NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -2 S 4.4913 8.2929 117.1110 57.8133 63.8925 174.4986 -1 S 4.3431 9.0045 127.0775 62.2984 61.8430 171.4717 0 G 3.8905 8.9752 110.5354 47.9784 0.0000 174.9968 1 N 4.2300 8.0794 118.9517 55.7186 38.4284 177.6696 2 W 4.4654 7.8745 119.7788 59.4971 29.1013 178.6212 3 I 3.6216 7.8384 120.2036 64.4084 36.5318 178.1161 4 D 4.1429 7.7108 119.4366 57.0961 40.5935 178.9712 5 V 3.5489 7.7314 118.7631 66.0957 31.5129 178.0906 6 R 3.8377 8.2114 118.4807 59.6650 29.9226 178.0049 7 Y 4.4403 8.3897 116.8390 61.3415 37.8275 178.4312 8 D 4.4097 8.3393 119.8538 57.3023 41.0343 178.8042 9 L 3.9190 7.9312 119.5832 57.6953 41.6242 179.3979 10 E 4.5378 8.5027 122.6312 59.4974 29.3805 180.2055 11 K 4.0458 8.0516 123.7509 59.7294 31.6460 181.2950 12 I 3.9776 7.7561 120.6323 64.2468 37.0002 178.2406 13 E 3.8848 7.9969 119.0926 59.5600 29.2680 179.6775 14 S 4.0719 7.8497 114.3551 61.5653 62.9939 176.4233 15 L 4.0068 8.4181 122.2469 57.9677 41.2733 179.1950 16 I 4.1304 7.7092 108.8567 61.9329 37.6848 177.3410 17 Q 4.2365 8.1374 120.3853 57.9453 28.5401 176.7155 18 S 4.8174 7.6373 114.6953 57.8650 63.6642 173.6354 19 I 4.5880 7.3782 120.0362 59.4106 40.3267 174.6594 20 H 4.3776 8.9838 125.0815 56.0821 30.1325 174.2889 21 I 4.5977 8.2689 127.4765 59.7239 39.4983 174.8286 22 D 4.9264 8.8563 124.5714 53.1400 39.7672 175.2061 23 T 4.6046 7.9351 116.5869 63.0558 70.3635 173.6734 24 T 4.9225 8.3576 115.6579 60.0461 71.3713 173.4765 25 L 4.6846 8.7635 122.6325 52.7417 46.6961 175.2774 26 Y 4.7024 9.0222 119.9079 59.2110 38.3422 176.0799 27 T 4.3078 8.8846 121.9123 61.7739 71.0502 173.9769 28 D 4.6846 8.1622 127.0532 53.0218 40.4932 175.6975 29 S 4.6535 8.5353 122.5228 59.6117 63.9080 175.0151 30 D 4.4875 7.7594 118.8447 51.3931 38.9593 174.5220 31 F 4.7059 6.8166 119.1004 56.4396 40.1318 176.1306 32 H 4.4386 8.6951 121.6802 55.2483 30.3461 174.6614 33 P 4.3974 0.0000 0.0000 65.6349 31.2536 177.3776 34 S 4.4612 8.1248 112.9212 59.7609 63.2650 174.9528 35 C 5.2726 8.4368 118.3905 56.1910 42.2115 176.0053 36 K 3.4468 8.2222 123.1764 60.1667 31.9360 178.9361 37 V 3.7883 8.1868 119.2758 65.9433 31.5221 178.2454 38 T 3.8795 8.3832 115.5106 66.2977 68.2672 176.5625 39 A 3.7936 8.0092 122.7297 55.3921 18.4033 179.0877 40 M 3.8248 7.9742 116.7257 59.1773 32.1596 178.2373 41 N 4.3941 8.2718 116.2728 56.3978 38.5674 176.8698 42 C 4.2839 7.9761 117.9100 59.8408 34.6586 176.0124 43 F 3.9879 7.8921 119.3253 60.5823 38.1264 177.7007 44 L 4.2269 7.8444 117.1901 57.7924 41.7924 179.1108 45 L 4.1611 8.1940 120.2998 58.2739 42.0975 178.9258 46 E 4.0841 8.6599 118.5653 59.1654 29.4468 179.2044 47 L 4.1629 8.0703 119.1163 57.8325 41.4971 179.1264 48 Q 4.0382 8.1036 117.9875 59.1682 28.5956 179.4725 49 V 3.5572 7.8031 118.9211 66.1687 31.4989 178.1777 50 I 3.7703 7.5571 119.0146 64.4199 36.6462 178.4678 51 L 4.0881 7.8453 118.5123 57.7022 41.5352 178.3324 52 H 4.3572 7.7032 117.7448 58.5165 30.0464 176.3628 53 E 4.0249 8.1305 118.0574 56.3507 29.9619 175.9789 54 Y 4.7613 7.2293 115.8077 56.2272 41.6860 175.3064 55 S 4.5458 8.7791 118.3422 58.4580 64.2921 174.8959 56 N 4.3128 8.4371 125.0807 56.0531 37.9841 180.4393 57 M 4.2610 8.8440 127.6673 59.6169 31.4173 175.2590 58 T 4.1045 7.8312 116.2949 66.0341 68.6604 176.4403 59 L 3.9386 7.8937 121.7805 58.3280 42.1094 178.4275 60 N 4.2988 8.2705 116.3144 56.4674 38.5623 176.9440 61 E 3.9400 8.1589 120.3800 