NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.2007 8.1633 120.2853 54.6852 33.1551 174.1988 2 K 4.0134 8.5001 126.3300 56.2166 32.4731 175.7550 3 G 3.9437 8.6634 113.7335 44.8437 0.0000 171.9179 4 D 4.5638 8.4765 119.5797 54.4000 41.9627 177.0118 5 T 3.8694 8.9016 122.9304 66.9001 68.5964 176.6573 6 K 3.8609 8.1794 120.8356 59.0826 32.2342 178.8953 7 V 3.9117 8.5658 118.9617 66.1537 31.4284 177.9205 8 I 3.7558 7.7208 119.2679 64.6289 36.9048 178.1202 9 N 4.2469 8.2435 117.1071 56.4107 38.3365 177.0000 10 Y 4.0917 7.9432 118.0128 61.2072 38.0510 178.7136 11 L 3.9284 8.5568 120.0965 57.9704 41.6246 179.4775 12 N 4.3665 8.4920 116.7441 55.9823 38.4309 177.4565 13 K 3.8709 8.2974 121.5463 59.3905 32.3141 178.9247 14 L 3.8239 8.2079 119.6298 57.6252 41.3864 179.0249 15 L 4.0243 7.9030 120.7140 58.1655 41.9488 179.2279 16 G 3.6258 8.1931 105.7537 47.9194 0.0000 175.2892 17 N 4.3511 8.0055 119.0363 56.1219 38.6057 177.3660 18 E 4.0774 8.2882 119.8412 59.3837 29.4120 179.2417 19 L 3.9900 8.2103 119.2739 57.8485 41.6325 179.7731 20 V 3.5933 7.7469 117.5026 66.0969 31.5317 177.8757 21 A 3.8702 8.1958 120.5013 55.0720 18.1467 179.4521 22 I 3.7548 8.4032 118.6218 64.8767 37.1919 178.4454 23 N 4.3824 7.8985 116.9735 56.4034 38.3901 177.4242 24 Q 3.8366 8.3046 121.1935 59.3256 29.0507 177.8965 25 Y 4.3495 8.4972 118.2920 60.9319 37.9021 178.0615 26 F 3.8197 8.5822 121.7055 61.0928 39.4953 176.7596 27 L 3.9666 8.2732 120.0745 58.6217 41.8202 178.4776 28 H 3.8389 8.2532 115.7801 58.7780 28.6115 177.2268 29 A 4.1761 8.2852 122.7715 55.7456 18.1158 179.9510 30 R 3.8844 7.8236 115.5440 58.7279 30.1499 179.2970 31 M 3.5963 7.8468 119.3033 58.2133 31.8635 178.3771 32 F 4.5820 7.6879 118.2409 60.7036 39.1296 177.6906 33 K 3.9383 8.1881 119.0788 59.5267 31.7871 178.2676 34 N 4.2897 8.0477 116.2293 56.8368 38.9970 176.6348 35 F 4.7546 8.2369 117.9748 59.0882 38.9655 176.4776 36 G 3.9902 8.1080 106.2485 45.8043 0.0000 175.2190 37 L 4.4826 8.0792 122.2536 52.6145 38.2485 176.8894 38 K 3.8223 7.9426 122.9331 59.8980 32.6119 177.5416 39 R 3.9334 8.2809 118.9439 59.2577 29.9462 178.4528 40 L 4.1126 7.9053 118.8716 57.3064 41.4435 178.8609 41 N 4.5639 8.1720 116.8165 56.7821 39.0055 176.4961 42 D 4.3084 8.0718 120.2491 57.3702 41.0428 178.9847 43 V 3.3583 7.6084 118.3860 66.0724 31.4146 177.9756 44 E 3.8259 8.3786 118.4591 59.2308 29.2911 178.5650 45 Y 3.8190 8.1915 119.8670 61.1568 38.6094 178.0811 46 H 4.1959 8.3128 116.0219 57.9022 28.6982 177.2246 47 E 3.7393 7.5471 120.5227 58.1941 29.4939 178.3451 48 S 4.0820 7.8268 113.5978 61.5877 62.4360 176.2636 49 I 3.5562 7.3177 122.2491 64.3691 36.7863 177.8268 50 D 4.2028 7.4853 118.3876 57.5193 40.9853 178.3104 51 E 4.0845 8.1352 118.8507 59.2986 29.3136 179.2586 52 M 4.0608 8.0155 119.1033 58.3348 32.0452 178.7051 53 K 3.8922 8.0646 118.5672 59.7922 32.1884 179.1230 54 H 4.1056 8.0409 116.0509 58.7405 28.6082 177.4615 55 A 4.2341 8.3495 122.9334 55.4681 18.2176 178.9963 56 D 4.3105 8.3816 116.5876 57.7672 41.2532 178.8154 57 R 3.8941 7.8946 118.3311 59.3981 30.0041 178.6690 58 Y 4.3235 7.9004 116.4806 61.2588 37.9133 178.6948 59 I 3.8042 8.2825 121.0829 64.5845 37.1937 178.4309 60 E 4.0800 8.4298 119.4408 59.1445 29.2442 179.4271 61 R 4.0409 8.1567 118.9099 59.5076 30.1860 178.4936 62 I 3.7691 8.4815 119.9484 64.5698 37.1552 178.4019 63 L 4.0426 8.0741 119.6758 57.7171 