NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.6180 8.1476 120.6128 55.5471 34.3291 173.4456 3 I 4.8827 8.2057 114.2984 58.6849 40.1857 173.4241 4 R 4.7557 9.4388 123.6721 54.3358 35.0720 175.8313 5 G 4.2241 8.6847 108.2641 45.8172 0.0000 173.2814 6 I 4.7172 9.1103 123.7341 59.2991 40.3124 175.3512 7 R 4.7909 8.3707 126.2338 55.4151 31.8451 175.8613 8 G 4.6966 8.0549 106.3422 44.8194 0.0000 171.8028 9 A 5.2783 7.8954 122.5595 50.6757 23.2388 174.7164 10 T 5.1332 8.8675 113.2615 61.2612 71.5531 172.3776 11 T 5.7778 8.3335 114.1772 59.3363 71.8488 173.1946 12 V 4.5147 8.1231 113.8222 59.9184 34.9779 175.8167 13 E 4.2844 9.2350 121.8558 57.8565 30.1140 177.5828 14 R 4.6352 7.5624 115.6106 54.2656 33.2146 175.9194 15 D 4.6603 8.4873 122.6912 53.3514 39.7806 175.4197 16 T 4.7111 7.4541 112.8412 58.0804 73.5865 173.8870 17 E 3.8391 8.7949 123.3986 59.8458 29.4351 178.6036 18 E 3.8641 8.2831 118.3774 59.5952 29.4296 178.3188 19 E 3.8887 7.7392 117.4722 59.4102 29.7103 178.8610 20 I 3.6779 7.8113 119.5953 64.5466 37.1929 178.6280 21 L 3.9852 8.1558 119.9179 57.4670 41.4010 179.4610 22 Q 3.8884 8.3443 119.9814 59.2981 29.1129 178.4570 23 K 4.0032 8.3466 119.8391 59.5382 32.0259 179.6927 24 T 3.7733 8.2269 116.4338 66.6078 68.4442 176.6448 25 K 3.8008 8.1418 121.5718 59.6141 32.0845 178.7897 26 Q 3.9046 7.9767 118.1547 58.7554 28.5842 178.3754 27 L 3.9008 7.7900 121.3002 58.1529 42.0673 179.0247 28 L 3.8508 7.8764 118.8363 57.7251 41.4279 179.2679 29 E 3.7972 8.1559 118.5822 59.2996 29.3207 179.4229 30 K 3.9006 8.0529 119.4965 59.4400 32.2271 178.8437 31 I 3.6537 7.9984 120.4558 64.5001 37.0578 178.4451 32 I 3.7692 7.8777 120.6738 64.2626 36.6914 177.9892 33 E 3.9055 8.1889 119.1773 59.5528 29.6199 178.3663 34 E 4.1344 8.2755 117.4093 58.7617 29.6563 178.2213 35 N 4.7751 8.1471 112.9626 51.8684 39.8753 173.9120 36 H 4.0840 8.3505 119.0744 57.3342 28.8101 174.8722 37 T 4.2595 8.0656 114.2881 63.0546 69.5209 174.5764 38 K 4.6703 8.5511 125.3384 53.6066 34.5794 175.3604 39 P 2.9700 0.0000 0.0000 65.3698 30.8301 177.7575 40 E 4.0257 7.7519 113.7478 57.3966 29.8497 176.7907 41 D 4.4660 8.1084 119.7847 54.9132 41.4879 175.8441 42 V 4.4598 7.5253 120.6867 61.4801 32.3280 175.5748 43 V 3.8633 8.7614 128.8347 64.9008 31.7326 175.6178 44 Q 4.7785 7.5020 115.5639 56.0526 31.5436 171.6049 45 M 5.2728 8.8431 118.8675 53.9168 36.1161 173.5905 46 L 5.4100 8.9289 124.7983 52.9757 45.5654 175.3987 47 L 5.4446 8.9873 121.9380 52.9971 45.6005 175.7778 48 S 5.9794 9.5631 117.3701 55.6886 66.5870 172.7444 49 A 5.2412 8.2525 121.6792 49.9960 22.4094 175.8480 50 T 4.3626 8.6859 111.8503 60.9482 70.0051 173.4145 51 P 4.4900 0.0000 0.0000 64.0101 31.3015 176.4728 52 D 4.6292 7.8907 117.6161 53.6674 39.9990 175.7930 53 L 4.7246 7.4155 121.0692 53.7640 43.1237 175.7600 54 H 4.6740 9.0452 118.9290 55.2441 30.2291 174.8681 55 A 4.1339 8.2630 124.1987 54.6703 18.4426 178.6570 56 V 4.3065 6.9744 111.5397 60.0718 34.1826 173.6352 57 F 4.2023 8.5827 120.9611 57.0681 39.3005 174.3224 58 P 4.2431 0.0000 0.0000 65.9121 31.1212 178.1875 59 A 4.1090 8.2268 118.4932 54.6284 17.6512 179.2203 60 K 3.9569 8.3483 118.1321 59.3089 32.1816 178.4666 61 A 4.1190 8.1597 120.6698 54.2732 18.2702 179.6172 62 V 3.4704 7.8306 117.4356 65.8963 31.3978 177.7898 63 R 4.1457 7.5114 114.8168 57.8121 29.9312 177.7048 64 E 4.2960 7.9667 118.0506 56.5477 30.1028 176.4727 