59.7150 29.8083 179.0426 62 T 3.9162 8.3082 116.1572 66.4907 68.5056 176.9309 63 V 3.6343 8.2259 120.6149 66.2028 31.5629 178.3363 64 R 3.6509 8.1587 117.9273 59.0717 29.7972 178.5315 65 N 4.4731 8.1037 116.9355 56.8323 38.8520 177.3430 66 V 3.7311 7.7235 113.2270 63.9033 31.5169 178.6530 67 L 4.0310 7.5725 118.7097 57.8624 41.4705 178.9810 68 Y 4.3791 8.0132 117.0526 61.1990 37.8577 178.4605 69 L 3.8751 8.1239 119.5281 57.7793 41.6894 179.3275 70 A 3.5591 8.2525 120.6414 55.3409 18.4014 179.4314 71 N 4.3035 8.5039 115.2224 56.5611 38.6087 177.6188 72 S 4.1005 8.1419 114.5129 61.6364 62.3010 176.4402 73 T 3.7811 7.8092 118.4671 66.5174 67.9432 176.9745 74 L 4.2658 8.1482 122.5048 58.2365 41.6798 180.0040 75 S 4.4670 8.0773 120.7817 63.8503 62.4589 180.1535 76 S 4.5017 8.3942 124.3720 62.3349 63.0647 178.2833 77 N 4.9336 6.9090 122.9918 52.3969 36.2296 178.0171 78 K 4.6628 7.6964 125.7816 54.3678 34.3077 178.6351 79 N 4.8843 8.2693 119.6744 51.9847 39.6593 175.2858 80 V 3.8088 8.5018 114.0915 62.9450 32.0475 171.4657 81 A 4.9051 8.2580 118.8657 51.8785 21.1782 175.6590 82 E 4.8038 8.5680 120.2812 54.5720 32.1258 175.6537 83 S 4.5982 8.0664 115.1610 57.8173 66.2236 174.2696 84 G 3.8640 8.9206 108.3594 45.9081 0.0000 174.1395 85 C 4.7517 7.6182 116.0123 54.9941 42.0124 173.5758 86 K 4.4501 8.1611 120.5192 56.1914 32.6759 177.0286 87 E 4.3281 8.8264 120.5018 55.6826 30.6488 177.5779 88 C 4.0758 8.5499 118.6437 60.2919 40.3369 175.5925 89 E 2.5423 7.5680 115.4857 56.8675 28.9975 177.0105 90 E 4.2526 7.6134 118.3189 56.9323 30.1904 176.8184 91 L 4.2629 7.3037 121.3470 54.8147 42.5700 177.0576 92 E 4.4523 8.5255 118.7830 56.5674 31.1657 176.5817 93 E 4.7850 8.8658 124.7165 56.0462 30.9152 176.4139 94 K 4.9555 8.9308 125.8077 53.1567 37.0623 174.7835 95 T 4.2892 8.3214 107.5920 62.6016 69.3569 175.2391 96 F 4.4906 8.5488 123.4663 61.9144 39.2090 177.8109 97 T 3.7470 7.9773 114.8631 66.7905 68.3774 176.3361 98 E 4.0553 8.2025 120.1508 59.1472 29.3874 179.1277 99 F 4.3216 8.8258 121.2929 61.4915 39.4269 177.1750 100 L 3.9838 8.4721 118.9607 57.8282 41.3633 179.5643 101 Q 3.9439 8.0716 117.9401 59.2428 28.6242 179.1672 102 S 4.1964 8.1184 116.1163 61.2628 62.7773 176.5571 103 F 2.6974 7.9987 123.5610 61.0048 39.0700 177.3372 104 I 3.6093 8.0726 122.2195 64.7928 36.6637 179.3853 105 R 3.9350 7.9093 121.6716 61.3383 29.2912 181.5541 106 I 4.0445 7.9703 120.1214 63.9456 37.9251 178.0163 107 V 3.1463 7.7384 119.2127 66.0428 31.2175 177.7599 108 Q 3.9531 8.1300 119.1964 59.3734 28.7673 178.2044 109 M 4.1216 7.8562 119.7050 58.3605 31.7764 178.7363 110 F 3.7007 8.0670 117.0286 60.2776 39.3005 177.5298 111 I 3.9746 8.0372 119.6649 64.5620 36.7599 178.0993 112 N 4.3973 8.5277 116.3158 56.1342 38.4239 176.7311 113 T 4.5140 7.8385 110.6630 62.4786 69.4176 176.0519 114 S 4.5525 7.6871 126.5686 61.0287 62.6692 177.1301 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 S 8.29 4.49 0.00 3.67 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 -1 S 9.00 4.34 0.00 3.80 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 G 8.98 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 1 N 8.08 4.23 0.00 2.62 2.37 0.00 0.00 7.09 7.22 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 2 W 7.87 4.47 0.00 3.52 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 3 I 7.84 3.62 1.87 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 1.45 0.80 0.22 0.00 0.00 4 D 7.71 