41.2101 179.3881 64 F 4.4087 8.1606 119.6720 61.2834 39.7362 176.5098 65 L 4.5736 8.2314 117.7896 53.9894 41.1378 177.2401 66 E 3.8597 7.9925 117.5972 57.3728 27.0450 174.5890 67 G 3.9210 8.1893 108.8569 44.1562 0.0000 173.8131 68 L 4.5193 8.0023 119.1529 51.9937 41.8689 175.0619 69 P 4.3710 0.0000 0.0000 62.5862 31.7560 176.0762 70 N 4.7194 9.4443 122.1829 52.4073 38.7323 173.8312 71 L 4.6262 8.3259 124.0937 54.5450 42.4277 177.4690 72 Q 4.1495 8.5635 122.1355 58.0740 29.4055 175.9350 73 D 4.6763 8.0384 116.8599 52.9317 41.9334 175.2704 74 L 4.5947 8.2824 125.2438 52.8052 44.1723 176.5815 75 G 3.8180 8.4391 115.3452 44.5906 0.0000 171.9148 76 K 4.0841 8.3176 120.7632 55.8358 32.4107 176.6537 77 L 4.1166 8.3621 126.8030 54.3855 42.3138 176.0145 78 N 4.8349 8.8495 121.1163 52.1168 40.3481 174.0083 79 I 3.9363 8.6045 126.6449 63.6858 37.9239 177.8957 80 G 4.1739 8.1131 102.8571 45.7658 0.0000 172.5233 81 E 4.5881 8.6867 117.2522 56.2586 31.9431 176.7899 82 D 5.0930 7.6776 117.1251 50.8870 43.4026 176.7929 83 V 3.9645 8.4491 119.2484 66.6611 31.3125 177.5291 84 E 3.8413 8.2071 117.9076 59.4998 29.5160 178.2054 85 E 3.9862 8.3892 119.2685 59.5441 29.6330 178.7251 86 M 4.0788 8.2640 117.0936 58.2565 31.3750 178.5841 87 L 4.1526 8.4539 120.5593 57.6324 41.7536 179.4911 88 R 3.8993 8.4818 119.1196 59.3354 30.0950 178.5656 89 S 4.0941 8.1292 113.1749 61.3261 62.3868 175.8052 90 D 4.2159 8.1425 121.6445 57.1527 40.5205 178.4565 91 L 3.9766 8.2075 120.6045 58.3099 42.1691 178.8187 92 A 3.9899 8.2074 120.7460 55.2111 18.2569 179.4025 93 L 3.9380 7.8754 118.5162 58.1437 42.0582 178.8367 94 E 4.0593 8.2819 119.4793 59.1401 29.7389 178.6964 95 L 4.0214 8.2115 119.2635 58.0285 41.8123 179.3041 96 D 4.5300 8.3645 118.9669 57.1643 40.7230 179.1041 97 G 3.6353 8.3403 106.2877 47.6479 0.0000 175.7048 98 A 4.0793 8.4059 123.4940 54.6078 18.4053 179.6089 99 K 3.8597 7.9611 117.7496 59.9529 32.2645 178.8560 100 N 4.4282 8.0666 116.1916 56.1599 38.3112 177.4598 101 L 3.9789 8.0420 120.4475 57.8792 41.6347 179.6772 102 R 3.8971 8.1699 118.0934 59.2267 29.9826 178.7797 103 E 3.8559 8.1241 118.6156 59.2530 29.6003 178.7350 104 A 2.8378 7.9219 120.9656 54.7588 18.4186 179.6517 105 I 3.7077 8.0559 118.8493 64.4611 36.9437 178.9123 106 G 3.5921 7.5989 105.3723 47.8390 0.0000 174.9204 107 Y 4.0981 7.7764 121.2868 60.3247 38.8976 177.3752 108 A 3.7992 8.1637 122.0181 55.2781 18.3889 179.0248 109 D 4.0633 7.8787 116.3568 57.4694 41.1069 178.5900 110 S 4.1495 7.4917 112.9854 60.2255 63.2456 175.6998 111 V 3.9988 6.8574 113.7262 60.7675 31.6081 175.7064 112 H 2.8224 7.1150 114.3074 56.5812 27.0481 176.4682 113 D 4.5526 7.3895 121.1670 53.5873 37.5478 176.2595 114 Y 4.3118 7.4746 121.4349 60.6180 38.4376 178.2105 115 V 3.7210 7.8899 119.9832 64.7419 31.7375 178.3455 116 S 4.1640 8.3356 115.7109 61.4269 62.6532 176.6715 117 R 3.8788 8.1028 121.2011 59.4065 29.9527 177.9905 118 D 4.2998 8.3981 118.0136 57.6000 41.2978 177.6701 119 M 3.9629 8.1851 118.7136 59.2433 32.1234 178.1732 120 M 4.1575 8.2421 118.6595 58.3791 32.0845 178.8665 121 I 3.7283 8.2869 120.5953 64.2401 37.2507 178.2696 122 E 3.9639 8.1081 119.2720 59.4956 29.2264 179.4831 123 I 3.5468 7.6223 119.7099 64.1081 37.1069 178.1666 124 L 3.9194 8.1095 121.3520 58.1717 41.9220 178.7886 125 R 3.8954 8.0490 118.5444 59.8155 30.0412 178.1398 126 D 4.3406 8.0914 118.3805 