65 L 4.1350 7.2267 119.7446 54.0696 42.2536 176.8078 66 S 4.3155 8.5760 120.3367 59.5755 63.4985 174.4258 67 G 4.0326 8.5292 111.1407 45.8494 0.0000 173.5907 68 W 4.7100 8.1010 117.0253 56.1673 29.9899 176.6241 69 Q 4.2953 8.1521 114.9570 57.0746 28.3847 175.6268 70 Y 4.5671 7.5717 114.8593 57.7496 39.0041 175.5950 71 V 3.7907 7.6611 121.3208 61.6367 31.9542 173.6279 72 P 4.5800 0.0000 0.0000 62.9314 32.3678 175.6960 73 V 5.4958 8.2272 116.1386 59.0208 35.6127 174.4485 74 T 4.6577 8.3199 116.6397 61.2760 71.1606 171.5987 75 C 6.0863 8.5073 121.6480 57.7967 32.1245 172.4995 76 M 4.6396 8.1524 115.5597 54.8139 34.0940 172.9941 77 Q 4.8445 8.5155 121.0448 54.9333 30.0277 174.8804 78 E 4.3401 9.0196 128.8020 55.9400 30.4168 176.5004 79 M 4.1989 8.5478 122.8772 55.1091 32.1237 175.1871 80 D 4.5969 8.4633 120.4648 53.2993 42.1146 175.7382 81 V 4.3031 8.0518 125.7668 60.7056 34.0868 173.5521 82 T 3.9947 8.5665 123.5947 67.0449 67.9691 173.7121 83 G 3.9490 8.9707 114.4868 44.9607 0.0000 172.5971 84 G 3.7262 8.1475 108.6514 44.3997 0.0000 173.9783 85 L 3.9487 8.4036 124.1789 55.0693 42.5196 176.8904 86 K 4.4037 8.4847 124.9424 55.6306 34.3216 176.1849 87 K 3.8789 8.8141 118.6220 57.1203 29.5466 173.3567 88 C 5.1740 8.3843 119.2577 58.0097 35.9610 172.6195 89 I 4.9907 8.8365 127.1665 59.6971 39.5337 174.8739 90 R 5.2510 9.0765 125.1157 54.2885 34.0700 174.6923 91 V 4.8416 8.7608 122.2761 60.1041 34.9704 174.5009 92 M 4.9097 8.8655 122.2533 54.2150 34.6524 173.1413 93 M 4.7274 9.1789 127.4343 54.3187 34.4195 174.6263 94 T 4.8888 8.7894 123.6038 62.4168 70.3725 174.1749 95 V 4.8515 8.8407 120.4827 59.2965 35.3502 174.9360 96 Q 4.6586 8.9872 126.2079 56.2253 29.2143 174.9364 97 T 4.4877 8.7823 120.0352 61.2898 70.8795 172.6364 98 D 4.9068 8.4736 124.6755 53.9256 41.5775 176.5878 99 V 3.7883 7.5672 119.9221 61.7374 32.2397 174.4123 100 P 4.3928 0.0000 0.0000 62.5375 32.0591 177.0119 101 Q 4.0050 8.8836 122.7511 59.4195 28.9783 178.0995 102 D 4.6103 8.1053 114.2256 54.8831 39.6103 176.3374 103 Q 4.5506 8.1174 118.2870 55.5983 29.5829 175.6453 104 I 3.7597 7.3916 120.6610 61.1043 37.5029 176.0386 105 R 4.2517 8.4442 125.0977 55.6048 29.5618 175.6009 106 H 4.8126 8.4949 120.5300 54.6560 30.4266 175.0621 107 V 4.3651 8.1744 122.2705 61.3074 33.7310 173.8554 108 Y 5.0728 8.6608 124.7093 56.2750 41.0644 174.6531 109 L 4.8637 8.6388 122.8223 51.7084 46.4487 178.9238 110 E 3.5495 8.8441 120.1554 58.0114 28.8008 179.2665 111 K 4.0791 9.4432 127.5109 59.3232 32.2781 178.1272 112 A 4.3230 8.0616 121.5219 53.5146 18.3426 179.4418 113 V 3.8799 7.4533 109.7253 63.3403 31.6288 176.8786 114 V 4.1631 7.3773 118.9208 61.6062 31.6097 176.2218 115 L 4.1656 7.3481 125.9243 55.6375 42.0807 176.3971 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 M 8.15 4.62 0.00 2.28 2.02 0.00 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.62 0.00 3 I 8.21 4.88 1.93 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.97 0.91 0.00 0.00 4 R 9.44 4.76 0.00 1.69 1.82 0.00 3.23 0.00 0.00 3.19 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.56 0.00 5 G 8.68 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 6 I 9.11 4.72 1.89 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 1.21 0.76 0.92 0.00 0.00 7 R 8.37 4.79 0.00 1.68 1.74 0.00 3.66 0.00 0.00 3.33 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.44 0.00 8 G 8.05 4.