4.14 0.00 2.72 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 5 V 7.73 3.55 2.47 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 1.02 0.00 0.00 0.95 0.00 0.00 6 R 8.21 3.84 0.00 2.10 2.08 0.00 3.44 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 7 Y 8.39 4.44 0.00 3.13 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 8 D 8.34 4.41 0.00 2.88 2.71 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 0.00 0.00 0.00 0.00 9 L 7.93 3.92 0.00 1.69 1.48 -0.03 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 10 E 8.50 4.54 0.00 2.11 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 2.29 2.33 0.00 11 K 8.05 4.05 0.00 1.79 1.82 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.35 7.81 12 I 7.76 3.98 2.01 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.72 1.05 0.00 0.00 13 E 8.00 3.88 0.00 2.23 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 2.23 2.45 0.00 14 S 7.85 4.07 0.00 4.03 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 15 L 8.42 4.01 0.00 1.83 1.74 0.93 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 16 I 7.71 4.13 1.92 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 1.84 0.54 1.11 0.00 0.00 17 Q 8.14 4.24 0.00 2.17 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.56 7.36 0.00 0.00 0.00 0.00 0.00 2.39 2.68 0.00 18 S 7.64 4.82 0.00 3.83 3.82 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 19 I 7.38 4.59 1.81 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 1.30 0.75 0.83 0.00 0.00 20 H 8.98 4.38 0.00 3.10 3.31 0.00 5.86 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 21 I 8.27 4.60 1.90 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.09 0.94 0.00 0.00 22 D 8.86 4.93 0.00 2.73 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 23 T 7.94 4.60 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 1.10 0.00 0.00 24 T 8.36 4.92 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 1.20 0.00 0.00 25 L 8.76 4.68 0.00 1.17 1.35 0.16 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 26 Y 9.02 4.70 0.00 2.81 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 27 T 8.88 4.31 4.37 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 1.39 0.00 0.00 28 D 8.16 4.68 0.00 2.50 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 29 S 8.54 4.65 0.00 3.95 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 30 D 7.76 4.49 0.00 2.62 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 F 6.82 4.71 0.00 3.20 3.72 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 32 H 8.70 4.44 0.00 3.29 3.30 0.00 5.87 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 P 0.00 4.40 0.00 2.19 2.15 0.00 3.20 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.85 0.00 34 S 8.12 4.46 0.00 4.06 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 35 C 8.44 5.27 0.00 3.17 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 36 K 8.22 3.45 0.00 1.96 2.09 0.00 0.90 0.00 0.00 1.57 0.00 0.00 2.80 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.54 1.40 7.81 37 V 8.19 3.79 2.36 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 1.12 0.00 0.00 1.04 0.00 0.00 38 T 8.38 3.88 4.37 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 1.18 0.00 0.00 39 A 8.01 3.79 1.06 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 0.00 0.00 40 M 7.97 3.82 0.00 2.15 1.59 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.29 0.00 41 N 8.27 4.39 0.00 3.06 2.86 0.00 0.00 7.06 6.96 