57.3924 40.7318 178.6982 127 E 3.9449 8.3570 119.3333 59.4557 29.3990 179.1738 128 E 4.1546 8.7877 119.2333 59.1848 29.4568 179.5862 129 G 3.7144 8.0022 105.8109 48.2752 0.0000 175.3870 130 H 4.4332 8.0920 118.8627 58.5411 28.7032 177.7937 131 I 3.8072 8.2889 122.0080 64.5684 37.0269 177.6472 132 D 4.3944 8.4463 118.9294 57.2681 41.0006 178.2648 133 W 4.1415 8.3762 128.4707 60.4895 30.8103 177.7521 134 L 3.7481 8.5090 119.1265 57.9057 41.1479 179.3584 135 E 3.9284 8.5248 118.6918 59.7320 29.3257 179.5871 136 T 3.7838 7.8459 115.5155 66.6588 68.5341 176.3992 137 E 3.7644 7.6748 120.2952 59.4707 29.2535 179.5528 138 L 3.7830 7.7246 118.7692 57.7685 41.5416 179.3949 139 D 4.2892 8.1398 118.9336 57.1188 40.6747 178.6004 140 L 3.9768 8.1197 119.9245 57.9109 41.7044 179.5289 141 I 3.4624 7.4696 119.5248 64.4911 36.7464 178.5562 142 Q 3.9393 7.4170 117.5054 58.8913 28.6290 178.6339 143 K 4.1424 8.1940 119.0963 58.9150 32.2980 178.4941 144 M 4.3682 8.4392 114.9135 54.0330 32.4907 177.1860 145 G 4.1077 7.5665 105.7951 45.9747 0.0000 174.3308 146 L 3.9604 8.4674 121.7831 58.0752 42.1423 179.4026 147 Q 4.0057 8.0699 117.3510 59.3244 28.8553 178.6469 148 N 4.3752 8.1515 116.7982 56.2767 38.3615 176.7216 149 Y 3.9732 7.9843 120.2092 60.5878 39.1624 177.7734 150 L 4.0702 8.3462 120.2135 58.0669 41.6996 179.1730 151 Q 3.9300 8.1260 119.0226 59.2897 28.6725 178.0030 152 A 4.1674 7.5703 119.0632 53.4013 18.6993 178.2099 153 Q 4.3193 7.8794 116.2164 55.3844 29.1653 177.5839 154 I 3.8358 7.3466 121.8084 63.9745 37.3707 176.6677 155 R 4.5966 7.5220 117.2559 54.0857 31.8079 176.0348 156 E 4.1349 8.3693 118.7380 55.9530 30.5180 175.8625 157 E 4.0771 8.5172 122.0064 55.3623 30.4478 176.5782 *158 G 3.7283 8.6049 114.1647 45.8878 0.0000 172.1668 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 8.16 4.20 0.00 1.45 1.77 0.00 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.46 0.00 2 K 8.50 4.01 0.00 1.71 1.72 0.00 1.77 0.00 0.00 1.68 0.00 0.00 2.86 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.39 1.47 7.81 3 G 8.66 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 0.00 0.00 0.00 4 D 8.48 4.56 0.00 2.77 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 5 T 8.90 3.87 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 1.18 0.00 0.00 6 K 8.18 3.86 0.00 1.72 1.91 0.00 1.41 0.00 0.00 0.92 0.00 0.00 2.62 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.86 1.05 7.81 7 V 8.57 3.91 2.37 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 1.00 0.00 0.00 1.21 0.00 0.00 8 I 7.72 3.76 2.05 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 1.55 0.69 0.92 0.00 0.00 9 N 8.24 4.25 0.00 2.59 2.67 0.00 0.00 7.06 7.03 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 10 Y 7.94 4.09 0.00 3.22 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 11 L 8.56 3.93 0.00 2.00 1.77 1.09 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.49 4.37 0.00 2.88 2.81 0.00 0.00 6.65 8.35 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 13 K 8.30 3.87 0.00 1.76 1.95 0.00 1.58 0.00 0.00 1.61 0.00 0.00 2.99 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.44 1.45 7.81 14 L 8.21 3.82 0.00 0.89 1.21 0.94 0.52 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 15 L 7.90 4.02 0.00 1.67 1.83 1.03 1.17 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 16 G 8.19 3.63 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 