NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.5036 0.0000 0.0000 61.9225 33.4275 175.2246 3 E 4.3057 8.9362 125.5743 56.2000 30.0965 174.7072 4 I 4.1967 9.6326 129.8639 61.1981 38.7859 175.2084 5 R 4.4965 8.6027 125.0439 55.2964 31.9296 175.0630 6 L 4.8974 8.3775 123.0579 53.4537 43.1704 176.2433 7 R 4.2490 9.5329 126.4045 58.7957 30.4045 175.7808 8 H 4.8128 7.7254 111.5979 54.5296 32.4574 171.4594 9 V 4.1929 8.1320 118.9854 62.0833 31.2233 175.7092 10 V 3.9611 8.7997 129.9720 65.7860 32.0905 176.0170 11 S 4.6645 7.6532 112.0757 57.8350 66.1321 173.5382 12 C 5.0011 8.2125 120.8132 58.3453 33.5637 174.0466 13 S 4.3696 9.5018 122.2597 61.1778 63.4587 174.7487 14 S 4.5922 8.0270 110.7234 57.5773 64.8567 174.2562 15 Q 5.5925 8.3745 123.0912 55.5053 31.0996 173.4656 16 D 4.7313 8.4685 119.0465 53.2573 42.4038 176.6227 17 S 4.2942 8.6050 117.9812 61.0117 63.5271 175.4910 18 T 4.1921 8.0678 109.5976 63.7936 69.8540 175.5666 19 H 4.9487 8.1089 121.8997 53.0706 27.3657 174.1626 20 C 4.9821 7.6542 117.6508 56.2881 32.2342 175.4703 21 A 3.4334 9.5044 122.8127 55.2680 17.6602 179.4009 22 E 3.7655 8.2990 117.1235 59.9128 29.2639 178.6937 23 N 4.4638 8.0381 114.8513 55.4437 38.6602 176.2727 24 L 4.4498 7.8184 119.1154 55.5662 42.1637 177.7606 25 L 4.1783 7.9300 119.0121 56.6936 41.7646 177.6910 26 K 4.5757 7.7676 117.1040 54.2554 35.5848 177.0526 27 A 4.1910 8.6044 126.1235 54.6425 18.7667 178.9141 28 D 4.1678 8.0537 115.1329 57.7527 39.9766 178.3385 29 T 3.6428 7.3430 114.2796 64.6691 68.5470 175.2750 30 Y 4.0001 6.9789 115.5265 58.8528 35.8789 169.3139 31 R 4.7457 7.3209 118.1513 54.5967 32.2834 175.8522 32 K 4.9662 8.4280 119.5397 54.6333 35.8435 174.5981 33 W 5.2104 8.9303 131.9742 55.9814 33.0734 174.8527 34 R 4.6062 9.0094 124.6648 53.8345 33.6812 174.4902 35 A 4.1952 7.7611 122.2308 51.6512 18.9461 178.9652 36 A 4.3008 8.8837 124.2256 54.6186 18.7486 178.4664 37 K 4.6266 7.2102 112.8237 54.2845 36.2534 176.1743 38 A 4.1624 8.3248 124.0506 53.4850 18.8793 178.3139 39 G 3.9252 8.9793 108.7299 45.2532 0.0000 173.3358 40 E 4.2989 7.8924 119.5379 55.4354 29.8583 176.7204 41 K 4.3145 8.8015 124.7398 59.3779 33.1774 176.9984 42 T 5.5374 7.8029 107.4448 60.5106 71.9216 173.1188 43 I 4.8492 9.0200 115.3857 60.0832 41.7237 173.4999 44 S 5.3650 9.3800 116.4737 57.4788 66.3203 173.1278 45 V 4.6696 8.4018 116.8505 59.7013 36.4073 173.9868 46 V 4.5434 8.6250 124.6823 61.1489 33.7075 174.1820 47 L 4.9652 8.9681 128.1182 53.0000 44.4542 175.1296 48 Q 4.7933 8.8953 125.1423 54.8220 30.2736 175.1728 49 L 4.5905 8.6493 127.2446 54.6271 42.0790 177.2685 50 E 4.3074 8.7516 121.7024 58.9586 29.8688 177.2901 51 K 4.7401 7.7305 115.6611 54.5908 36.3199 175.8779 52 E 4.3889 8.6982 122.2465 56.6424 30.1296 175.6180 53 E 4.8175 9.6456 125.2811 55.0234 35.1335 173.6816 54 Q 4.8695 8.6543 122.7200 55.4354 30.8839 174.2113 55 I 4.7567 8.5494 127.1881 60.8699 37.8606 174.7404 56 H 4.7257 9.7596 127.8380 58.0348 31.0630 174.9065 57 S 5.0370 7.9727 110.4444 57.1064 66.5313 173.0222 58 V 4.7928 8.9111 123.2591 61.6216 34.8254 173.3445 59 D 5.4764 9.2874 128.4207 52.8281 43.4077 175.4897 60 I 4.4386 8.8955 123.4783 59.3737 40.6941 174.6645 61 G 3.4742 7.6785 115.2436 44.1527 0.0000 172.8808 62 N 4.6616 8.8433 125.9457 52.7685 40.9096 174.2182 63 D 4.7373 8.0458 115.7541 53.3154 41.0411 176.2555 64 G 4.1116 8.7323 107.0720 45.4099 0.0000 173.2862 65 S 4.1050 7.6425 115.0447 58.1806 63.8065 173.8794 66 A 4.2993 8.6086 125.1077 53.4409 20.3321 177.4358 67 F 5.5532 7.9038 112.0783 55.8656 43.7414 174.5174 68 V 4.9566 9.2938 121.0888 61.2412 35.0265 173.6976 69 E 5.0748 9.6091 128.2140 54.3055 33.1629 174.3584 70 V 4.8526 8.4779 125.4908 61.1516 34.4501 174.2802 71 L 5.2175 9.3015 127.3164 53.1197 45.6213 175.7614 72 V 