NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2265 8.2649 123.5814 51.4821 20.3562 176.3710 2 I 3.9225 7.6602 119.0802 60.6795 37.0588 173.8130 3 Q 4.7805 9.3758 125.6216 54.3051 32.9978 174.6197 4 R 4.8486 9.1354 124.1752 53.5162 32.9728 174.2386 5 P 5.1885 0.0000 0.0000 61.1896 32.5553 174.2569 6 P 4.7186 0.0000 0.0000 62.9163 32.3327 175.6644 7 K 4.4147 8.8695 121.5666 55.1607 34.5022 175.6066 8 I 5.1023 7.9847 122.4072 59.8354 40.7271 174.5667 9 Q 4.9127 9.5401 125.9713 54.1087 31.6915 174.5927 10 V 5.0743 8.4592 123.7105 61.5190 33.5249 174.0743 11 Y 5.1925 8.5517 124.2881 56.3872 41.4592 173.4355 12 S 4.7524 8.9892 115.4664 57.4529 64.3996 173.9552 13 R 4.1320 9.1725 123.7004 59.5479 29.9992 176.3366 14 H 5.0996 8.3161 112.7220 52.6888 31.7769 172.0798 15 P 4.3992 0.0000 0.0000 62.6220 31.5718 174.7177 16 P 4.7761 0.0000 0.0000 62.2400 32.7250 175.4289 17 E 4.6799 8.4233 117.4445 54.6565 32.6297 174.1562 18 D 4.6094 8.8910 122.0782 56.3216 41.2517 177.9685 19 G 3.8195 8.6969 110.9315 45.5010 0.0000 173.0165 20 K 4.3140 7.8070 121.5716 53.7833 32.9453 174.3328 21 P 4.2349 0.0000 0.0000 63.0000 32.2426 175.1749 22 N 4.7014 8.1758 119.2810 53.4155 43.0711 171.9251 23 Y 5.0852 9.4461 116.0458 56.2712 42.1059 174.4761 24 L 4.2087 8.9824 126.5403 53.4174 43.9194 174.7971 25 N 5.2836 8.7836 123.2276 51.3621 42.4822 172.6746 26 C 5.2578 9.2702 123.0185 55.0929 47.7834 171.7320 27 Y 5.4819 9.4481 129.3315 56.5618 40.2281 174.3113 28 V 5.0668 9.0683 126.9416 61.3342 34.7286 173.7858 29 Y 5.2747 8.8187 124.8122 56.8588 41.7499 175.6609 30 G 4.2599 8.7964 107.0123 46.6513 0.0000 173.4182 31 F 5.2675 7.3947 114.4287 56.0084 40.8514 174.1437 32 H 5.1760 8.9700 117.1243 54.8574 33.7843 171.8934 33 P 5.1309 0.0000 0.0000 61.6766 32.2729 174.3091 34 P 4.1832 0.0000 0.0000 64.7179 31.5681 176.9267 35 Q 4.0143 7.9099 118.6883 56.2100 29.0079 175.2198 36 I 4.4233 7.6644 119.9718 60.1743 41.0422 172.8824 37 E 4.7473 8.7845 127.2353 54.5721 32.8490 175.0779 38 I 4.9350 8.3489 123.7350 59.7802 40.6349 174.3059 39 D 4.9790 9.2090 127.6026 52.2704 44.2095 175.3249 40 L 4.7226 8.4895 123.1099 54.1636 43.3729 175.5630 41 L 5.1850 9.1968 123.7821 52.7717 45.0973 175.2807 42 K 4.4011 9.2362 124.5112 54.8265 34.7016 175.8991 43 N 4.1128 9.9896 127.1603 54.4318 36.6686 175.4598 44 G 3.9745 8.4018 103.2925 45.4935 0.0000 173.3940 45 E 4.7100 7.7308 118.6701 53.6526 32.6502 175.0866 46 K 4.6039 8.6130 123.9183 56.6527 32.6962 176.1733 47 I 4.5325 8.3550 121.2832 58.6699 40.2360 175.2574 48 K 4.2827 8.4866 124.8022 56.7961 32.5319 175.8676 49 S 4.8011 8.4683 120.1801 57.2560 66.5464 172.5568 50 E 4.7820 9.0128 119.7369 54.6187 32.6304 174.9982 51 Q 5.1276 8.2968 122.0251 54.1196 32.0810 175.0787 52 S 4.5576 9.0158 121.2294 58.0621 64.3581 173.3798 53 D 4.5381 8.4848 120.3444 53.4054 41.3041 176.3866 54 L 4.0443 8.5051 125.6656 56.0891 42.6775 175.8213 55 S 4.7810 8.4008 118.5740 57.1826 66.7086 171.7876 56 F 5.2561 7.6772 115.0310 56.0664 40.6675 174.0240 57 S 4.7348 9.1321 117.1496 56.7614 64.6588 175.2985 58 K 3.6364 8.4694 121.5767 59.1723 31.8441 176.8194 59 D 4.4794 7.8467 116.4028 52.6158 39.3930 177.4197 60 W 3.6092 7.7682 118.5039 57.1489 28.0507 174.7674 61 S 4.4532 8.2690 114.2708 58.2824 64.0340 173.8953 62 F 5.1433 8.5915 121.0999 56.9281 41.2115 174.2749 63 Y 5.5491 8.4193 117.6783 55.8775 41.6511 174.0252 64 L 5.1744 9.5729 120.6715 53.2596 46.9682 174.6627 65 L 5.3451 9.5189 124.5532 53.4871 44.8073 174.7485 66 S 5.3225 9.0366 121.5588 56.8626 64.4978 172.3993 67 H 5.5003 9.2173 121.7100 54.4214 32.4231 172.1065 68 A 4.9568 8.6719 120.4347 50.5112 22.8648 175.6732 69 E 4.3984 8.8683 121.6806 56.6169 30.3476 176.2673 70 F 4.8392 9.0874 117.4134 56.1702 41.6498 173.4158 71 T 4.3836 