00 3.00 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 22 I 7.58 4.82 1.94 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 1.29 1.50 1.01 0.00 0.00 23 Y 9.50 4.24 0.00 3.05 2.96 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 24 G 9.49 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 0.00 0.00 0.00 25 I 7.35 4.27 1.97 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 1.10 0.90 0.00 0.00 26 G 8.65 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 K 7.87 3.61 0.00 2.00 1.80 0.00 1.73 0.00 0.00 1.66 0.00 0.00 3.04 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.36 1.50 7.81 28 A 7.58 3.93 1.28 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 0.00 0.00 29 R 7.65 3.93 0.00 1.43 1.17 0.00 2.39 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 1.19 0.00 30 A 8.04 4.78 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 K 8.24 4.22 0.00 1.94 1.99 0.00 1.70 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.56 1.45 7.81 32 E 8.70 3.98 0.00 2.33 2.39 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 2.49 2.70 0.00 33 A 9.62 4.32 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 L 8.00 4.10 0.00 1.73 1.98 0.97 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.33 4.28 0.00 2.28 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 2.34 2.39 0.00 36 K 8.12 4.25 0.00 1.23 1.22 0.00 1.79 0.00 0.00 1.55 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.36 1.31 7.81 37 T 7.70 4.02 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 1.26 0.00 0.00 38 G 8.45 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 39 I 8.08 4.46 1.88 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 1.18 0.85 0.92 0.00 0.00 40 N 8.83 4.27 0.00 2.75 2.72 0.00 0.00 7.20 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 41 P 0.00 4.08 0.00 2.23 2.11 0.00 3.68 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.11 0.00 42 A 8.80 3.85 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 43 T 7.18 3.57 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 1.23 0.00 0.00 44 R 8.45 4.05 0.00 1.91 2.15 0.00 3.33 0.00 0.00 3.26 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.67 0.00 45 V 7.99 3.23 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 0.90 0.00 0.00 1.02 0.00 0.00 46 K 8.84 3.57 0.00 1.77 1.94 0.00 1.63 0.00 0.00 1.84 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.74 1.42 7.81 47 D 7.70 4.76 0.00 2.67 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 48 L 8.65 4.16 0.00 1.69 1.60 0.93 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 49 T 7.77 4.40 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 1.25 0.00 0.00 50 E 8.82 4.20 0.00 2.03 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 2.38 2.39 0.00 51 A 7.92 4.02 1.32 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 52 E 8.19 4.01 0.00 2.30 1.95 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 2.40 2.42 0.00 53 V 8.53 3.52 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 1.00 0.00 0.00 1.00 0.00 0.00 54 V 8.24 3.50 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 0.98 0.00 0.00 0.99 0.00 0.00 55 R 8.14 3.91 0.00 1.88 1.95 0.00 3.18 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.76 0.00 56 L 8.54 3.93 0.00 1.77 1.91 0.98 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 57 R 8.77 3.87 0.00 1.93 2.21 0.00 3.20 0.00 0.00 3.18 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.73 0.00 58 E 8.12 3.83 0.00 2.28 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 2.65 2.51 0.00 59 Y 8.07 4.03 0.00 2.80 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 60 V 8.03 3.14 2.28 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 1.17 0.00 0.00 1.20 0.00 0.00 61 E 8.82 4.32 0.00 2.02 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 0.00 2.35 2.39 0.00 62 N 8.40 4.72 0.00 2.62 2.68 0.00 0.00 7.01 6.99 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 63 T 7.29 4.84 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 -0.77 0.00 0.00 64 W 7.01 5.39 0.00 3.38 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 65 K 8.67 4.42 0.00 1.79 1.80 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.82 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.51 7.81 66 L 8.19 5.00 0.00 1.79 1.64 1.13 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 67 E 8.92 3.77 0.00 2.10 1.93 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 2.36 2.66 0.00 68 G 8.56 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 0.00 0.00 0.00 69 E 7.90 3.99 0.00 2.01 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 0.00 2.36 2.34 0.00 70 L 8.65 4.18 0.00 1.79 2.05 0.65 1.23 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 71 R 8.35 4.00 0.00 1.94 1.85 0.00 2.88 0.00 0.00 2.97 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 1.33 0.00 72 A 8.27 3.98 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 E 8.32 3.85 0.00 1.96 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 2.34 2.36 0.00 74 V 7.76 3.75 2.11 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 0.79 0.00 0.00 1.11 0.00 0.00 75 A 8.18 3.96 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 76 A 7.79 4.16 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 77 N 8.44 4.51 0.00 2.91 2.92 0.00 0.00 7.09 7.42 0.00 0.00 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 I 7.37 3.68 1.91 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.86 0.69 0.00 0.00 79 K 8.05 3.84 0.00 1.77 1.82 0.00 1.65 0.00 0.00 1.76 0.00 0.00 2.88 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.43 1.60 7.81 80 R 8.03 4.09 0.00 2.11 1.94 0.00 3.16 0.00 0.00 3.35 8.