4.5633 8.5616 113.8503 59.8638 35.5254 175.2970 73 G 3.9125 8.5073 109.5163 45.4832 0.0000 171.0651 74 S 6.1060 8.5775 113.4027 55.5203 64.7512 174.5674 75 S 4.2769 9.2763 118.9846 59.8546 63.5982 174.4227 76 A 4.0268 7.7816 125.4593 52.9816 18.4475 177.2632 77 G 3.7116 9.2436 110.9076 46.2893 0.0000 175.3061 78 G 3.7986 8.4177 109.8717 44.4118 0.0000 173.4758 79 A 4.3544 8.2536 121.5135 50.9194 20.9476 176.4042 80 G 4.0611 8.8132 112.5092 44.4557 0.0000 173.9805 81 E 4.0051 8.7640 117.6304 59.9473 29.3818 179.6264 82 Q 4.2824 8.0655 113.2195 56.4734 28.3749 176.1776 83 D 4.5973 7.7156 119.4593 55.3259 42.3030 176.3623 84 Y 4.2523 7.3757 116.2905 57.4588 38.4969 175.3934 85 E 4.2860 8.8095 125.9198 55.4516 31.5230 175.2991 86 V 3.9593 8.1969 125.4859 62.8757 32.0681 174.7570 87 L 4.3364 8.9863 130.1513 56.4167 43.9476 175.4931 88 L 4.9847 7.5666 123.7633 52.7067 43.6815 175.7668 89 V 3.9662 8.4491 126.2947 61.7962 32.2694 175.7209 90 T 4.0383 8.3559 118.0661 64.5565 68.7465 173.2051 91 S 4.9938 9.3045 122.9642 56.6336 66.1071 173.6265 92 S 4.9509 8.8029 118.4509 58.2462 62.7517 173.5464 93 F 4.7249 9.0318 122.8078 57.1236 41.0746 174.8716 94 M 4.6421 7.6343 116.3922 53.2771 35.0869 174.7497 95 S 4.3049 8.7688 121.5948 56.7625 65.7419 173.7098 96 P 3.4585 0.0000 0.0000 65.5053 30.9235 179.1593 97 S 4.0384 7.7233 113.2734 61.5958 62.7482 176.4720 98 E 3.9170 8.0053 121.1311 59.5481 29.0054 179.4196 99 S 4.0621 8.1787 114.1421 61.9093 62.9907 176.8793 100 R 4.0905 8.1765 120.0487 58.7952 29.9435 178.5178 101 S 4.5397 8.1245 111.8166 58.0664 63.6190 175.0637 102 G 3.8527 8.5409 110.9656 46.1398 0.0000 173.4163 103 S 4.3106 7.9680 114.8688 58.8008 64.2131 174.1210 104 N 4.1614 8.5889 120.6798 54.2142 35.6559 172.7449 105 P 4.5064 0.0000 0.0000 63.7119 33.1669 178.9768 106 N 5.0310 7.9402 115.1307 51.8407 39.8449 174.7876 107 R 4.0360 8.0952 120.8353 57.2707 30.9798 175.1965 108 V 5.0884 8.5022 125.5342 60.1140 33.7199 175.2669 109 R 4.4507 9.1020 122.9279 54.4812 33.6264 174.4365 110 M 4.5894 8.2702 123.1307 54.9934 34.1312 175.9243 111 F 4.6159 9.0613 122.1964 56.0427 42.8020 175.0137 112 G 4.1051 8.5214 114.0657 43.7147 0.0000 170.8652 113 P 4.3613 0.0000 0.0000 65.3512 31.3132 178.5568 114 D 4.1656 8.0572 116.2546 55.0407 39.7922 177.0314 115 K 4.3976 7.9920 117.5037 56.4518 32.8244 176.5163 116 L 4.6143 7.0957 118.7432 53.2413 43.0952 176.6912 117 V 3.8868 8.5952 115.2540 61.4980 31.9784 178.0122 118 R 4.1020 8.6557 123.1795 58.0633 29.9290 178.8915 119 A 4.0121 8.0010 119.8896 55.2246 18.7090 179.0384 120 A 4.4487 8.0669 118.6302 55.2995 18.4412 179.3770 121 A 4.2573 8.2625 117.9390 54.5196 18.4749 178.9524 122 E 4.1224 7.9755 117.6728 57.9337 29.9538 176.6938 123 K 4.2954 7.5390 117.4988 55.4072 33.9881 176.2241 124 R 4.7474 7.6683 119.3012 54.6518 32.2596 175.9212 125 W 5.4232 9.2016 121.6204 55.3405 34.3933 174.9549 126 D 5.0161 8.9425 116.6212 52.9361 41.1685 174.9197 127 R 5.2200 8.4105 118.3852 54.6984 34.4984 174.8395 128 V 4.5035 8.6053 121.3122 61.3033 35.0268 173.5699 129 K 4.7104 9.1619 130.2381 54.7512 34.3454 174.6703 130 I 4.8419 8.5267 128.6382 59.5838 39.8654 174.5706 131 V 4.9019 9.1551 127.8360 61.3387 33.7161 173.9802 132 C 5.4410 9.2774 125.6774 58.1941 31.1556 173.1791 133 S 5.0890 8.9971 117.9613 57.1537 66.7094 173.3855 134 Q 4.1937 8.4771 124.1283 54.5670 28.8742 172.4359 135 P 4.2831 0.0000 0.0000 63.2746 32.1347 176.6809 136 Y 4.5864 7.5537 114.6329 58.4015 38.5593 175.7532 137 S 4.5169 7.7382 113.8661 57.3052 65.2162 173.4333 138 K 4.5696 8.5885 125.6479 56.3839 32.3663 176.9595 139 D 4.5539 7.7736 121.3584 56.6740 40.9852 176.7400 140 S 4.7551 7.5637 112.4098 55.7738 66.9957 171.9580 141 P 4.4260 0.0000 0.0000 62.7674 31.9407 175.7030 142 F 5.0781 7.5181 