NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2817 8.3044 120.3226 56.3305 32.7510 174.6658 2 D 4.0274 7.9643 116.9962 53.7493 39.2430 171.3404 3 L 4.1519 8.4304 125.2913 53.3740 43.7512 175.8633 4 P 3.8824 0.0000 0.0000 64.9368 32.2466 176.1807 5 I 5.0858 7.4061 119.2784 58.4987 39.0218 175.5542 6 T 4.5707 8.1067 114.0506 59.9847 71.6281 172.7924 7 L 5.2120 8.3717 125.7856 51.6811 44.5341 176.7976 8 S 4.5803 8.4513 115.8639 58.7690 62.6466 174.9236 9 K 4.3906 7.7721 118.3635 55.6103 31.0338 177.4374 10 E 4.0848 8.2682 120.4801 58.9126 29.8835 177.8567 11 T 4.4024 7.5123 109.3449 58.1958 68.5261 169.7217 12 P 3.9913 0.0000 0.0000 63.8702 31.7252 176.7317 13 F 4.3977 8.3618 121.0399 56.3874 41.5117 173.5600 14 E 3.9741 8.7990 127.3970 57.8496 29.8326 176.8398 15 G 3.9139 8.8930 112.4109 44.9486 0.0000 172.1851 16 E 4.6491 7.4313 118.9114 53.7906 32.1663 174.7039 17 E 4.3302 8.6940 127.3975 56.0160 30.6513 175.6301 18 I 4.6269 8.3966 120.0525 59.3633 41.0580 174.7560 19 T 4.6703 8.4445 121.2919 62.8916 69.4171 173.8436 20 V 4.4457 9.0316 128.9825 61.5185 32.5409 174.8029 21 S 4.9274 8.3880 119.3379 56.3727 65.4147 172.6815 22 A 5.0891 8.4897 124.3443 50.0991 21.7210 175.1064 23 R 4.5115 8.4405 122.7897 55.6369 30.9220 176.2837 24 V 4.2648 8.4157 125.2101 61.8110 33.3072 174.5807 25 T 4.6626 8.4716 124.7279 62.2329 69.8770 173.9364 26 N 4.5355 8.4432 125.9274 53.4003 39.1456 174.4286 27 R 4.6150 8.4418 127.7494 55.0354 33.9079 176.7923 28 G 4.0000 9.8941 108.5836 45.3904 0.0000 174.3815 29 A 4.4037 8.3809 123.9219 52.2662 20.9362 176.0094 30 A 4.6994 7.7399 119.1997 50.4826 22.2976 176.2766 31 E 4.0607 8.8248 118.0566 56.9957 29.5228 176.5086 32 A 4.6511 8.5917 126.2493 51.3501 20.9298 175.3165 33 H 4.9090 8.1997 115.6689 54.0167 33.2688 172.9865 34 N 4.1286 8.6317 115.3318 54.6830 35.2245 175.7594 35 V 4.3197 7.2255 117.0114 60.1394 31.0395 172.7452 36 P 4.7525 0.0000 0.0000 61.6127 33.8402 175.1852 37 V 4.7158 8.1895 118.1081 61.0412 34.3640 174.3029 38 A 4.7140 8.4758 128.0154 50.3248 21.8404 174.8322 39 V 4.5319 8.0204 120.8904 61.6881 34.2056 174.3557 40 Y 5.3374 6.9920 124.9086 54.8591 40.9645 174.2337 41 L 4.0056 8.3758 125.9425 54.5273 43.1925 174.5110 42 G 3.9034 8.4161 111.8424 44.4068 0.0000 171.9785 43 N 4.9113 8.6562 116.6003 50.6595 40.7982 174.2089 44 P 4.2113 0.0000 0.0000 65.1648 32.0164 177.7215 45 A 3.9920 7.9671 121.6723 55.2709 17.9191 178.1206 46 Q 4.0504 7.7049 115.9892 56.0355 29.8044 176.5346 47 G 4.9977 7.2152 120.0700 45.6146 0.0000 171.9754 48 G 3.8314 7.6786 113.4909 45.7676 0.0000 170.7595 49 V 4.4494 7.8932 117.5397 59.2365 34.3617 174.5988 50 E 4.4374 8.7486 123.5169 56.4372 30.2950 176.1741 51 I 4.1400 8.0979 126.6605 62.4226 36.9823 175.9357 52 G 4.0296 7.4691 106.9318 45.7587 0.0000 171.5435 53 R 4.8369 8.2495 114.6941 55.4521 32.0822 174.6256 54 D 4.4901 8.1618 117.9950 53.6231 43.9268 175.6302 55 T 4.1436 8.4415 122.1075 63.2550 69.2313 174.6708 56 I 4.2018 8.0553 126.7135 60.3648 38.5099 176.0589 57 S 4.2419 8.8696 118.8927 60.3274 62.4747 174.5262 58 R 4.4338 7.0003 111.6163 55.5805 31.1643 173.4138 59 I 4.6046 7.7590 122.2324 58.7925 39.1720 174.0431 60 P 4.5510 0.0000 0.0000 62.0846 32.9934 175.9585 61 V 3.5984 8.2665 120.4327 63.9609 31.9619 176.3591 62 G 3.8929 8.8841 113.4117 45.8930 0.0000 173.2102 63 G 4.5041 7.3998 108.1701 44.8524 0.0000 172.6768 64 T 4.8616 8.3188 108.1856 60.2901 72.0188 173.6198 65 G 4.1686 9.4150 111.0765 45.0364 0.0000 172.7046 66 L 4.8004 8.2304 121.9891 53.4880 44.4653 175.2873 67 A 4.7781 8.0618 125.2946 