NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 I 4.1939 8.0249 121.4508 61.2068 37.3916 173.9672 2 Q 4.8270 8.4185 123.3761 53.4618 32.2307 173.6027 3 R 4.7625 9.5868 122.3527 54.5852 34.3165 174.3668 4 T 4.8561 8.8842 118.3424 60.0561 68.3953 172.4091 5 P 4.8377 0.0000 0.0000 62.9139 32.3767 176.1163 6 K 4.4636 9.5893 122.6184 56.3610 33.7491 176.0078 7 I 5.1976 8.2390 122.5926 59.8592 40.8390 174.7266 8 Q 4.8147 9.3189 125.1746 54.1037 32.5808 174.3331 9 V 5.0496 8.4347 123.4004 61.4943 34.0024 173.8682 10 Y 5.3072 8.2562 124.4451 56.9249 41.6488 172.8657 11 S 5.1053 9.1016 114.3691 56.8038 64.8263 174.3263 12 R 4.1242 8.9019 122.5277 59.2475 30.2016 176.3083 13 H 5.1515 8.3387 113.2558 52.7023 32.1862 171.7115 14 P 4.3981 0.0000 0.0000 62.6986 31.6719 176.2873 15 A 4.4149 8.7319 125.8600 51.6165 19.1791 176.6369 16 E 4.6907 8.5748 120.7980 53.9548 32.0377 175.1948 17 N 4.5807 8.8877 120.8973 55.1061 38.9222 175.4688 18 G 3.9084 9.5076 111.4947 45.3293 0.0000 173.1077 19 K 4.4112 7.7000 119.6599 54.1188 33.5062 176.2675 20 S 4.0899 8.3452 118.6266 58.7029 63.1221 172.7047 21 N 4.9839 8.7446 123.3670 53.0734 42.8501 172.0088 22 F 5.1901 8.9263 116.3606 55.6938 42.9034 174.0498 23 L 3.8218 8.7201 126.6484 53.9134 43.1698 174.8578 24 N 5.3878 8.8300 124.0598 51.4849 41.6072 172.9869 25 C 5.2500 9.5881 122.8405 55.1072 45.6341 171.7579 26 Y 5.5615 9.3704 128.7021 56.2140 40.5692 174.4830 27 V 5.1526 8.8245 120.7626 59.7181 34.5911 175.1064 28 S 5.2560 8.4412 118.2085 58.1908 66.8236 174.8504 29 G 4.2437 8.8934 107.2132 46.7757 0.0000 173.1345 30 F 5.3135 7.3644 114.1375 55.6805 41.0720 174.1257 31 H 5.2536 8.9605 118.1778 54.8585 33.8030 172.1668 32 P 4.7767 0.0000 0.0000 62.5828 32.2598 175.8114 33 S 4.0506 8.3493 112.6833 60.0707 63.4292 174.3588 34 D 4.4416 7.8729 121.6768 54.3816 40.9860 175.1408 35 I 4.5855 7.9351 122.5334 59.7483 41.3194 172.8920 36 E 4.5835 9.0254 129.2522 54.3084 31.9846 174.6518 37 V 4.5605 7.9563 126.0363 61.0343 34.2359 174.0091 38 D 4.9671 8.7757 127.3218 52.4343 44.2399 174.9800 39 L 4.9405 8.3245 121.9139 53.5235 43.9029 175.2943 40 L 5.1929 9.4125 124.5090 52.7894 44.9868 175.4386 41 K 4.2995 8.9365 124.7304 54.4226 34.3683 175.8008 42 N 4.1945 9.6764 128.2421 54.2976 36.5966 175.4478 43 G 4.0413 8.4496 106.2324 45.1837 0.0000 173.7992 44 E 4.5261 7.6003 118.3624 54.5123 31.2681 174.9713 45 R 4.5207 8.2411 122.1342 56.2903 30.7413 176.0703 46 I 4.1010 8.7794 128.3714 61.3236 36.5072 175.3967 47 E 4.4601 8.7644 125.1988 55.2641 31.9740 176.0397 48 K 3.8927 8.6492 119.3163 57.3488 29.6410 176.1539 49 V 3.6886 7.1260 117.0446 63.2878 32.1292 175.2467 50 E 4.6447 8.5111 127.0460 55.0941 32.1877 174.3595 51 H 5.3887 7.8808 115.4164 53.5569 31.8197 173.0063 52 S 4.5114 8.9676 115.2931 58.3648 63.8535 173.5063 53 D 4.5839 8.4667 120.0552 53.4008 41.4148 176.3828 54 L 4.1273 8.4055 125.1829 55.7897 42.7763 176.0430 55 S 4.8052 8.3156 119.8587 57.0207 67.9289 172.3557 56 F 5.2255 7.6734 114.2598 55.9874 41.0380 174.2139 57 S 4.7632 9.0668 116.8110 56.7862 64.6033 175.6109 58 K 3.6859 8.4695 120.2251 59.6329 31.6460 177.9030 59 D 4.4199 7.8247 115.4248 52.9470 39.4393 177.1444 60 W 3.7631 8.0995 119.6571 56.7788 27.9318 174.5694 61 S 4.4715 8.1881 114.0647 58.0214 64.2712 173.9397 62 F 4.9863 8.7351 121.2864 57.2654 40.6134 174.2016 63 Y 5.4585 8.4228 117.5578 56.2117 41.6270 173.7609 64 L 4.9908 9.5370 120.3758 53.5275 47.1559 174.3475 65 L 5.3893 9.2075 124.9346 53.8523 44.4434 174.5160 66 Y 5.2956 9.4302 125.0624 56.8794 40.3733 174.4447 67 Y 5.8759 8.7797 120.2485 56.7800 42.1085 173.4665 68 T 4.9856 8.3406 113.8102 60.5261 71.1230 172.6251 69 E 3.9683 8.5798 127.5659 56.6748 30.2258 