114.6778 55.1999 41.9142 174.0849 143 G 3.6485 7.4021 110.6119 46.1671 0.0000 173.2113 144 L 4.7892 7.9072 123.4514 53.1068 45.3047 177.4787 145 S 4.4368 9.4219 117.8257 60.8623 63.2432 173.6126 146 F 5.1495 7.5103 112.4378 56.3850 41.2330 173.0127 147 V 4.7983 8.3736 117.4723 60.5835 34.1837 173.9184 148 R 4.6228 8.8792 122.9616 54.4211 33.6007 174.3096 149 F 5.2987 8.7776 122.1063 56.1870 41.9875 174.4283 150 H 5.5262 8.9781 118.6219 54.1014 32.6008 173.5569 151 S 5.5867 9.1470 117.6507 56.1828 64.5651 172.1516 152 P 4.2894 0.0000 0.0000 62.0858 31.9230 175.1404 153 P 4.3931 0.0000 0.0000 62.8959 31.3809 176.3581 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 P 0.00 4.50 0.00 2.13 2.07 0.00 3.84 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 2.03 2.11 0.00 3 E 8.94 4.31 0.00 2.13 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 2.44 2.39 0.00 4 I 9.63 4.20 2.02 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 1.31 0.83 1.02 0.00 0.00 5 R 8.60 4.50 0.00 1.87 1.85 0.00 3.11 0.00 0.00 3.35 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.68 0.00 6 L 8.38 4.90 0.00 1.64 1.57 1.12 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 7 R 9.53 4.25 0.00 1.81 2.14 0.00 3.30 0.00 0.00 3.34 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.60 0.00 8 H 7.73 4.81 0.00 3.18 3.32 0.00 5.50 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 V 8.13 4.19 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 0.80 0.00 0.00 10 V 8.80 3.96 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 0.82 0.00 0.00 0.80 0.00 0.00 11 S 7.65 4.66 0.00 3.85 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 12 C 8.21 5.00 0.00 2.75 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 13 S 9.50 4.37 0.00 3.90 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 14 S 8.03 4.59 0.00 3.84 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 15 Q 8.37 5.59 0.00 2.41 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.77 0.00 0.00 0.00 0.00 0.00 2.29 2.37 0.00 16 D 8.47 4.73 0.00 2.79 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 17 S 8.61 4.29 0.00 4.01 3.98 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 18 T 8.07 4.19 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 1.17 0.00 0.00 19 H 8.11 4.95 0.00 3.27 3.44 0.00 5.61 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 C 7.65 4.98 0.00 3.33 3.29 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 21 A 9.50 3.43 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 E 8.30 3.77 0.00 2.02 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 2.38 2.42 0.00 23 N 8.04 4.46 0.00 3.10 3.04 0.00 0.00 7.04 7.97 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 24 L 7.82 4.45 0.00 1.64 1.77 0.87 1.46 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 25 L 7.93 4.18 0.00 1.64 1.74 0.95 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 26 K 7.77 4.58 0.00 1.73 1.60 0.00 1.63 0.00 0.00 1.94 0.00 0.00 2.90 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.41 1.39 7.81 27 A 8.60 4.19 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 28 D 8.05 4.17 0.00 2.53 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 29 T 7.34 3.64 4.23 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 1.18 0.00 0.00 30 Y 6.98 4.00 0.00 3.32 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 31 R 7.32 4.75 0.00 1.98 2.00 0.00 3.14 0.00 0.00 3.42 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 32 K 8.43 4.97 0.00 1.74 1.82 0.00 1.62 0.00 0.00 1.96 0.00 0.00 2.86 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.53 1.50 7.81 33 W 8.93 5.21 0.00 3.45 3.09 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 34 R 9.01 4.61 0.00 1.64 1.52 0.00 3.02 0.00 0.00 3.02 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.37 