50.4668 21.4560 175.7994 68 R 4.5958 8.3928 118.9080 54.5804 32.6479 174.8846 69 V 4.7402 8.4892 124.9542 61.1361 35.5146 173.7049 70 Q 5.2687 8.7725 123.5566 54.3316 31.3077 174.4185 71 W 5.3349 8.7541 130.0076 55.7941 34.9291 173.2715 72 K 4.1963 7.7603 127.0114 54.9034 32.5745 175.8754 73 A 2.9366 7.5598 129.1497 51.6691 19.6316 176.4193 74 T 3.9609 7.7420 111.8526 62.0858 69.9534 172.6758 75 R 4.5150 8.0566 124.4549 56.5938 33.1192 174.5842 76 K 4.2511 8.0831 115.8583 57.3857 32.9829 176.8923 77 L 4.5061 8.1231 116.9494 55.1721 42.1275 175.6035 78 A 3.7444 8.0586 119.8814 52.7594 15.9576 177.9700 79 G 3.9325 8.1640 106.0967 47.1338 0.0000 173.3470 80 R 3.6653 8.6482 120.8354 57.1185 27.6848 175.6712 81 A 4.2834 7.7238 120.0030 53.4947 19.8404 178.0562 82 A 4.3718 7.7560 118.6644 51.8603 18.5218 176.9214 83 N 4.4826 7.6010 114.7338 53.4974 41.6243 171.0595 84 P 4.1740 0.0000 0.0000 60.4274 31.6517 176.6638 85 G 3.9411 8.6681 106.8888 44.7443 0.0000 174.1681 86 V 4.4404 7.2513 117.3346 59.3348 30.7735 172.4313 87 P 4.4507 0.0000 0.0000 63.0656 33.0962 176.1808 88 V 4.3024 7.2166 116.2143 61.2670 33.8701 173.8234 89 Y 4.9657 8.1092 122.9721 56.3281 42.3378 173.9659 90 A 4.7026 8.1073 119.9339 50.5239 22.5167 175.8474 91 V 4.4907 8.2077 119.8007 61.1553 35.3654 174.4291 92 V 4.5022 8.4541 126.9405 61.2176 32.7435 174.8550 93 D 4.5871 7.9734 127.3139 52.8732 40.0294 175.1494 94 P 4.3309 0.0000 0.0000 63.0175 31.0448 175.4600 95 D 4.7591 8.6198 122.3923 53.5337 39.9722 176.8400 96 N 4.9112 7.5912 116.6530 53.0137 39.6854 175.4943 97 R 3.7070 8.0349 115.1413 56.3254 30.1083 177.1935 98 V 4.1957 7.6882 116.5117 61.5124 35.1586 174.8757 99 A 4.2119 7.9873 124.5372 50.5501 20.0739 176.2334 100 E 3.8770 8.3898 122.5466 60.0428 29.7398 178.0469 101 S 4.0508 8.0393 112.0759 62.4442 62.5469 175.1572 102 D 4.5044 8.1559 121.4242 55.7046 40.7802 177.6440 103 K 3.8398 8.3106 117.5766 59.7803 32.3775 178.7685 104 A 3.9907 8.3877 118.8051 54.3107 18.1293 178.6516 105 N 4.4413 8.9572 116.5371 54.8726 39.2356 175.7664 106 N 4.4555 8.1450 118.1996 52.8069 38.8393 175.3169 107 V 4.1188 6.6544 116.5970 59.8690 32.9920 175.1595 108 F 5.2168 7.8327 120.0343 56.2937 43.5092 173.4257 109 S 4.7884 8.6818 113.2238 58.3817 65.4121 175.1826 110 R 4.6955 7.8616 117.6083 54.8137 32.9380 173.9982 111 I 4.4010 8.2584 121.5507 60.4150 38.6279 175.8139 112 V 4.5041 7.9728 115.7654 59.5744 35.3578 175.0227 113 K 4.6306 8.5173 122.4072 54.6410 34.3343 175.9505 114 V 4.3453 8.0229 115.2193 59.3931 33.7060 175.5857 115 L 4.1266 8.1634 124.2804 54.2057 42.2476 176.5029 116 E 4.4957 8.2428 122.2320 55.3364 31.1368 174.2670 117 H 4.6746 8.1966 117.4365 55.5710 30.9313 172.6811 118 H 4.6574 8.1173 115.2172 54.2688 32.4753 173.3857 119 H 4.3717 8.4396 119.7453 56.2717 29.2533 175.9703 120 H 4.5092 8.6196 124.5082 56.6505 29.9065 172.8670 121 H 4.1425 8.3092 114.9971 56.7710 28.1223 174.3255 122 H 4.3655 8.2840 121.1321 56.6461 27.7007 174.2801 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 4.28 0.00 2.00 2.09 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.47 0.00 2 D 7.96 4.03 0.00 2.81 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 3 L 8.43 4.15 0.00 1.74 1.51 0.89 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 4 P 0.00 3.88 0.00 1.40 0.80 0.00 3.37 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 1.45 1.54 0.00 5 I 7.41 5.09 1.83 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 0.90 1.14 0.87 0.00 0.00 6 T 8.11 4.57 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 7 L 8.37 5.21 