NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5387 8.3049 120.3439 55.4768 33.4929 174.6881 2 Y 4.6028 8.3046 119.1218 56.2747 40.6135 172.5277 3 Q 4.5692 8.9265 122.9227 55.1988 31.2436 173.7499 4 L 5.0411 8.5519 127.8367 53.3138 44.5251 174.7810 5 Q 4.5960 8.8314 128.2324 54.4655 30.9553 174.1141 6 F 4.8614 8.8673 125.5864 56.8717 40.4822 175.4496 7 I 4.1627 9.0246 124.8403 59.7450 39.4974 174.3859 8 N 5.2270 9.2432 126.5508 51.5472 38.9700 174.0184 9 L 4.7195 8.7990 124.6884 54.6989 42.9913 176.3933 10 V 4.7899 8.3536 118.0081 59.8973 33.4061 174.8992 11 Y 4.6352 7.9672 121.1927 56.4098 40.2110 173.0446 12 D 4.8621 8.4566 120.7673 52.4160 42.5547 176.7465 13 T 4.0807 8.7435 118.4501 64.9079 68.7722 176.4008 14 T 3.9743 8.1831 111.4960 63.9177 68.7661 175.1221 15 K 4.3094 8.0876 119.7714 56.5970 32.6138 176.3658 16 L 4.9051 7.5238 119.2729 52.8249 44.0949 177.0104 17 T 4.2113 8.7172 112.6046 61.4301 70.8528 175.1765 18 H 4.0834 8.7770 120.9378 59.5471 29.7097 176.9952 19 L 3.8141 7.8365 121.3289 58.1428 41.9976 178.4807 20 E 3.8553 8.0844 118.4666 59.6777 29.4015 179.4944 21 Q 3.9375 8.1196 117.8575 59.1670 28.5090 178.9180 22 T 3.7778 7.7797 116.0974 66.5558 68.8177 176.1670 23 N 4.3613 8.1802 118.2796 56.4177 38.6588 177.3564 24 I 3.8081 7.6073 121.1315 64.7435 36.7129 178.2402 25 N 4.4995 8.1899 116.6947 55.9114 38.0366 177.2824 26 L 3.9083 7.4239 119.7878 57.0514 41.6089 178.4385 27 F 4.7063 7.9459 115.3066 56.7642 39.8170 176.2864 28 I 4.1037 7.1864 119.8816 60.1636 37.5550 176.6571 29 G 3.8953 7.7392 112.1293 44.4658 0.0000 170.4734 30 N 5.4584 7.6967 116.6622 51.3359 41.1769 174.4470 31 W 5.8194 9.2589 121.8434 55.3871 34.1225 174.3213 32 S 5.5725 9.7160 117.8036 57.0374 67.5042 172.6736 33 N 5.0263 9.1821 120.7960 52.1573 40.9002 174.9103 34 H 4.5077 9.1135 123.7832 58.5885 29.3374 177.9924 35 Q 3.9466 8.1591 117.2020 58.8043 28.5765 177.3024 36 L 4.0830 8.2773 115.1257 54.5910 42.8497 176.4523 37 Q 2.0000 7.2786 117.6686 55.9660 26.6291 172.9726 38 K 5.1570 7.7393 118.0441 54.8580 36.6902 175.7292 39 S 5.6035 9.9868 121.0414 56.5322 66.4355 172.4285 40 I 4.9061 9.0258 117.8813 59.1567 40.9133 173.8459 41 C 5.0158 8.8612 125.4908 57.9715 33.7362 172.2596 42 I 4.9191 8.9286 128.7330 59.8962 38.7991 175.4893 43 R 5.0230 8.9422 125.1727 54.5472 35.1707 174.1537 44 H 4.9575 8.9380 120.9209 55.7656 29.9738 174.5762 45 G 4.2154 8.8401 116.8769 45.3070 0.0000 169.8416 46 D 4.8933 8.6064 118.9256 51.8795 42.3828 175.4129 47 D 4.4519 8.6763 117.5813 56.7808 40.8415 177.2219 48 T 4.3382 7.5907 107.5560 61.1906 69.3032 175.3428 49 S 4.2336 7.7138 118.7649 59.1179 63.3205 173.8607 50 H 4.4626 8.5477 120.2952 55.6247 29.9336 174.4103 51 N 4.2935 8.6448 114.6434 54.6563 35.7769 174.5640 52 Q 5.0384 7.8576 115.8630 56.2453 30.7895 176.0894 53 Y 5.0251 9.2408 120.0544 56.4361 42.4929 174.1065 54 H 5.4186 8.7774 118.0570 53.8605 31.9645 173.1128 55 I 4.4431 8.4133 120.6995 61.2335 37.4211 175.5174 56 L 4.5764 9.0872 127.0879 56.4564 43.1866 177.0357 57 F 4.8521 7.9153 118.9046 56.9444 43.0623 172.9134 58 I 4.3697 7.3420 125.9297 59.6299 39.4196 174.9569 59 D 4.7234 9.1390 129.2115 52.7242 41.1308 176.8420 60 T 4.1124 8.2812 116.4238 63.8528 69.5148 177.2681 61 A 4.0119 8.1471 124.5065 54.5740 18.5256 177.5400 62 H 4.7857 8.0653 109.6994 54.8720 30.1740 174.3133 63 Q 4.2890 7.6830 116.9621 55.8624 26.6141 173.0841 64 R 5.4042 8.4161 117.3518 54.6580 34.6199 174.5049 65 I 5.0747 8.4654 118.2227 59.0448 41.0328 174.2249 66 K 5.1523 8.9401 123.9701 54.9149 35.1806 175.1228 67 F 5.4157 8.3656 117.7590 56.3077 41.8882 172.7910 68 S 5.2465 8.8830 113.0023 57.1705 66.2084 173.2178 69 S 4.4538 8.4676 115.2458 56.7935 64.5161 175.3226 70 F 4.7942 7.6798 120.3241 60.1686 38.9552 176.8840 71 D 4.4892 8.0952 119.7637 56.9977 40.7834 175.9757 72 N 4.8287 7.8397 117.1980 52.1481 39.8631 174.2556 73 E 4.1669 8.5640 123.7570 57.9535 30.0802 178.2201 74 E 4.3671 8.6499 118.2596 57.1738 30.7012 175.9459 75 I 4.7187 7.4491 121.1967 59.4136 39.4378 175.0115 76 I 4.3645 8.5650 128.1417 59.8964 39.4346 174.3153 77 Y 4.5211 