0.00 35 A 7.76 4.20 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 A 8.88 4.30 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 37 K 7.21 4.63 0.00 1.86 1.65 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.50 7.81 38 A 8.32 4.16 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 39 G 8.98 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 40 E 7.89 4.30 0.00 1.99 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 2.32 2.31 0.00 41 K 8.80 4.31 0.00 1.72 1.84 0.00 1.60 0.00 0.00 1.84 0.00 0.00 2.74 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.47 1.43 7.81 42 T 7.80 5.54 4.41 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 1.22 0.00 0.00 43 I 9.02 4.85 1.88 0.00 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.70 0.65 0.00 0.00 44 S 9.38 5.36 0.00 3.91 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 45 V 8.40 4.67 1.54 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 -0.93 0.00 0.00 0.23 0.00 0.00 46 V 8.62 4.54 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 0.90 0.00 0.00 0.66 0.00 0.00 47 L 8.97 4.97 0.00 1.44 1.44 0.94 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 48 Q 8.90 4.79 0.00 1.99 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.95 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 49 L 8.65 4.59 0.00 1.66 1.58 0.96 0.66 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 50 E 8.75 4.31 0.00 1.89 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 2.36 2.27 0.00 51 K 7.73 4.74 0.00 1.69 1.72 0.00 1.59 0.00 0.00 1.86 0.00 0.00 2.86 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.30 1.43 7.81 52 E 8.70 4.39 0.00 1.99 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 2.38 2.34 0.00 53 E 9.65 4.82 0.00 1.92 1.81 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 2.25 2.49 0.00 54 Q 8.65 4.87 0.00 2.16 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.94 0.00 0.00 0.00 0.00 0.00 2.48 2.48 0.00 55 I 8.55 4.76 2.04 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 1.37 0.86 1.17 0.00 0.00 56 H 9.76 4.73 0.00 3.19 3.56 0.00 5.94 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 S 7.97 5.04 0.00 3.99 3.78 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 58 V 8.91 4.79 2.24 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 0.76 0.00 0.00 1.15 0.00 0.00 59 D 9.29 5.48 0.00 2.82 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 I 8.90 4.44 2.33 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 1.39 1.67 0.55 0.00 0.00 61 G 7.68 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 0.00 0.00 0.00 62 N 8.84 4.66 0.00 2.95 2.91 0.00 0.00 6.28 8.08 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 63 D 8.05 4.74 0.00 2.83 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 64 G 8.73 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 S 7.64 4.10 0.00 3.93 3.88 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 66 A 8.61 4.30 1.13 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 0.00 0.00 67 F 7.90 5.55 0.00 2.95 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 68 V 9.29 4.96 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 0.95 0.00 0.00 0.42 0.00 0.00 69 E 9.61 5.07 0.00 1.98 1.71 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 2.14 2.33 0.00 70 V 8.48 4.85 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 1.11 0.00 0.00 1.00 0.00 0.00 71 L 9.30 5.22 0.00 1.48 1.64 0.87 0.92 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 72 V 8.56 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 0.39 0.00 0.00 -0.07 0.00 0.00 73 G 8.51 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 74 S 8.58 6.11 0.00 3.95 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 75 S 9.28 4.28 0.00 4.03 4.14 