0.00 1.62 1.63 0.94 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 8 S 8.45 4.58 0.00 3.84 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 9 K 7.77 4.39 0.00 1.78 1.76 0.00 1.87 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.41 7.81 10 E 8.27 4.08 0.00 2.02 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 2.32 2.48 0.00 11 T 7.51 4.40 4.54 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 1.28 0.00 0.00 12 P 0.00 3.99 0.00 1.76 1.94 0.00 3.63 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 1.93 2.07 0.00 13 F 8.36 4.40 0.00 3.36 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 E 8.80 3.97 0.00 2.03 1.90 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 2.31 2.38 0.00 15 G 8.89 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 E 7.43 4.65 0.00 2.23 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 2.21 2.22 0.00 17 E 8.69 4.33 0.00 1.95 1.80 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 2.28 2.41 0.00 18 I 8.40 4.63 1.93 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 1.27 0.80 0.99 0.00 0.00 19 T 8.44 4.67 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 1.26 0.00 0.00 20 V 9.03 4.45 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 0.90 0.00 0.00 1.11 0.00 0.00 21 S 8.39 4.93 0.00 4.00 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 22 A 8.49 5.09 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 23 R 8.44 4.51 0.00 1.57 1.82 0.00 3.18 0.00 0.00 3.03 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 24 V 8.42 4.26 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 0.99 0.00 0.00 1.02 0.00 0.00 25 T 8.47 4.66 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 26 N 8.44 4.54 0.00 2.72 2.75 0.00 0.00 7.37 7.54 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 27 R 8.44 4.62 0.00 1.85 1.90 0.00 3.30 0.00 0.00 3.25 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.81 0.00 28 G 9.89 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 A 8.38 4.40 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 30 A 7.74 4.70 1.21 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 0.00 0.00 0.00 31 E 8.82 4.06 0.00 2.00 2.03 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 2.32 2.42 0.00 32 A 8.59 4.65 1.33 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 0.00 0.00 0.00 0.00 0.00 0.00 33 H 8.20 4.91 0.00 2.96 3.19 0.00 6.05 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 N 8.63 4.13 0.00 2.87 2.85 0.00 0.00 6.67 7.70 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 35 V 7.23 4.32 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 0.91 0.00 0.00 0.93 0.00 0.00 36 P 0.00 4.75 0.00 2.18 2.20 0.00 3.86 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.97 0.00 37 V 8.19 4.72 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 0.84 0.00 0.00 0.95 0.00 0.00 38 A 8.48 4.71 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 39 V 8.02 4.53 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 0.81 0.00 0.00 0.90 0.00 0.00 40 Y 6.99 5.34 0.00 3.21 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 41 L 8.38 4.01 0.00 0.92 1.33 0.45 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 42 G 8.42 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 43 N 8.66 4.91 0.00 2.71 2.62 0.00 0.00 6.65 8.07 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 44 P 0.00 4.21 0.00 2.05 2.02 0.00 3.63 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.90 0.00 45 A 7.97 3.99 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 46 Q 7.70 4.05 0.00 2.01 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.56 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 47 G 7.22 5.