0.00 0.00 0.00 17 N 8.01 4.35 0.00 2.99 2.92 0.00 0.00 7.07 7.80 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 18 E 8.29 4.08 0.00 2.26 2.29 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 2.78 2.90 0.00 19 L 8.21 3.99 0.00 1.93 1.74 0.95 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 20 V 7.75 3.59 2.22 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 1.06 0.00 0.00 1.00 0.00 0.00 21 A 8.20 3.87 1.46 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 0.00 0.00 22 I 8.40 3.75 2.11 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 1.71 0.77 0.91 0.00 0.00 23 N 7.90 4.38 0.00 2.86 2.86 0.00 0.00 6.75 7.94 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 24 Q 8.30 3.84 0.00 2.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.82 0.00 0.00 0.00 0.00 0.00 2.22 2.11 0.00 25 Y 8.50 4.35 0.00 3.22 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 26 F 8.58 3.82 0.00 3.41 3.11 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 27 L 8.27 3.97 0.00 1.96 1.60 0.90 1.18 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 28 H 8.25 3.84 0.00 3.53 3.18 0.00 5.72 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 A 8.29 4.18 1.28 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 0.00 0.00 0.00 30 R 7.82 3.88 0.00 1.80 1.93 0.00 3.33 0.00 0.00 3.12 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.82 0.00 31 M 7.85 3.60 0.00 1.36 1.73 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.33 0.00 32 F 7.69 4.58 0.00 3.33 3.08 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 0.00 0.00 0.00 33 K 8.19 3.94 0.00 2.00 1.94 0.00 1.56 0.00 0.00 1.50 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.43 7.81 34 N 8.05 4.29 0.00 2.73 2.77 0.00 0.00 7.32 7.87 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 35 F 8.24 4.75 0.00 3.32 3.04 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 36 G 8.11 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 0.00 0.00 0.00 37 L 8.08 4.48 0.00 2.11 1.62 1.04 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 38 K 7.94 3.82 0.00 2.04 1.83 0.00 1.59 0.00 0.00 1.74 0.00 0.00 2.97 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.57 7.81 39 R 8.28 3.93 0.00 2.10 1.98 0.00 3.49 0.00 0.00 3.24 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.79 0.00 40 L 7.91 4.11 0.00 1.68 1.01 1.08 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 41 N 8.17 4.56 0.00 3.10 3.01 0.00 0.00 7.24 8.49 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 42 D 8.07 4.31 0.00 2.88 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 43 V 7.61 3.36 1.83 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 -0.57 0.00 0.00 0.77 0.00 0.00 44 E 8.38 3.83 0.00 2.31 2.19 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 2.60 3.15 0.00 45 Y 8.19 3.82 0.00 2.92 3.01 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 46 H 8.31 4.20 0.00 3.23 3.23 0.00 5.66 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 E 7.55 3.74 0.00 1.52 1.12 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 1.47 1.85 0.00 48 S 7.83 4.08 0.00 3.90 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 49 I 7.32 3.56 1.82 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.67 0.84 0.00 0.00 50 D 7.49 4.20 0.00 2.87 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 51 E 8.14 4.08 0.00 2.24 2.19 