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 76 A 7.78 4.03 1.25 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 0.00 0.00 0.00 77 G 9.24 3.71 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 0.00 0.00 0.00 78 G 8.42 3.80 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 0.00 0.00 0.00 0.00 0.00 0.00 79 A 8.25 4.35 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 80 G 8.81 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 0.00 0.00 0.00 81 E 8.76 4.01 0.00 2.04 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 0.00 2.44 2.30 0.00 82 Q 8.07 4.28 0.00 2.05 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.91 0.00 0.00 0.00 0.00 0.00 2.38 2.30 0.00 83 D 7.72 4.60 0.00 2.66 2.35 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 84 Y 7.38 4.25 0.00 2.95 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 85 E 8.81 4.29 0.00 1.78 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 2.35 2.30 0.00 86 V 8.20 3.96 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 0.81 0.00 0.00 0.90 0.00 0.00 87 L 8.99 4.34 0.00 1.63 1.67 0.99 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 88 L 7.57 4.98 0.00 1.65 1.39 0.44 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 89 V 8.45 3.97 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 0.76 0.00 0.00 0.92 0.00 0.00 90 T 8.36 4.04 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 1.12 0.00 0.00 91 S 9.30 4.99 0.00 3.89 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 92 S 8.80 4.95 0.00 4.01 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 93 F 9.03 4.72 0.00 2.81 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 94 M 7.63 4.64 0.00 1.85 2.06 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.52 0.00 95 S 8.77 4.30 0.00 3.92 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 96 P 0.00 3.46 0.00 1.83 1.50 0.00 3.27 0.00 0.00 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.73 0.00 97 S 7.72 4.04 0.00 3.78 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 98 E 8.01 3.92 0.00 2.10 2.20 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 0.00 2.28 2.28 0.00 99 S 8.18 4.06 0.00 4.00 4.20 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 0.00 0.00 0.00 0.00 100 R 8.18 4.09 0.00 1.98 1.98 0.00 3.15 0.00 0.00 3.29 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.83 0.00 101 S 8.12 4.54 0.00 4.02 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 0.00 102 G 8.54 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 0.00 0.00 0.00 103 S 7.97 4.31 0.00 3.85 3.78 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 0.00 104 N 8.59 4.16 0.00 2.80 2.83 0.00 0.00 7.04 8.02 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 0.00 105 P 0.00 4.51 0.00 2.07 2.08 0.00 3.57 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 2.09 2.23 0.00 106 N 7.94 5.03 0.00 2.61 2.86 0.00 0.00 7.19 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 0.00 107 R 8.10 4.04 0.00 1.94 1.97 0.00 3.29 0.00 0.00 3.31 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.65 0.00 108 V 8.50 5.09 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 0.98 0.00 0.00 1.08 0.00 0.00 109 R 9.10 4.45 0.00 1.54 1.07 0.00 2.62 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 1.23 0.00 110 M 8.27 4.59 0.00 1.88 1.87 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.56 0.00 111 F 9.06 4.62 0.00 3.17 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 0.00 112 G 8.52 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 P 0.00 4.36 0.00 2.17 2.06 0.00 3.58 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.55 0.00 114 D 8.06 4.17 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 0.00 115 K 7.99 4.40 0.00 2.01 2.11 0.00 1.70 0.00 0.00 1.75 0.00 0.00 3.18 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.48 