8.2509 116.6791 60.7226 70.4457 172.1291 72 P 4.6049 0.0000 0.0000 63.2758 32.4197 174.8603 73 N 5.6630 8.4388 115.7922 52.8356 39.7423 175.3063 74 S 4.2488 8.6683 112.6178 60.6105 62.7657 174.9041 75 K 4.2962 8.4646 119.0096 58.2211 32.6702 177.2323 76 D 4.5285 7.7472 115.3383 54.4834 41.2834 175.6187 77 Q 4.7761 9.1556 123.6561 54.8158 30.9296 174.4069 78 Y 5.4071 8.8099 119.7228 56.6624 42.3259 174.4697 79 S 5.1522 9.0422 115.5684 57.8389 67.5332 171.7427 80 C 5.4143 9.3787 119.9156 54.7233 44.5737 172.2597 81 R 5.1906 9.3418 126.4707 54.5215 32.3219 174.4405 82 V 4.9046 8.8692 126.1627 60.9794 34.8281 174.0452 83 K 4.8910 8.9642 127.1003 54.9576 34.9608 174.6787 84 H 5.0919 8.5739 122.7806 54.6070 33.0168 174.2038 85 V 3.6232 8.3412 122.9604 65.1595 31.0348 177.4564 86 T 4.0829 8.0025 108.3503 62.3694 69.0627 173.2741 87 L 4.8343 7.8821 123.8353 52.9128 43.0363 176.4651 88 E 4.1210 8.8791 124.0154 58.8104 29.7364 176.9219 89 Q 4.6423 7.5572 114.7622 52.9076 32.9773 172.6808 90 P 4.4940 0.0000 0.0000 63.2246 32.1708 175.7498 91 R 4.5930 8.9314 123.9942 54.7955 32.1756 174.7112 92 I 4.9539 8.3740 126.4556 59.4827 39.7552 174.8860 93 V 4.4514 8.9010 127.1722 60.9623 33.9313 174.7710 94 K 4.6787 8.7528 127.2833 55.4448 33.3569 176.4924 95 W 4.4803 9.2003 134.9605 57.6970 31.2809 175.3667 96 D 4.4612 8.8393 128.2673 52.4546 40.1373 176.6044 97 R 3.4438 7.4871 122.9426 57.4373 29.7395 177.0237 98 D 4.6943 7.8870 117.8517 54.0227 41.1767 176.4382 99 L 4.1717 7.4673 125.5731 55.1028 41.5055 176.8350 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 A 8.26 4.23 1.30 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 0.00 0.00 0.00 2 I 7.66 3.92 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 1.42 0.71 0.89 0.00 0.00 3 Q 9.38 4.78 0.00 1.92 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 6.68 0.00 0.00 0.00 0.00 0.00 2.29 2.39 0.00 4 R 9.14 4.85 0.00 1.90 1.94 0.00 3.20 0.00 0.00 3.28 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 5 P 0.00 5.19 0.00 2.07 2.07 0.00 3.41 0.00 0.00 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.82 0.00 6 P 0.00 4.72 0.00 1.91 1.73 0.00 3.67 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.73 0.00 7 K 8.87 4.41 0.00 0.79 1.18 0.00 1.50 0.00 0.00 1.62 0.00 0.00 2.81 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.23 1.18 7.81 8 I 7.98 5.10 1.90 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.51 0.98 0.00 0.00 9 Q 9.54 4.91 0.00 2.32 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.46 2.68 0.00 10 V 8.46 5.07 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 0.89 0.00 0.00 1.06 0.00 0.00 11 Y 8.55 5.19 0.00 3.13 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 12 S 8.99 4.75 0.00 4.25 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 13 R 9.17 4.13 0.00 1.79 2.22 0.00 3.02 0.00 0.00 3.01 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.50 0.00 14 H 8.32 5.10 0.00 3.24 3.22 0.00 5.77 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 15 P 0.00 4.40 0.00 2.10 2.09 0.00 3.78 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.17 0.00 16 P 0.00 4.78 0.00 2.50 2.58 0.00 3.89 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.23 0.00 17 E 8.42 4.68 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 2.28 2.32 0.00 18 D 8.89 4.61 0.00 2.74 2.68 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 0.00 0.00 0.00 0.00 19 G 8.70 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 0.00 0.00 0.00 20 K 7.81 4.31 0.00 1.69 1.80 0.00 1.80 0.00 0.00 1.85 0.00 0.00 2.86 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.34 1.35 7.81 21 P 0.00 4.23 0.00 1.85 1.81 0.00 3.75 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 1.96 1.84 0.00 22 N 8.18 4.70 0.00 2.62 2.18 0.00 0.00 7.07 7.85 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 23 Y 9.45 5.09 0.00 2.81 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 24 L 8.98 4.21 0.00 0.27 0.68 -0.28 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 25 N 8.78 5.28 0.00 1.44 1.84 0.00 0.00 6.05 8.