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.90 5.28 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 10 T 8.87 5.13 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 11 T 8.33 5.78 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 1.29 0.00 0.00 12 V 8.12 4.51 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.92 0.00 0.00 13 E 9.24 4.28 0.00 2.08 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 2.41 0.00 14 R 7.56 4.64 0.00 1.74 1.78 0.00 3.19 0.00 0.00 3.14 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.56 0.00 15 D 8.49 4.66 0.00 2.61 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 16 T 7.45 4.71 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 17 E 8.79 3.84 0.00 2.03 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 2.38 2.40 0.00 18 E 8.28 3.86 0.00 2.02 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 2.38 2.34 0.00 19 E 7.74 3.89 0.00 2.20 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 0.00 2.43 2.41 0.00 20 I 7.81 3.68 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 1.50 0.62 0.90 0.00 0.00 21 L 8.16 3.99 0.00 1.67 1.70 0.92 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 22 Q 8.34 3.89 0.00 2.40 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.79 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 23 K 8.35 4.00 0.00 1.83 1.83 0.00 1.72 0.00 0.00 1.80 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.59 1.74 7.81 24 T 8.23 3.77 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 25 K 8.14 3.80 0.00 1.81 1.76 0.00 1.56 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.35 1.38 7.81 26 Q 7.98 3.90 0.00 2.36 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.56 0.00 0.00 0.00 0.00 0.00 2.35 2.56 0.00 27 L 7.79 3.90 0.00 1.73 1.78 0.89 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 28 L 7.88 3.85 0.00 1.70 1.39 0.78 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 29 E 8.16 3.80 0.00 2.14 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 2.21 2.39 0.00 30 K 8.05 3.90 0.00 1.93 1.88 0.00 1.61 0.00 0.00 1.63 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.50 7.81 31 I 8.00 3.65 1.96 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.53 0.91 0.00 0.00 32 I 7.88 3.77 1.96 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.85 1.10 0.00 0.00 33 E 8.19 3.91 0.00 2.08 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 0.00 2.32 2.34 0.00 34 E 8.28 4.13 0.00 2.18 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 2.47 2.49 0.00 35 N 8.15 4.78 0.00 2.83 2.85 0.00 0.00 7.27 7.87 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 36 H 8.35 4.08 0.00 3.28 3.30 0.00 5.77 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 T 8.07 4.26 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 38 K 8.55 4.67 0.00 1.84 1.77 0.00 1.72 0.00 0.00 1.91 0.00 0.00 3.03 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.47 1.34 7.81 39 P 0.00 2.97 0.00 1.55 0.49 0.00 3.55 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.71 0.00 40 E 7.75 4.03 0.00 2.00 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 2.19 2.20 0.00 41 D 8.11 4.47 0.00 2.73 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 V 7.53 4.46 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 0.83 0.00 0.00 0.81 0.00 0.00 43 V 8.76 3.86 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 0.81 0.00 0.00 0.97 0.00 0.00 44 Q 7.50 4.78 0.00 2.12 