176.0724 70 F 4.7953 8.9109 117.0535 56.1597 41.6048 173.3927 71 T 4.4548 8.1469 116.5399 60.7069 70.8021 171.7511 72 P 4.6146 0.0000 0.0000 62.9224 32.7869 175.6220 73 T 4.8948 8.4513 110.7569 59.5389 72.1041 173.4473 74 E 4.1348 8.8550 121.8962 58.4717 29.9292 177.4692 75 K 4.2693 7.9973 116.5729 58.5226 33.7278 177.0066 76 D 4.4875 7.5731 119.2084 54.2736 41.0980 175.4837 77 E 4.7037 8.8935 124.3001 55.6230 31.3717 175.0629 78 Y 5.3450 8.8215 119.9013 56.6284 42.0517 174.2543 79 A 5.0700 8.8953 122.3660 51.3781 23.7514 174.0312 80 C 5.3363 9.3737 119.4870 54.7565 47.9203 172.5749 81 R 5.0665 9.1236 126.4910 54.5542 32.3070 174.2525 82 V 4.7467 9.0860 126.7313 60.9971 34.4205 173.6348 83 N 5.3258 9.1214 126.1101 52.1896 42.1856 172.4086 84 H 5.2053 8.4904 123.3981 54.2881 33.5047 174.2103 85 V 3.5824 8.2376 121.7568 64.8060 31.1764 177.4751 86 T 4.1052 7.9735 109.2469 62.6482 69.1858 173.4733 87 L 4.7399 7.6384 123.5197 52.7553 43.3011 176.8442 88 S 4.3081 8.7833 119.0900 60.2847 63.4721 174.2952 89 Q 4.6095 7.5955 116.6777 52.9605 31.4120 172.8587 90 P 4.4361 0.0000 0.0000 63.2044 32.2362 175.4664 91 K 4.3954 9.1586 126.2011 55.3681 33.6767 175.0060 92 I 4.9147 8.3556 128.1643 59.6136 39.3034 175.0845 93 V 4.4508 8.8167 126.8787 60.9502 34.1228 174.8027 94 K 4.6715 8.7742 127.3068 55.6064 33.2699 176.4669 95 W 4.5451 9.5649 135.0000 57.3815 31.4947 174.9292 96 D 4.4633 8.5042 126.9540 51.8673 42.0219 176.4656 97 R 3.6958 7.6219 123.8568 58.4430 29.3612 176.9035 98 D 4.7361 8.1389 117.4657 54.3828 41.1147 176.3519 99 M 4.3756 8.0538 125.2021 55.5252 32.7605 175.1848 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 I 8.02 4.19 1.82 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 1.40 1.02 0.83 0.00 0.00 2 Q 8.42 4.83 0.00 2.02 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.32 6.66 0.00 0.00 0.00 0.00 0.00 2.30 2.49 0.00 3 R 9.59 4.76 0.00 1.90 1.98 0.00 3.16 0.00 0.00 3.16 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 4 T 8.88 4.86 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 1.25 0.00 0.00 5 P 0.00 4.84 0.00 2.03 1.75 0.00 3.78 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.76 0.00 6 K 9.59 4.46 0.00 1.84 1.82 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.87 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.50 1.48 7.81 7 I 8.24 5.20 1.92 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 1.34 0.61 0.97 0.00 0.00 8 Q 9.32 4.81 0.00 2.33 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.76 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 9 V 8.43 5.05 2.32 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 0.97 0.00 0.00 1.11 0.00 0.00 10 Y 8.26 5.31 0.00 3.29 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 11 S 9.10 5.11 0.00 4.31 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 12 R 8.90 4.12 0.00 1.85 2.22 0.00 3.09 0.00 0.00 3.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.45 0.00 13 H 8.34 5.15 0.00 3.38 3.20 0.00 5.72 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 P 0.00 4.40 0.00 2.11 2.06 0.00 3.77 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.16 0.00 15 A 8.73 4.41 1.66 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 0.00 0.00 16 E 8.57 4.69 0.00 2.12 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 0.00 2.27 2.29 0.00 17 N 8.89 4.58 0.00 2.75 2.85 0.00 0.00 7.19 7.65 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 18 G 9.51 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 19 K 7.70 4.41 0.00 1.93 1.70 0.00 1.60 0.00 0.00 1.62 0.00 0.00 2.85 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.37 7.81 20 S 8.35 4.09 0.00 3.79 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 21 N 8.74 