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 C 9.27 5.26 0.00 2.88 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 27 Y 9.45 5.48 0.00 3.36 3.21 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 28 V 9.07 5.07 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 0.81 0.00 0.00 0.96 0.00 0.00 29 Y 8.82 5.27 0.00 2.99 2.43 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 0.00 0.00 0.00 0.00 30 G 8.80 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 0.00 0.00 0.00 0.00 31 F 7.39 5.27 0.00 3.06 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 32 H 8.97 5.18 0.00 3.32 3.23 0.00 5.58 0.00 0.00 0.00 0.00 6.65 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 5.13 0.00 2.44 2.16 0.00 3.89 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 1.99 1.99 0.00 34 P 0.00 4.18 0.00 1.62 0.49 0.00 3.72 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.69 0.00 35 Q 7.91 4.01 0.00 2.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.77 0.00 0.00 0.00 0.00 0.00 2.33 2.36 0.00 36 I 7.66 4.42 1.57 0.00 0.00 -0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.43 0.81 0.00 0.00 37 E 8.78 4.75 0.00 1.89 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.20 0.00 38 I 8.35 4.93 1.85 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 1.25 0.50 0.91 0.00 0.00 39 D 9.21 4.98 0.00 2.50 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.49 4.72 0.00 1.57 1.54 0.78 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 41 L 9.20 5.19 0.00 1.55 1.54 0.93 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 42 K 9.24 4.40 0.00 1.75 1.58 0.00 1.89 0.00 0.00 1.66 0.00 0.00 2.91 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.13 0.76 7.81 43 N 9.99 4.11 0.00 2.74 2.78 0.00 0.00 7.15 8.10 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 44 G 8.40 3.97 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 0.00 0.00 0.00 0.00 0.00 0.00 45 E 7.73 4.71 0.00 1.99 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 2.35 2.32 0.00 46 K 8.61 4.60 0.00 1.76 1.72 0.00 1.74 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.43 7.81 47 I 8.36 4.53 1.91 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.83 0.97 0.00 0.00 48 K 8.49 4.28 0.00 1.80 1.76 0.00 1.76 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.42 1.44 7.81 49 S 8.47 4.80 0.00 3.88 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 50 E 9.01 4.78 0.00 1.62 1.75 0.00 0.00 0.00 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 2.20 0.00 51 Q 8.30 5.13 0.00 1.99 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 7.04 0.00 0.00 0.00 0.00 0.00 2.26 2.37 0.00 52 S 9.02 4.56 0.00 3.99 3.99 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 0.00 0.00 0.00 53 D 8.48 4.54 0.00 2.70 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 54 L 8.51 4.04 0.00 1.63 1.63 0.78 0.59 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 55 S 8.40 4.78 0.00 3.71 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 56 F 7.68 5.26 0.00 2.86 2.41 0.00 0.00 0.00 0.00 0.00 0.00 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 9.13 4.73 0.00 4.09 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 58 K 8.47 3.64 0.00 1.60 1.72 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.17 1.25 7.81 59 D 7.85 4.48 0.00 2.81 2.67 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 0.00 0.00 0.00 60 W 7.77 3.61 0.00 3.30 3.03 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 61 S 8.27 4.45 0.00 4.02 