8.6669 124.9247 56.6653 39.9205 174.6952 78 I 4.8188 8.7235 124.0039 59.5151 40.7418 174.2551 79 L 5.1224 8.7407 127.5508 52.9334 44.3075 175.3360 80 D 5.6451 9.0630 123.0278 52.5699 44.5024 174.6623 81 Y 4.3472 9.0701 124.4808 57.8621 39.6317 174.0827 82 D 4.5926 8.0264 124.1638 54.8925 43.2712 175.4947 83 D 4.3624 7.0625 117.2903 53.0219 41.7160 175.5469 84 T 4.3143 8.5434 107.1582 64.0615 69.3144 174.9721 85 Q 4.6648 8.5824 119.1825 55.6602 29.6657 174.2187 86 H 5.7535 8.2031 114.6524 54.2894 33.5389 172.4734 87 I 4.8732 8.6069 114.7851 58.9842 41.6457 173.8292 88 L 5.2710 9.0417 122.1791 53.1508 44.7122 175.3765 89 M 5.0828 9.3177 124.0882 53.8360 34.8142 174.2828 90 Q 4.9818 9.1632 126.4626 54.4549 33.3086 173.7109 91 T 4.8358 8.6068 113.4079 59.9787 72.3831 172.6737 92 S 4.9315 8.5230 116.7514 56.8083 66.4150 173.0202 93 S 4.6562 8.5619 122.7706 58.2239 62.7464 174.5601 94 K 4.1823 9.3474 127.1760 58.4224 32.7093 177.0820 95 Q 4.4311 8.2217 117.4313 55.2386 30.2996 175.4258 96 G 3.7710 8.9107 107.6546 44.8671 0.0000 172.0414 97 I 4.1947 7.7401 119.2325 59.8191 38.0451 176.1120 98 G 4.2900 7.9451 115.1850 45.5833 0.0000 171.6052 99 T 4.8890 8.2670 121.9625 61.7518 72.3442 174.2130 100 S 4.3296 8.6948 121.8831 57.5243 63.8588 173.8729 101 R 4.0501 8.1830 121.4904 55.7102 30.5581 174.3577 102 P 4.3750 0.0000 0.0000 63.0820 32.0820 175.5020 103 I 4.5155 8.9261 126.2007 59.5233 39.3028 175.2312 104 V 4.4778 8.2934 126.9696 61.4390 32.7585 174.9784 105 Y 5.1111 9.2802 122.5323 56.1003 41.2192 174.3246 106 E 5.3453 9.4184 122.3594 54.3045 32.5805 175.3349 107 R 3.6968 9.0083 123.5669 56.6272 30.6538 175.9923 108 L 4.0755 8.6859 127.7178 54.6464 41.9931 177.7092 109 V 3.5875 8.3015 116.7153 61.8388 31.7272 173.0179 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 4.54 0.00 2.10 2.13 0.00 0.00 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.61 0.00 2 Y 8.30 4.60 0.00 2.93 2.89 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 3 Q 8.93 4.57 0.00 2.17 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.75 0.00 0.00 0.00 0.00 0.00 2.36 2.35 0.00 4 L 8.55 5.04 0.00 1.60 1.46 0.66 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 5 Q 8.83 4.60 0.00 2.19 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.53 6.71 0.00 0.00 0.00 0.00 0.00 2.27 2.42 0.00 6 F 8.87 4.86 0.00 3.10 3.05 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 7 I 9.02 4.16 1.58 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.40 0.46 0.00 0.00 0.00 8 N 9.24 5.23 0.00 3.07 2.86 0.00 0.00 6.79 6.36 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 9 L 8.80 4.72 0.00 1.91 1.80 0.69 -0.25 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 10 V 8.35 4.79 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 0.95 0.00 0.00 1.26 0.00 0.00 11 Y 7.97 4.64 0.00 2.99 2.88 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 0.00 0.00 0.00 12 D 8.46 4.86 0.00 2.71 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 13 T 8.74 4.08 4.49 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 1.38 0.00 0.00 14 T 8.18 3.97 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 1.27 0.00 0.00 15 K 8.09 4.31 0.00 1.95 1.92 0.00 1.72 0.00 0.00 1.75 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.44 7.81 16 L 7.52 4.91 0.00 1.64 1.52 0.84 0.85 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 17 T 8.72 4.21 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 1.24 0.00 0.00 18 H 8.78 4.08 0.00 3.25 3.37 0.00 5.87 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 L 7.84 3.81 0.00 1.76 1.60 0.86 0.95 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 20 E 8.08 3.86 0.00 2.13 1.87 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 2.19 2.27 0.00 21 Q 8.12 3.94 0.00 2.19 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.80 0.00 0.00 0.00 0.00 0.00 2.41 2.61 0.00 22 T 7.78 3.78 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 1.09 0.00 0.00 23 N 8.18 4.36 0.00 2.88 2.89 0.00 0.00 7.03 6.81 0.00 0.00 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 I 7.61 3.81 1.64 0.00 