1.46 7.81 116 L 7.10 4.61 0.00 1.54 1.77 1.06 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 117 V 8.60 3.89 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 0.81 0.00 0.00 1.03 0.00 0.00 118 R 8.66 4.10 0.00 1.89 2.01 0.00 3.16 0.00 0.00 3.37 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.73 0.00 119 A 8.00 4.01 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 0.00 120 A 8.07 4.45 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 A 8.26 4.26 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 0.00 0.00 122 E 7.98 4.12 0.00 2.26 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 2.34 2.41 0.00 123 K 7.54 4.30 0.00 1.06 1.13 0.00 1.89 0.00 0.00 1.54 0.00 0.00 2.93 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.30 1.55 7.81 124 R 7.67 4.75 0.00 1.45 1.71 0.00 3.09 0.00 0.00 3.15 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.49 0.00 125 W 9.20 5.42 0.00 3.16 3.25 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 0.00 126 D 8.94 5.02 0.00 2.67 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 0.00 127 R 8.41 5.22 0.00 1.87 1.99 0.00 3.29 0.00 0.00 3.17 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.66 0.00 128 V 8.61 4.50 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.41 0.00 0.00 129 K 9.16 4.71 0.00 0.94 1.19 0.00 0.62 0.00 0.00 1.08 0.00 0.00 2.66 0.00 0.00 2.60 0.00 0.00 0.00 0.00 1.08 1.04 7.81 130 I 8.53 4.84 1.93 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.08 1.02 0.00 0.00 131 V 9.16 4.90 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 0.93 0.00 0.00 0.89 0.00 0.00 132 C 9.28 5.44 0.00 3.00 2.99 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 0.00 133 S 9.00 5.09 0.00 3.89 3.70 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 0.00 134 Q 8.48 4.19 0.00 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.94 0.00 0.00 0.00 0.00 0.00 1.89 2.28 0.00 135 P 0.00 4.28 0.00 1.39 1.81 0.00 3.06 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.91 0.00 136 Y 7.55 4.59 0.00 3.07 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 0.00 137 S 7.74 4.52 0.00 3.84 3.70 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 0.00 138 K 8.59 4.57 0.00 1.77 1.80 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.76 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.41 7.81 139 D 7.77 4.55 0.00 2.65 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 0.00 140 S 7.56 4.76 0.00 3.82 3.71 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 0.00 141 P 0.00 4.43 0.00 1.97 2.05 0.00 3.63 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 2.00 2.12 0.00 142 F 7.52 5.08 0.00 3.13 2.99 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 0.00 143 G 7.40 3.65 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 0.00 0.00 0.00 144 L 7.91 4.79 0.00 1.77 1.53 1.02 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 145 S 9.42 4.44 0.00 4.06 4.07 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 0.00 146 F 7.51 5.15 0.00 3.21 3.18 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 0.00 147 V 8.37 4.80 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 0.85 0.00 0.00 0.59 0.00 0.00 148 R 8.88 4.62 0.00 1.96 1.76 0.00 3.17 0.00 0.00 3.24 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.69 0.00 149 F 8.78 5.30 0.00 3.01 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 0.00 150 H 8.98 5.53 0.00 3.18 3.22 0.00 5.61 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 0.00 151 S 9.15 5.59 0.00 3.88 4.05 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 0.00 152 P 0.00 4.29 0.00 1.98 2.07 0.00 3.73 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.23 0.00 153 P 0.00 4.39 0.00 2.01 1.93 0.00 3.60 0.00 0.00 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.93 0.00