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 2.68 2.82 0.00 52 M 8.02 4.06 0.00 2.05 2.24 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 2.81 2.56 0.00 53 K 8.06 3.89 0.00 1.90 1.82 0.00 1.62 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.64 7.81 54 H 8.04 4.11 0.00 3.55 3.33 0.00 5.65 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.35 4.23 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.38 4.31 0.00 2.89 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 57 R 7.89 3.89 0.00 1.82 1.78 0.00 3.14 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.75 0.00 58 Y 7.90 4.32 0.00 3.23 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 59 I 8.28 3.80 2.05 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 1.58 0.95 0.95 0.00 0.00 60 E 8.43 4.08 0.00 2.04 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 2.35 2.62 0.00 61 R 8.16 4.04 0.00 2.14 2.22 0.00 3.35 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.87 0.00 62 I 8.48 3.77 1.94 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.75 1.00 0.00 0.00 63 L 8.07 4.04 0.00 2.11 1.80 0.95 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 64 F 8.16 4.41 0.00 3.01 3.33 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 65 L 8.23 4.57 0.00 1.79 1.60 1.03 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 66 E 7.99 3.86 0.00 2.08 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 2.17 2.27 0.00 67 G 8.19 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 0.00 0.00 0.00 68 L 8.00 4.52 0.00 1.60 1.63 0.92 0.99 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 69 P 0.00 4.37 0.00 2.06 2.03 0.00 3.66 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 2.06 2.12 0.00 70 N 9.44 4.72 0.00 2.59 2.80 0.00 0.00 7.09 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 71 L 8.33 4.63 0.00 1.63 1.64 0.94 0.97 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 72 Q 8.56 4.15 0.00 1.97 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.51 6.73 0.00 0.00 0.00 0.00 0.00 2.33 2.35 0.00 73 D 8.04 4.68 0.00 2.68 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 74 L 8.28 4.59 0.00 1.52 1.50 0.92 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 75 G 8.44 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 76 K 8.32 4.08 0.00 1.72 1.73 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.41 1.45 7.81 77 L 8.36 4.12 0.00 1.64 1.55 0.90 0.97 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 78 N 8.85 4.83 0.00 2.62 2.68 0.00 0.00 7.18 7.32 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 79 I 8.60 3.94 1.88 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 1.34 0.94 0.93 0.00 0.00 80 G 8.11 4.17 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 0.00 0.00 0.00 81 E 8.69 4.59 0.00 1.98 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 2.25 2.29 0.00 82 D 7.68 5.09 0.00 2.84 2.75 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 0.00 0.00 0.00 83 V 8.45 3.96 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 1.26 0.00 0.00 1.21 0.00 0.00 84 E 8.21 3.84 0.00 2.01 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 2.32 2.26 0.00 85 E 8.39 3.99 0.00 2.29 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 0.00 2.33 2.34 0.00 86 M 8.26 4.08 0.00 2.22 1.77 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.90 0.00 87 L 8.45 4.15 0.00 2.03 1.77 1.29 0.62 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 