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.65 0.00 0.00 0.00 0.00 0.00 2.22 2.26 0.00 45 M 8.84 5.27 0.00 2.12 1.98 0.00 0.00 0.00 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.54 0.00 46 L 8.93 5.41 0.00 1.62 1.53 0.94 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 47 L 8.99 5.44 0.00 1.57 1.53 0.94 0.90 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 48 S 9.56 5.98 0.00 3.90 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 49 A 8.25 5.24 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 T 8.69 4.36 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 1.25 0.00 0.00 51 P 0.00 4.49 0.00 2.21 2.20 0.00 3.75 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 52 D 7.89 4.63 0.00 2.79 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 53 L 7.42 4.72 0.00 1.50 1.55 0.92 0.92 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 54 H 9.05 4.67 0.00 3.07 3.21 0.00 5.65 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.26 4.13 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 56 V 6.97 4.31 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 0.68 0.00 0.00 0.95 0.00 0.00 57 F 8.58 4.20 0.00 3.16 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 58 P 0.00 4.24 0.00 2.19 2.14 0.00 3.75 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.19 0.00 59 A 8.23 4.11 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 60 K 8.35 3.96 0.00 1.92 1.97 0.00 1.68 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.48 7.81 61 A 8.16 4.12 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 0.00 0.00 0.00 0.00 0.00 62 V 7.83 3.47 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 1.13 0.00 0.00 0.96 0.00 0.00 63 R 7.51 4.15 0.00 2.06 1.95 0.00 3.19 0.00 0.00 3.22 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 64 E 7.97 4.30 0.00 1.92 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 2.35 2.45 0.00 65 L 7.23 4.14 0.00 1.53 1.19 0.09 0.43 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 66 S 8.58 4.32 0.00 3.92 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 67 G 8.53 4.03 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 0.00 0.00 0.00 68 W 8.10 4.71 0.00 3.49 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 69 Q 8.15 4.30 0.00 1.90 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.22 6.77 0.00 0.00 0.00 0.00 0.00 1.16 1.81 0.00 70 Y 7.57 4.57 0.00 2.97 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 71 V 7.66 3.79 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 0.97 0.00 0.00 0.68 0.00 0.00 72 P 0.00 4.58 0.00 2.17 2.20 0.00 3.71 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.01 0.00 73 V 8.23 5.50 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 0.91 0.00 0.00 0.95 0.00 0.00 74 T 8.32 4.66 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 1.21 0.00 0.00 75 C 8.51 6.09 0.00 3.00 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 76 M 8.15 4.64 0.00 2.03 2.14 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.47 0.00 77 Q 8.52 4.84 0.00 2.11 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.85 7.02 0.00 0.00 0.00 0.00 0.00 2.30 2.34 0.00 78 E 9.02 4.34 0.00 1.99 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 2.33 2.31 0.00 79 M 8.55 4.20 0.00 2.17 2.06 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.53 0.00 80 D 8.46 4.60 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 81 V 8.05 