NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 Q 4.2001 8.3444 121.7044 55.6058 30.1869 174.7573 4 N 4.3767 8.5934 123.6909 52.3301 40.0064 172.6947 5 I 4.0627 8.5759 123.6054 62.9457 40.2348 174.7347 6 L 5.3050 7.9705 123.3869 53.5061 45.1450 175.4138 7 S 5.2570 9.1121 122.2196 56.9161 66.7085 173.6481 8 V 5.0428 8.7742 114.5611 59.2907 36.2558 174.0319 9 H 5.4281 8.4281 116.5253 54.7317 32.3946 171.9666 10 I 4.8470 8.8220 119.6086 59.3664 40.8479 174.1898 11 L 4.8219 8.5670 128.7014 53.0997 44.7316 174.7072 12 N 5.0523 9.0330 126.2032 53.2348 39.1329 175.3464 13 Q 4.2942 9.1929 126.3415 57.7632 28.6444 177.7123 14 Q 4.2913 8.9063 118.5926 57.4663 29.2574 176.7527 15 T 4.3106 8.1923 105.7952 60.6696 70.1657 175.3643 16 G 3.9741 8.3690 109.4102 45.9282 0.0000 173.0668 17 K 4.8109 7.5733 117.8982 53.2028 36.4248 174.1549 18 P 4.7281 0.0000 0.0000 62.9317 32.3072 176.3177 19 A 4.3258 8.5465 125.2922 51.1079 19.1041 176.5345 20 A 4.4721 8.6261 123.4326 51.7790 20.8151 175.7786 21 D 4.3057 8.3866 116.8312 55.3091 40.4762 173.8125 22 V 4.2782 7.5453 117.6415 61.2099 33.3573 175.1258 23 T 4.5421 8.5129 125.0636 63.7282 69.8766 173.4395 24 V 4.7757 8.9416 125.9953 61.3115 34.8187 174.5965 25 T 4.8635 8.3632 117.8890 60.1327 71.7811 173.0865 26 L 5.1873 8.5792 124.2871 53.3938 45.0829 175.0744 27 E 5.2449 9.3415 124.6612 54.5324 34.2162 174.3694 28 K 4.4663 9.0012 123.4896 54.6628 35.0029 175.5780 29 K 3.4190 7.9206 128.2529 55.1102 30.9460 176.2011 30 A 4.3088 7.9993 129.5474 49.9685 20.5743 178.3244 31 D 4.2389 8.5200 118.7847 57.7811 40.7473 177.9043 32 N 4.5633 7.7830 113.1739 53.1196 38.8456 173.3525 33 G 3.6021 7.4224 104.8860 43.5872 0.0000 173.4945 34 W 4.4903 8.4784 118.7967 56.5459 29.6277 175.6583 35 L 4.7440 8.8532 124.1917 52.9839 44.4913 175.3053 36 Q 4.4176 8.9142 128.2346 56.5893 29.1002 175.2413 37 L 4.4892 8.6241 126.1421 56.1985 43.7422 176.0117 38 N 4.7665 7.4780 114.3235 53.0373 42.3749 173.0885 39 T 5.0714 8.1623 115.7214 60.8496 71.0132 172.1541 40 A 4.5930 8.5053 127.4118 51.3404 23.5612 174.8068 41 K 5.1493 8.3067 117.5717 54.4861 35.4501 177.1298 42 T 4.2265 8.6175 115.2373 62.2015 70.0663 174.7160 43 D 4.9980 8.6076 124.0139 52.5555 41.5873 176.7049 44 K 4.0700 8.5838 116.8068 60.0050 32.7820 177.0928 45 D 4.5904 8.3080 117.9184 53.8582 40.9286 176.6852 46 G 3.9824 8.1867 107.4737 46.1495 0.0000 173.5332 47 R 4.9774 8.3119 118.0931 54.0833 32.7819 175.4979 48 I 4.7863 8.3951 122.2538 59.2611 37.9270 176.5713 49 K 4.0129 8.5510 125.1328 58.3327 32.2331 177.6176 50 A 4.6413 7.5499 120.0037 50.4111 19.4058 174.6463 51 L 4.2836 8.8219 123.3309 56.2590 42.9654 177.3956 52 W 3.9216 8.1387 128.3833 56.3187 31.1286 173.7192 53 P 4.6025 0.0000 0.0000 62.2634 31.7085 175.9763 54 E 4.2013 8.6383 117.1611 58.9450 29.5769 178.1177 55 Q 4.2549 7.9389 116.0930 55.7639 29.3497 176.1448 56 T 3.8965 8.4807 116.7388 63.9273 69.0453 174.0505 57 A 4.6133 8.2935 128.8981 51.9254 19.3189 176.4536 58 T 4.7327 7.8720 110.4541 59.3213 71.6552 174.0002 59 T 4.7418 7.6145 111.5557 61.1394 69.6193 173.8326 60 G 3.9380 8.0817 107.8477 43.8424 0.0000 171.5158 61 D 5.2078 7.8471 119.2499 53.3160 42.9515 175.7564 62 Y 5.4160 8.2018 118.2977 56.5175 43.1408 174.2659 63 R 5.1161 9.1458 116.6395 55.0202 33.2864 174.2625 64 V 4.6284 8.7466 115.5073 59.7948 34.3033 175.1176 65 V 4.6028 8.0582 124.2757 61.0526 34.0610 174.2935 66 F 4.5372 8.8898 128.2419 56.2863 39.6874 177.0833 67 K 4.6335 8.7309 128.2149 55.7213 28.5750 177.9342 68 T 4.1296 7.6826 112.9809 64.2655 69.5815 176.9584 69 G 4.2398 8.1894 109.6887 47.3905 0.0000 175.1160 70 D 4.4136 8.1309 121.0630 56.9844 39.4909 177.9141 71 Y 4.0461 7.5795 118.7867 61.0057 38.7663 178.5103 72 F 4.4614 8.3287 118.5856 60.2958 39.1658 177.7243 73 K 4.0368 8.3777 119.2774 59.2894 31.7015 179.0054 74 K 4.0269 7.8463 117.9369 58.9135 32.1024 177.6507 75 Q 4.3003 7.3007 115.7700 54.9453 28.7859 175.1265 76 N 4.2321 7.6937 113.9232 54.6464 36.6775 174.1606 77 L 4.7948 7.8743 115.9233 52.8951 44.6418 177.0374 78 E 4.3735 8.4970 121.8355 56.0175 30.6003 175.8130 79 S 