4.98 0.00 2.64 2.25 0.00 0.00 6.85 7.31 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 22 F 8.93 5.19 0.00 3.01 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 23 L 8.72 3.82 0.00 0.27 0.75 -0.25 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 24 N 8.83 5.39 0.00 1.44 1.99 0.00 0.00 5.96 7.99 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 25 C 9.59 5.25 0.00 2.91 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 26 Y 9.37 5.56 0.00 3.35 3.13 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.82 5.15 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 0.69 0.00 0.00 1.14 0.00 0.00 28 S 8.44 5.26 0.00 3.83 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 29 G 8.89 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 0.00 0.00 0.00 0.00 30 F 7.36 5.31 0.00 3.05 3.13 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.96 5.25 0.00 3.33 3.24 0.00 5.58 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 P 0.00 4.78 0.00 2.12 2.16 0.00 3.91 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 33 S 8.35 4.05 0.00 3.24 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 34 D 7.87 4.44 0.00 2.65 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 35 I 7.94 4.59 1.47 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.51 0.82 0.00 0.00 36 E 9.03 4.58 0.00 1.97 1.67 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 0.00 2.09 2.13 0.00 37 V 7.96 4.56 0.67 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 0.46 0.00 0.00 0.52 0.00 0.00 38 D 8.78 4.97 0.00 2.53 2.45 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 39 L 8.32 4.94 0.00 1.56 1.53 0.88 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 40 L 9.41 5.19 0.00 1.51 1.53 0.91 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 41 K 8.94 4.30 0.00 1.82 1.61 0.00 1.95 0.00 0.00 1.67 0.00 0.00 2.82 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.09 0.72 7.81 42 N 9.68 4.19 0.00 2.77 2.79 0.00 0.00 7.22 7.77 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 43 G 8.45 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 E 7.60 4.53 0.00 2.02 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 2.37 2.35 0.00 45 R 8.24 4.52 0.00 1.80 1.82 0.00 3.24 0.00 0.00 3.21 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 46 I 8.78 4.10 1.87 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.82 0.93 0.00 0.00 47 E 8.76 4.46 0.00 1.91 1.84 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 2.33 2.32 0.00 48 K 8.65 3.89 0.00 1.87 1.88 0.00 1.63 0.00 0.00 1.63 0.00 0.00 3.06 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.33 1.46 7.81 49 V 7.13 3.69 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 0.82 0.00 0.00 0.96 0.00 0.00 50 E 8.51 4.64 0.00 1.16 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 2.10 2.06 0.00 51 H 7.88 5.39 0.00 2.42 1.84 0.00 5.73 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 S 8.97 4.51 0.00 3.96 4.06 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 53 D 8.47 4.58 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 54 L 8.41 4.13 0.00 1.66 1.62 0.91 0.72 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 55 S 8.32 4.81 0.00 2.72 3.37 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 56 F 7.67 5.23 0.00 2.68 2.31 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 57 S 9.07 4.76 0.00 4.13 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 58 K 8.47 3.69 0.00 1.63 1.71 0.00 1.67 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.31 1.34 7.81 59 D 7.82 4.42 0.00 2.78 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 60 W 8.10 3.76 0.00 3.27 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 61 S 8.19 4.47 0.00 3.87 