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.84 0.65 0.00 0.00 25 N 8.19 4.50 0.00 2.89 2.88 0.00 0.00 7.06 6.83 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 26 L 7.42 3.91 0.00 0.80 1.02 0.24 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 27 F 7.95 4.71 0.00 3.15 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 28 I 7.19 4.10 1.98 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.86 1.03 0.00 0.00 29 G 7.74 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 30 N 7.70 5.46 0.00 2.47 2.63 0.00 0.00 6.60 7.68 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 31 W 9.26 5.82 0.00 3.17 3.19 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 32 S 9.72 5.57 0.00 3.92 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 33 N 9.18 5.03 0.00 1.72 2.13 0.00 0.00 7.38 8.61 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 34 H 9.11 4.51 0.00 3.28 3.40 0.00 6.15 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 35 Q 8.16 3.95 0.00 2.10 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.97 0.00 0.00 0.00 0.00 0.00 2.33 2.42 0.00 36 L 8.28 4.08 0.00 1.50 1.64 0.90 1.26 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 37 Q 7.28 2.00 0.00 1.89 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.76 0.00 0.00 0.00 0.00 0.00 2.06 2.07 0.00 38 K 7.74 5.16 0.00 1.80 1.66 0.00 1.66 0.00 0.00 1.77 0.00 0.00 3.06 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.54 1.60 7.81 39 S 9.99 5.60 0.00 4.10 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 40 I 9.03 4.91 1.71 0.00 0.00 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.64 0.56 0.00 0.00 41 C 8.86 5.02 0.00 2.79 2.61 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 0.00 0.00 0.00 0.00 42 I 8.93 4.92 2.22 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 1.11 0.56 0.86 0.00 0.00 43 R 8.94 5.02 0.00 1.93 1.81 0.00 3.32 0.00 0.00 3.16 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.77 0.00 44 H 8.94 4.96 0.00 3.17 3.19 0.00 5.74 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 G 8.84 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 46 D 8.61 4.89 0.00 2.75 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 D 8.68 4.45 0.00 2.65 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 T 7.59 4.34 4.19 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 1.17 0.00 0.00 49 S 7.71 4.23 0.00 4.00 3.87 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 50 H 8.55 4.46 0.00 3.08 3.27 0.00 6.05 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 N 8.64 4.29 0.00 3.06 3.32 0.00 0.00 6.83 7.82 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 52 Q 7.86 5.04 0.00 2.28 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.85 0.00 0.00 0.00 0.00 0.00 2.55 2.59 0.00 53 Y 9.24 5.03 0.00 2.82 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 54 H 8.78 5.42 0.00 3.24 3.43 0.00 5.25 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 I 8.41 4.44 1.90 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 1.41 0.70 0.93 0.00 0.00 56 L 9.09 4.58 0.00 1.69 1.78 0.91 0.74 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 57 F 7.92 4.85 0.00 3.11 2.88 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 0.00 0.00 0.00 58 I 7.34 4.37 1.59 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.60 0.77 0.00 0.00 59 D 9.14 4.72 0.00 3.03 2.83 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 60 T 8.28 4.11 4.19 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 1.12 0.00 0.00 61 A 8.15 4.01 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 62 H 8.07 4.79 0.00 3.27 3.37 0.00 6.01 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 63 Q 7.68 4.29 0.00 2.49 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.77 0.00 0.00 0.00 0.00 0.00 2.35 2.23 0.00 64 R 8.42 5.40 0.00 1.97 1.82 0.00 3.12 0.00 0.00 3.