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 42 C 7.98 4.28 0.00 2.91 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 43 F 7.89 3.99 0.00 2.51 1.45 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 0.00 44 L 7.84 4.23 0.00 1.83 1.86 1.08 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 45 L 8.19 4.16 0.00 1.93 1.92 0.95 0.88 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 46 E 8.66 4.08 0.00 2.42 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 2.58 2.68 0.00 47 L 8.07 4.16 0.00 2.09 1.88 1.24 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 48 Q 8.10 4.04 0.00 2.17 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.80 0.00 0.00 0.00 0.00 0.00 2.51 2.57 0.00 49 V 7.80 3.56 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 0.94 0.00 0.00 50 I 7.56 3.77 1.93 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 0.50 0.38 0.81 0.00 0.00 51 L 7.85 4.09 0.00 1.80 1.74 0.90 1.04 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 52 H 7.70 4.36 0.00 3.06 3.40 0.00 5.94 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 E 8.13 4.02 0.00 1.61 1.18 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 2.14 2.32 0.00 54 Y 7.23 4.76 0.00 2.85 2.78 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.78 4.55 0.00 3.97 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 56 N 8.44 4.31 0.00 2.75 2.80 0.00 0.00 6.95 7.66 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 57 M 8.84 4.26 0.00 2.01 2.12 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.22 0.00 58 T 7.83 4.10 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 1.22 0.00 0.00 59 L 7.89 3.94 0.00 1.74 1.83 0.96 0.47 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 60 N 8.27 4.30 0.00 3.12 2.88 0.00 0.00 6.75 7.18 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 61 E 8.16 3.94 0.00 2.26 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 0.00 2.35 2.40 0.00 62 T 8.31 3.92 4.37 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 1.23 0.00 0.00 63 V 8.23 3.63 2.23 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 1.10 0.00 0.00 1.07 0.00 0.00 64 R 8.16 3.65 0.00 1.89 1.37 0.00 3.20 0.00 0.00 3.05 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.72 0.00 65 N 8.10 4.47 0.00 2.98 3.07 0.00 0.00 7.18 7.24 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 66 V 7.72 3.73 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 0.84 0.00 0.00 1.00 0.00 0.00 67 L 7.57 4.03 0.00 1.58 1.64 0.88 1.18 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 68 Y 8.01 4.38 0.00 3.11 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 69 L 8.12 3.88 0.00 1.80 1.55 1.01 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 70 A 8.25 3.56 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 71 N 8.50 4.30 0.00 2.83 2.93 0.00 0.00 6.71 7.46 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 72 S 8.14 4.10 0.00 3.90 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 73 T 7.81 3.78 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 0.83 0.00 0.00 74 L 8.15 4.27 0.00 1.70 1.86 1.10 1.61 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 75 S 8.08 4.47 0.00 3.73 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 76 S 8.39 4.50 0.00 3.72 3.60 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 77 N 6.91 4.93 0.00 2.70 2.68 0.00 0.00 7.04 7.33 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 78 K 7.70 4.66 0.00 1.77 1.61 