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 62 F 8.74 4.99 0.00 1.77 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 0.00 0.00 0.00 0.00 63 Y 8.42 5.46 0.00 2.91 2.91 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 64 L 9.54 4.99 0.00 1.89 1.72 1.17 0.39 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 65 L 9.21 5.39 0.00 2.07 1.71 1.12 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 66 Y 9.43 5.30 0.00 2.98 2.86 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 67 Y 8.78 5.88 0.00 3.16 3.10 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 68 T 8.34 4.99 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 1.06 0.00 0.00 69 E 8.58 3.97 0.00 1.66 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 1.47 1.77 0.00 70 F 8.91 4.80 0.00 2.78 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 71 T 8.15 4.45 4.16 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 1.14 0.00 0.00 72 P 0.00 4.61 0.00 2.31 2.18 0.00 3.40 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.71 0.00 73 T 8.45 4.89 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 1.31 0.00 0.00 74 E 8.85 4.13 0.00 1.98 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 2.32 2.26 0.00 75 K 8.00 4.27 0.00 1.91 1.93 0.00 1.64 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.38 1.46 7.81 76 D 7.57 4.49 0.00 2.97 2.42 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 0.00 0.00 0.00 0.00 77 E 8.89 4.70 0.00 1.92 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 2.33 2.29 0.00 78 Y 8.82 5.34 0.00 3.19 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 79 A 8.90 5.07 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 80 C 9.37 5.34 0.00 2.96 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 81 R 9.12 5.07 0.00 1.81 1.68 0.00 3.06 0.00 0.00 3.07 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.50 0.00 82 V 9.09 4.75 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 0.76 0.00 0.00 0.83 0.00 0.00 83 N 9.12 5.33 0.00 2.76 2.53 0.00 0.00 6.26 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 84 H 8.49 5.21 0.00 3.04 3.01 0.00 5.74 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 8.24 3.58 1.98 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 0.76 0.00 0.00 0.90 0.00 0.00 86 T 7.97 4.11 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 87 L 7.64 4.74 0.00 1.90 1.81 0.94 0.73 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 88 S 8.78 4.31 0.00 3.97 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 89 Q 7.60 4.61 0.00 2.11 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.91 0.00 0.00 0.00 0.00 0.00 2.21 2.34 0.00 90 P 0.00 4.44 0.00 1.93 2.01 0.00 3.65 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 2.01 2.07 0.00 91 K 9.16 4.40 0.00 1.79 1.65 0.00 1.60 0.00 0.00 1.66 0.00 0.00 2.85 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.41 7.81 92 I 8.36 4.91 1.88 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 1.22 0.74 0.96 0.00 0.00 93 V 8.82 4.45 2.14 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 1.12 0.00 0.00 0.97 0.00 0.00 94 K 8.77 4.67 0.00 1.74 1.80 0.00 1.82 0.00 0.00 1.66 0.00 0.00 2.82 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.48 1.48 7.81 95 W 9.56 4.55 0.00 3.28 3.46 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 0.00 0.00 0.00 0.00 96 D 8.50 4.46 0.00 2.60 2.42 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 0.00 0.00 0.00 0.00 97 R 7.62 3.70 0.00 1.84 1.29 0.00 2.97 0.00 0.00 3.16 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.51 0.00 98 D 8.14 4.74 0.00 2.75 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 99 M 8.05 4.38 0.00 1.99 1.93 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 2.57 2.63 0.00