88 R 8.48 3.90 0.00 2.11 1.93 0.00 3.09 0.00 0.00 3.08 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 89 S 8.13 4.09 0.00 4.06 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 90 D 8.14 4.22 0.00 3.12 2.75 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 0.00 0.00 0.00 91 L 8.21 3.98 0.00 1.82 1.89 0.98 0.86 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 92 A 8.21 3.99 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 93 L 7.88 3.94 0.00 1.87 1.81 0.90 0.51 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 94 E 8.28 4.06 0.00 2.47 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 2.50 2.53 0.00 95 L 8.21 4.02 0.00 2.09 1.73 0.96 1.04 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 96 D 8.36 4.53 0.00 2.84 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 97 G 8.34 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 0.00 0.00 0.00 0.00 98 A 8.41 4.08 1.41 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 0.00 0.00 99 K 7.96 3.86 0.00 2.05 2.02 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.50 7.81 100 N 8.07 4.43 0.00 2.99 2.91 0.00 0.00 7.11 6.23 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 0.00 101 L 8.04 3.98 0.00 2.01 1.74 0.98 0.79 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 0.00 102 R 8.17 3.90 0.00 1.98 1.98 0.00 3.14 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.97 0.00 103 E 8.12 3.86 0.00 2.18 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 0.00 2.35 2.37 0.00 104 A 7.92 2.84 1.08 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 0.00 0.00 0.00 0.00 0.00 105 I 8.06 3.71 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 1.46 1.12 0.91 0.00 0.00 106 G 7.60 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.78 4.10 0.00 3.11 2.92 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 0.00 108 A 8.16 3.80 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 0.00 109 D 7.88 4.06 0.00 2.86 2.81 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 0.00 110 S 7.49 4.15 0.00 3.97 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 0.00 111 V 6.86 4.00 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 0.51 0.00 0.00 0.67 0.00 0.00 112 H 7.12 2.82 0.00 3.16 3.33 0.00 5.84 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 D 7.39 4.55 0.00 2.64 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 0.00 0.00 0.00 0.00 114 Y 7.47 4.31 0.00 3.10 2.94 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 0.00 115 V 7.89 3.72 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 0.91 0.00 0.00 0.98 0.00 0.00 116 S 8.34 4.16 0.00 4.20 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 0.00 117 R 8.10 3.88 0.00 1.91 2.21 0.00 3.32 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.67 0.00 118 D 8.40 4.30 0.00 2.99 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 0.00 119 M 8.19 3.96 0.00 2.26 2.04 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 2.48 2.47 0.00 120 M 8.24 4.16 0.00 2.16 2.26 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.94 2.81 0.00 121 I 8.29 3.73 2.