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.68 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 49 V 7.89 4.45 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 0.81 0.00 0.00 0.95 0.00 0.00 50 E 8.75 4.44 0.00 1.97 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 2.32 2.38 0.00 51 I 8.10 4.14 1.83 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.87 1.01 0.00 0.00 52 G 7.47 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 53 R 8.25 4.84 0.00 1.94 1.95 0.00 3.07 0.00 0.00 3.39 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.67 0.00 54 D 8.16 4.49 0.00 2.65 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 55 T 8.44 4.14 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 56 I 8.06 4.20 1.87 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 1.30 0.50 0.95 0.00 0.00 57 S 8.87 4.24 0.00 3.84 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 58 R 7.00 4.43 0.00 1.73 1.88 0.00 3.07 0.00 0.00 3.27 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.51 0.00 59 I 7.76 4.60 1.84 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 1.27 0.65 0.90 0.00 0.00 60 P 0.00 4.55 0.00 2.11 2.17 0.00 3.68 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 2.06 1.95 0.00 61 V 8.27 3.60 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 0.97 0.00 0.00 62 G 8.88 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 63 G 7.40 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 0.00 0.00 0.00 0.00 64 T 8.32 4.86 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 1.20 0.00 0.00 65 G 9.41 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 L 8.23 4.80 0.00 1.59 1.51 0.91 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 67 A 8.06 4.78 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 68 R 8.39 4.60 0.00 1.79 1.80 0.00 3.19 0.00 0.00 3.16 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.59 0.00 69 V 8.49 4.74 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 1.02 0.00 0.00 70 Q 8.77 5.27 0.00 2.25 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.51 0.00 0.00 0.00 0.00 0.00 2.25 2.37 0.00 71 W 8.75 5.33 0.00 3.39 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 K 7.76 4.20 0.00 1.59 1.35 0.00 1.73 0.00 0.00 1.59 0.00 0.00 2.64 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.08 1.22 7.81 73 A 7.56 2.94 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 T 7.74 3.96 4.12 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 1.20 0.00 0.00 75 R 8.06 4.51 0.00 1.94 1.89 0.00 3.43 0.00 0.00 3.35 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.57 0.00 76 K 8.08 4.25 0.00 1.92 1.82 0.00 1.61 0.00 0.00 1.76 0.00 0.00 2.86 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.44 7.81 77 L 8.12 4.51 0.00 1.73 1.73 0.97 0.57 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 78 A 8.06 3.74 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 79 G 8.16 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 R 8.65 3.67 0.00 1.93 1.94 0.00 3.24 0.00 0.00 3.24 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.61 0.00 81 A 7.72 4.28 1.29 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 82 A 7.76 4.37 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 83 N 7.60 4.48 0.00 2.62 2.66 0.00 0.00 7.27 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 84 P 0.00 4.17 0.00 2.23 2.11 0.00 3.86 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 2.00 1.96 0.00 85 G 8.67 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 