4.30 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 0.99 0.00 0.00 0.93 0.00 0.00 82 T 8.57 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 83 G 8.97 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 84 G 8.15 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 85 L 8.40 3.95 0.00 1.60 1.61 0.92 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 86 K 8.48 4.40 0.00 1.78 1.95 0.00 1.97 0.00 0.00 1.76 0.00 0.00 2.98 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.39 7.81 87 K 8.81 3.88 0.00 1.96 1.90 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.83 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.36 1.35 7.81 88 C 8.38 5.17 0.00 2.92 2.73 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 89 I 8.84 4.99 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.70 0.91 0.00 0.00 90 R 9.08 5.25 0.00 1.72 1.78 0.00 3.09 0.00 0.00 3.26 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.59 0.00 91 V 8.76 4.84 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 0.78 0.00 0.00 0.98 0.00 0.00 92 M 8.87 4.91 0.00 2.15 1.97 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 2.50 2.51 0.00 93 M 9.18 4.73 0.00 2.15 1.96 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.61 0.00 94 T 8.79 4.89 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 1.22 0.00 0.00 95 V 8.84 4.85 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 1.00 0.00 0.00 96 Q 8.99 4.66 0.00 2.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.61 0.00 0.00 0.00 0.00 0.00 2.57 2.29 0.00 97 T 8.78 4.49 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 1.27 0.00 0.00 98 D 8.47 4.91 0.00 2.67 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 99 V 7.57 3.79 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 0.75 0.00 0.00 0.92 0.00 0.00 100 P 0.00 4.39 0.00 2.22 1.97 0.00 3.66 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.08 0.00 101 Q 8.88 4.01 0.00 2.10 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.99 0.00 0.00 0.00 0.00 0.00 2.47 2.40 0.00 102 D 8.11 4.61 0.00 2.82 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 0.00 103 Q 8.12 4.55 0.00 2.17 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.86 0.00 0.00 0.00 0.00 0.00 2.29 2.29 0.00 104 I 7.39 3.76 1.81 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.74 0.76 0.00 0.00 105 R 8.44 4.25 0.00 1.94 1.89 0.00 3.16 0.00 0.00 3.38 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.59 0.00 106 H 8.49 4.81 0.00 3.13 3.25 0.00 5.85 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 V 8.17 4.37 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 1.02 0.00 0.00 0.89 0.00 0.00 108 Y 8.66 5.07 0.00 2.87 2.92 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 0.00 109 L 8.64 4.86 0.00 1.58 1.54 0.90 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 110 E 8.84 3.55 0.00 2.12 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 2.32 2.25 0.00 111 K 9.44 4.08 0.00 1.77 1.85 0.00 1.68 0.00 0.00 1.66 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.53 7.81 112 A 8.06 4.32 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 V 7.45 3.88 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 0.76 0.00 0.00 0.97 0.00 0.00 114 V 7.38 4.16 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 0.77 0.00 0.00 0.90 0.00 0.00 115 L 7.35 4.17 0.00 1.09 1.23 1.00 0.96 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