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 81 L 6.56 4.13 0.00 1.70 1.90 0.95 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 82 M 7.44 4.41 0.00 2.19 2.18 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 2.52 2.47 0.00 83 D 8.90 4.94 0.00 2.70 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 84 I 7.29 4.71 1.88 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 1.33 1.07 0.92 0.00 0.00 85 G 8.61 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 C 9.81 4.23 0.00 3.01 3.02 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 87 Y 8.79 4.23 0.00 3.08 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 88 R 8.35 3.94 0.00 1.97 2.04 0.00 3.32 0.00 0.00 3.29 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.69 0.00 89 G 8.58 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 0.00 0.00 0.00 90 L 8.36 3.79 0.00 1.52 1.61 0.91 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 91 R 7.74 3.75 0.00 1.57 2.14 0.00 2.86 0.00 0.00 2.38 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.42 0.00 92 H 7.37 4.13 0.00 3.31 3.34 0.00 5.65 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 R 8.21 4.12 0.00 1.74 1.97 0.00 3.13 0.00 0.00 3.20 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.77 0.00 94 R 8.59 4.26 0.00 1.93 1.79 0.00 3.28 0.00 0.00 3.19 8.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.70 0.00 95 G 7.26 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 L 7.36 4.63 0.00 1.57 1.55 0.89 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 97 P 0.00 4.35 0.00 2.43 2.07 0.00 3.68 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 1.99 1.98 0.00 98 V 8.20 4.09 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 0.86 0.00 0.00 0.70 0.00 0.00 99 R 7.65 4.20 0.00 1.90 1.90 0.00 3.37 0.00 0.00 3.24 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.58 0.00 100 G 7.89 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 0.00 0.00 0.00 101 Q 7.85 4.56 0.00 2.01 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.91 0.00 0.00 0.00 0.00 0.00 2.27 2.51 0.00 102 R 8.23 4.49 0.00 1.92 1.93 0.00 2.98 0.00 0.00 3.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.61 0.00 103 T 8.05 4.60 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 1.22 0.00 0.00 104 R 8.12 3.94 0.00 1.79 2.01 0.00 3.22 0.00 0.00 3.28 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 105 T 7.18 4.62 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 0.00 106 N 9.38 3.65 0.00 2.81 2.68 0.00 0.00 6.87 7.35 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 0.00 107 A 8.39 3.79 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 0.00 108 R 7.96 4.10 0.00 1.83 1.96 0.00 3.51 0.00 0.00 3.26 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.61 0.00 109 T 7.90 3.80 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 0.00 110 R 7.77 4.16 0.00 1.83 1.91 0.00 3.28 0.00 0.00 3.13 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.66 0.00 111 K 6.76 4.46 0.00 2.15 1.88 0.00 1.67 0.00 0.00 1.55 0.00 0.00 3.05 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.30 7.81 112 G 8.40 3.84 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 0.00 113 P 0.00 4.40 0.00 2.05 1.99 0.00 3.68 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.10 0.00 114 R 8.42 3.97 0.00 1.79 1.89 0.00 3.35 0.00 0.00 3.22 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.59 0.00 115 K 8.24 4.30 0.00 1.71 1.76 0.00 1.63 0.00 0.00 1.91 0.00 0.00 3.05 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.38 1.50 7.81 116 T 7.78 3.99 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 0.00 117 V 8.26 3.64 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 0.79 0.00 0.00 0.93 0.00 0.00 118 A 8.99 4.28 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 0.00 119 G 8.16 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 0.00 120 K 8.28 4.66 0.00 1.69 1.67 0.00 1.74 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.31 1.41 7.81 121 K 8.27 4.59 0.00 1.72 1.64 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.33 1.41 7.81 122 K 8.35 4.42 0.00 1.63 1.74 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.30 1.45 7.81 123 A 7.55 4.23 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 P 0.00 4.24 0.00 2.05 2.05 0.00 3.68 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 2.03 2.09 0.00 125 R 8.46 4.25 0.00 1.90 2.02 0.00 3.06 0.00 0.00 3.15 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.67 0.00 126 K 7.98 4.12 0.00 1.73 1.71 0.00 1.81 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.34 1.41 7.81