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.32 0.99 7.81 79 N 8.27 4.88 0.00 2.67 2.49 0.00 0.00 6.57 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 80 V 8.50 3.81 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 0.88 0.00 0.00 0.93 0.00 0.00 81 A 8.26 4.91 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 82 E 8.57 4.80 0.00 1.95 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 2.22 2.27 0.00 83 S 8.07 4.60 0.00 3.90 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 84 G 8.92 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 85 C 7.62 4.75 0.00 2.96 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 86 K 8.16 4.45 0.00 1.72 1.69 0.00 1.75 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.46 7.81 87 E 8.83 4.33 0.00 1.90 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 2.37 2.37 0.00 88 C 8.55 4.08 0.00 2.75 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 89 E 7.57 2.54 0.00 1.72 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.06 0.00 90 E 7.61 4.25 0.00 2.01 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 2.24 2.18 0.00 91 L 7.30 4.26 0.00 1.79 1.65 0.82 0.81 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 92 E 8.53 4.45 0.00 1.66 1.82 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 2.31 1.91 0.00 93 E 8.87 4.79 0.00 1.79 1.79 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 1.73 2.14 0.00 94 K 8.93 4.96 0.00 1.39 1.60 0.00 1.82 0.00 0.00 1.70 0.00 0.00 2.79 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.26 1.23 7.81 95 T 8.32 4.29 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 1.26 0.00 0.00 96 F 8.55 4.49 0.00 3.20 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 97 T 7.98 3.75 4.28 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 1.21 0.00 0.00 98 E 8.20 4.06 0.00 2.27 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 0.00 2.37 2.36 0.00 99 F 8.83 4.32 0.00 3.26 3.32 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 0.00 100 L 8.47 3.98 0.00 1.73 1.54 0.42 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 101 Q 8.07 3.94 0.00 2.29 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 102 S 8.12 4.20 0.00 4.10 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 0.00 103 F 8.00 2.70 0.00 2.47 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 I 8.07 3.61 1.98 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 1.23 0.52 0.86 0.00 0.00 105 R 7.91 3.94 0.00 1.83 1.93 0.00 3.27 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.51 0.00 106 I 7.97 4.04 1.93 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.23 0.45 0.00 0.00 107 V 7.74 3.15 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 1.03 0.00 0.00 0.77 0.00 0.00 108 Q 8.13 3.95 0.00 2.34 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.58 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 109 M 7.86 4.12 0.00 2.14 2.44 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 2.84 2.62 0.00 110 F 8.07 3.70 0.00 2.32 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 0.00 0.00 0.00 0.00 111 I 8.04 3.97 2.09 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.21 0.96 0.00 0.00 112 N 8.53 4.40 0.00 2.82 2.88 0.00 0.00 7.07 7.43 0.00 0.00 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 T 7.84 4.51 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 1.20 0.00 0.00 114 S 7.69 4.55 0.00 3.75 3.66 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