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.84 0.00 65 I 8.47 5.07 1.83 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.30 0.61 0.86 0.00 0.00 66 K 8.94 5.15 0.00 1.80 1.69 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.88 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.31 1.41 7.81 67 F 8.37 5.42 0.00 3.20 3.06 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 0.00 0.00 0.00 68 S 8.88 5.25 0.00 3.95 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 69 S 8.47 4.45 0.00 3.47 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 70 F 7.68 4.79 0.00 3.17 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 71 D 8.10 4.49 0.00 2.64 2.76 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 72 N 7.84 4.83 0.00 2.72 2.68 0.00 0.00 7.18 7.53 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 73 E 8.56 4.17 0.00 2.06 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 2.44 2.33 0.00 74 E 8.65 4.37 0.00 2.06 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 2.31 2.43 0.00 75 I 7.45 4.72 1.83 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 1.11 0.52 0.46 0.00 0.00 76 I 8.57 4.36 1.75 0.00 0.00 0.81 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 0.59 0.80 0.00 0.00 77 Y 8.67 4.52 0.00 1.43 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 0.00 0.00 0.00 78 I 8.72 4.82 1.78 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.58 0.90 0.00 0.00 79 L 8.74 5.12 0.00 0.85 0.77 0.65 1.05 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 80 D 9.06 5.65 0.00 2.68 2.61 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 0.00 0.00 0.00 0.00 81 Y 9.07 4.35 0.00 2.90 2.83 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 82 D 8.03 4.59 0.00 2.55 2.61 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 0.00 0.00 0.00 0.00 83 D 7.06 4.36 0.00 2.90 2.69 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 84 T 8.54 4.31 4.31 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 1.34 0.00 0.00 85 Q 8.58 4.66 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.79 0.00 0.00 0.00 0.00 0.00 2.28 2.42 0.00 86 H 8.20 5.75 0.00 3.15 3.15 0.00 5.75 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 I 8.61 4.87 1.85 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.01 0.87 0.18 0.00 0.00 88 L 9.04 5.27 0.00 1.57 1.60 0.93 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 89 M 9.32 5.08 0.00 2.19 1.81 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.56 0.00 90 Q 9.16 4.98 0.00 2.08 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.49 0.00 0.00 0.00 0.00 0.00 2.15 2.39 0.00 91 T 8.61 4.84 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 0.57 0.00 0.00 92 S 8.52 4.93 0.00 3.76 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 S 8.56 4.66 0.00 3.76 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 94 K 9.35 4.18 0.00 1.79 1.80 0.00 1.94 0.00 0.00 1.74 0.00 0.00 2.96 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.43 1.36 7.81 95 Q 8.22 4.43 0.00 2.15 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.18 0.00 0.00 0.00 0.00 0.00 2.39 2.30 0.00 96 G 8.91 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 I 7.74 4.19 1.85 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 1.32 0.64 0.89 0.00 0.00 98 G 7.95 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 99 T 8.27 4.89 4.19 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 1.19 0.00 0.00 100 S 8.69 4.33 0.00 3.91 3.81 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.18 4.05 0.00 1.82 1.85 0.00 3.22 0.00 0.00 3.20 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 102 P 0.00 4.38 0.00 1.97 1.99 0.00 3.69 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 2.02 2.11 0.00 103 I 8.93 4.52 2.12 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 1.57 1.11 0.65 0.00 0.00 104 V 8.29 4.48 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 0.66 0.00 0.00 1.02 0.00 0.00 105 Y 9.28 5.11 0.00 2.90 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 0.00 106 E 9.42 5.35 0.00 2.00 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 0.00 2.51 2.32 0.00 107 R 9.01 3.70 0.00 1.59 1.70 0.00 3.06 0.00 0.00 2.95 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.52 0.00 108 L 8.69 4.08 0.00 1.47 1.52 0.87 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 109 V 8.30 3.59 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 0.56 0.00 0.00 0.85 0.00 0.00