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.91 0.92 0.00 0.00 122 E 8.11 3.96 0.00 2.17 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 2.32 2.34 0.00 123 I 7.62 3.55 1.92 0.00 0.00 0.34 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 0.57 0.74 0.00 0.00 124 L 8.11 3.92 0.00 1.85 1.85 0.95 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 125 R 8.05 3.90 0.00 2.00 2.15 0.00 3.15 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 126 D 8.09 4.34 0.00 2.98 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 0.00 127 E 8.36 3.94 0.00 2.13 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 0.00 2.61 2.55 0.00 128 E 8.79 4.15 0.00 2.11 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 2.36 2.36 0.00 129 G 8.00 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 0.00 130 H 8.09 4.43 0.00 3.54 3.56 0.00 5.66 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 0.00 131 I 8.29 3.81 2.11 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 1.50 0.88 0.97 0.00 0.00 132 D 8.45 4.39 0.00 2.90 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 0.00 133 W 8.38 4.14 0.00 3.54 3.49 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 0.00 134 L 8.51 3.75 0.00 2.11 1.76 1.36 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 135 E 8.52 3.93 0.00 2.11 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 0.00 2.33 2.52 0.00 136 T 7.85 3.78 4.21 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 1.16 0.00 0.00 137 E 7.67 3.76 0.00 1.56 1.65 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 1.47 1.47 0.00 138 L 7.72 3.78 0.00 1.73 1.61 0.88 0.79 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 0.00 139 D 8.14 4.29 0.00 2.76 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 0.00 140 L 8.12 3.98 0.00 1.87 1.85 0.94 0.81 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 0.00 141 I 7.47 3.46 1.71 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 -0.05 0.01 0.71 0.00 0.00 142 Q 7.42 3.94 0.00 2.06 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.98 0.00 0.00 0.00 0.00 0.00 2.49 2.49 0.00 143 K 8.19 4.14 0.00 1.69 1.86 0.00 1.68 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.61 7.81 144 M 8.44 4.37 0.00 2.16 2.20 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.85 0.00 145 G 7.57 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 0.00 146 L 8.47 3.96 0.00 1.75 1.68 0.95 0.73 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 0.00 147 Q 8.07 4.01 0.00 2.14 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.68 0.00 0.00 0.00 0.00 0.00 2.45 2.46 0.00 148 N 8.15 4.38 0.00 2.97 2.89 0.00 0.00 6.68 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 Y 7.98 3.97 0.00 3.01 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 0.00 150 L 8.35 4.07 0.00 2.04 1.70 1.06 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 151 Q 8.13 3.93 0.00 2.11 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.86 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 152 A 7.57 4.17 1.22 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 0.00 153 Q 7.88 4.32 0.00 1.90 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.99 6.76 0.00 0.00 0.00 0.00 0.00 1.97 2.14 0.00 154 I 7.35 3.84 1.97 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 1.30 0.44 0.90 0.00 0.00 155 R 7.52 4.60 0.00 1.77 1.82 0.00 3.19 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 156 E 8.37 4.13 0.00 2.08 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 0.00 2.26 2.28 0.00 157 E 8.52 4.08 0.00 1.95 1.89 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 2.26 2.30 0.00 *158 G 8.60 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.