86 V 7.25 4.44 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 0.97 0.00 0.00 1.15 0.00 0.00 87 P 0.00 4.45 0.00 1.98 2.11 0.00 3.85 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 2.14 2.10 0.00 88 V 7.22 4.30 1.89 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 0.82 0.00 0.00 0.86 0.00 0.00 89 Y 8.11 4.97 0.00 2.57 2.53 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 0.00 90 A 8.11 4.70 1.16 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 91 V 8.21 4.49 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 0.94 0.00 0.00 1.11 0.00 0.00 92 V 8.45 4.50 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 0.86 0.00 0.00 1.01 0.00 0.00 93 D 7.97 4.59 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 94 P 0.00 4.33 0.00 2.35 2.14 0.00 3.76 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 1.99 1.95 0.00 95 D 8.62 4.76 0.00 2.81 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 96 N 7.59 4.91 0.00 2.68 2.77 0.00 0.00 7.27 7.67 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 97 R 8.03 3.71 0.00 1.92 1.80 0.00 3.15 0.00 0.00 3.15 7.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 98 V 7.69 4.20 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 0.80 0.00 0.00 0.92 0.00 0.00 99 A 7.99 4.21 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 0.00 100 E 8.39 3.88 0.00 2.07 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 101 S 8.04 4.05 0.00 3.88 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 0.00 102 D 8.16 4.50 0.00 2.82 2.53 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 0.00 103 K 8.31 3.84 0.00 1.92 1.87 0.00 1.73 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.60 7.81 104 A 8.39 3.99 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 0.00 105 N 8.96 4.44 0.00 2.72 2.84 0.00 0.00 6.72 6.82 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 0.00 106 N 8.14 4.46 0.00 2.65 2.86 0.00 0.00 7.03 7.36 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 0.00 107 V 6.65 4.12 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.91 0.00 0.00 108 F 7.83 5.22 0.00 2.98 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 0.00 109 S 8.68 4.79 0.00 3.22 3.49 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 0.00 110 R 7.86 4.70 0.00 1.81 1.97 0.00 2.91 0.00 0.00 3.30 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.60 0.00 111 I 8.26 4.40 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 1.41 0.43 0.90 0.00 0.00 112 V 7.97 4.50 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 0.72 0.00 0.00 0.94 0.00 0.00 113 K 8.52 4.63 0.00 1.69 1.67 0.00 1.69 0.00 0.00 1.69 0.00 0.00 2.81 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.41 7.81 114 V 8.02 4.35 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 0.80 0.00 0.00 0.98 0.00 0.00 115 L 8.16 4.13 0.00 1.42 1.40 0.78 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 116 E 8.24 4.50 0.00 1.90 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 2.35 2.21 0.00 117 H 8.20 4.67 0.00 3.19 3.18 0.00 5.52 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 H 8.12 4.66 0.00 3.00 3.15 0.00 5.90 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 0.00 119 H 8.44 4.37 0.00 3.17 3.25 0.00 5.69 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 H 8.62 4.51 0.00 3.04 3.19 0.00 6.05 0.00 0.00 0.00 0.00 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 H 8.31 4.14 0.00 3.45 3.33 0.00 5.74 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 H 8.28 4.37 0.00 3.24 3.20 0.00 5.56 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00