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 62 F 8.59 5.14 0.00 1.76 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 63 Y 8.42 5.55 0.00 3.05 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 64 L 9.57 5.17 0.00 1.79 1.69 1.12 0.79 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 65 L 9.52 5.35 0.00 1.96 1.67 1.06 0.78 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 66 S 9.04 5.32 0.00 3.94 3.69 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 67 H 9.22 5.50 0.00 3.17 3.39 0.00 5.52 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 68 A 8.67 4.96 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 0.00 0.00 0.00 0.00 0.00 69 E 8.87 4.40 0.00 1.81 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 2.08 2.44 0.00 70 F 9.09 4.84 0.00 2.86 2.68 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 0.00 0.00 0.00 0.00 71 T 8.25 4.38 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 1.09 0.00 0.00 72 P 0.00 4.60 0.00 2.23 2.22 0.00 3.58 0.00 0.00 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 1.75 0.00 73 N 8.44 5.66 0.00 2.97 2.97 0.00 0.00 6.37 7.64 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 74 S 8.67 4.25 0.00 3.96 3.96 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 75 K 8.46 4.30 0.00 1.80 1.85 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.43 1.55 7.81 76 D 7.75 4.53 0.00 2.89 2.41 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 9.16 4.78 0.00 2.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.71 0.00 0.00 0.00 0.00 0.00 2.30 2.47 0.00 78 Y 8.81 5.41 0.00 3.10 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 79 S 9.04 5.15 0.00 4.07 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 80 C 9.38 5.41 0.00 2.99 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 81 R 9.34 5.19 0.00 1.85 1.73 0.00 3.07 0.00 0.00 3.09 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.53 0.00 82 V 8.87 4.90 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 0.86 0.00 0.00 0.88 0.00 0.00 83 K 8.96 4.89 0.00 1.65 1.63 0.00 1.85 0.00 0.00 1.55 0.00 0.00 2.79 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.32 1.31 7.81 84 H 8.57 5.09 0.00 2.98 3.00 0.00 5.69 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 8.34 3.62 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 0.67 0.00 0.00 0.90 0.00 0.00 86 T 8.00 4.08 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 1.33 0.00 0.00 87 L 7.88 4.83 0.00 1.68 1.82 0.92 0.82 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 88 E 8.88 4.12 0.00 1.95 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 2.32 2.33 0.00 89 Q 7.56 4.64 0.00 1.97 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.92 0.00 0.00 0.00 0.00 0.00 2.25 2.35 0.00 90 P 0.00 4.49 0.00 1.92 1.98 0.00 3.64 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 91 R 8.93 4.59 0.00 1.85 1.75 0.00 3.03 0.00 0.00 3.14 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 92 I 8.37 4.95 1.89 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 1.24 0.78 0.94 0.00 0.00 93 V 8.90 4.45 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 1.17 0.00 0.00 0.96 0.00 0.00 94 K 8.75 4.68 0.00 1.75 1.80 0.00 1.84 0.00 0.00 1.66 0.00 0.00 2.86 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.49 1.48 7.81 95 W 9.20 4.48 0.00 3.31 3.47 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 0.00 0.00 0.00 0.00 96 D 8.84 4.46 0.00 2.69 2.55 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 97 R 7.49 3.44 0.00 1.35 0.66 0.00 2.71 0.00 0.00 3.06 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 1.33 0.00 98 D 7.89 4.69 0.00 2.75 2.67 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 0.00 0.00 0.00 99 L 7.47 4.17 0.00 1.64 1.62 0.98 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00