3.9606 7.8062 113.6784 56.1953 65.6054 173.9637 80 F 4.2745 7.5839 127.6632 60.0659 39.2070 175.4120 81 F 4.8537 7.1088 119.7256 54.5494 40.7348 173.8616 82 P 4.3860 0.0000 0.0000 65.7914 31.2786 175.3559 83 E 5.0498 7.4896 113.6839 55.6692 32.5316 175.2570 84 I 4.3427 8.4862 120.2908 58.7305 39.7121 173.3046 85 P 4.9385 0.0000 0.0000 62.1315 32.8970 175.9194 86 V 4.4646 8.9322 122.1343 61.4339 34.4415 173.8715 87 E 5.3002 8.9698 127.6775 55.3700 31.3144 175.4373 88 F 5.0313 8.5922 116.8077 56.2135 41.7227 172.6584 89 H 5.0025 8.9722 117.6450 55.1826 30.3826 175.0836 90 I 4.1971 8.6655 123.9401 59.7994 38.3210 175.6856 91 N 4.5741 9.0878 125.0022 53.2279 38.4565 175.4706 92 K 4.5427 8.2195 118.0533 54.4866 34.1725 177.2474 93 V 3.7519 8.4343 117.6944 63.1347 31.7879 176.8630 94 N 4.4785 8.0037 116.7407 54.3565 39.0273 174.4705 95 E 4.2971 7.7644 117.9066 56.2173 30.8678 174.0808 96 H 5.0563 8.1891 120.1225 55.1525 31.3221 173.5406 97 Y 4.5464 8.9374 123.3880 56.3141 40.8890 174.0720 98 H 5.0489 8.6747 123.2534 54.4255 33.0816 172.0883 99 V 4.4613 8.4760 125.4040 59.2213 32.1614 172.8051 100 P 4.3119 0.0000 0.0000 61.6097 33.2668 174.6395 101 L 4.8320 8.3874 123.7450 53.2201 45.1335 175.0094 102 L 5.0240 9.0060 127.1248 53.2521 43.5231 175.1134 103 L 5.1504 8.9521 126.8987 53.3755 43.8247 175.4248 104 S 5.3403 9.3083 121.1731 56.5567 67.1835 175.2248 105 Q 3.4436 9.5672 120.1226 58.6836 28.4064 178.1287 106 Y 4.8025 7.3852 109.7445 56.8254 39.4066 175.0868 107 G 4.4171 8.2991 106.7769 45.4217 0.0000 172.1639 108 Y 5.4238 7.7895 117.6090 56.0419 41.1232 173.8332 109 S 4.8883 9.1977 115.1469 57.3488 67.2550 173.2298 110 T 5.1416 8.5332 115.9376 60.8961 70.4806 171.5432 111 Y 4.6815 7.5236 120.9531 56.2781 41.0884 172.7982 112 R 4.5108 8.9170 121.1806 55.8699 30.4878 176.2861 113 G 4.1423 8.7911 115.1095 44.9742 0.0000 173.5055 114 S 4.4513 8.4707 114.6840 58.7734 62.9433 174.6710 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 3 Q 8.34 4.20 0.00 1.92 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.97 0.00 0.00 0.00 0.00 0.00 1.93 2.13 0.00 4 N 8.59 4.38 0.00 2.82 2.83 0.00 0.00 7.07 7.06 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 5 I 8.58 4.06 1.59 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 1.21 0.32 0.00 0.00 6 L 7.97 5.30 0.00 2.10 1.78 0.92 1.14 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 7 S 9.11 5.26 0.00 3.36 3.53 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.77 5.04 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.93 0.00 0.00 9 H 8.43 5.43 0.00 3.26 3.37 0.00 5.40 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 I 8.82 4.85 1.67 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.68 0.59 0.00 0.00 11 L 8.57 4.82 0.00 1.79 1.51 0.99 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 12 N 9.03 5.05 0.00 2.87 2.97 0.00 0.00 6.79 6.90 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 13 Q 9.19 4.29 0.00 2.14 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.03 6.73 0.00 0.00 0.00 0.00 0.00 2.45 2.48 0.00 14 Q 8.91 4.29 0.00 2.26 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.78 0.00 0.00 0.00 0.00 0.00 2.48 2.59 0.00 15 T 8.19 4.31 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 1.30 0.00 0.00 16 G 8.37 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 17 K 7.57 4.81 0.00 1.65 1.69 0.00 1.71 0.00 0.00 1.67 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.56 1.56 7.81 18 P 0.00 4.73 0.00 1.93 2.12 0.00 3.68 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 19 A 8.55 4.33 0.47 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 20 A 8.63 4.47 1.29 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 0.00 0.00 21 D 8.39 4.31 0.00 2.83 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 22 V 7.55 4.28 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 0.88 0.00 0.00 0.63 0.00 0.00 23 T 8.51 4.54 4.22 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 1.17 0.00 0.00 24 V 8.94 4.78 1.91 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 0.42 0.00 0.00 0.95 0.00 0.00 25 T 8.36 4.86 4.13 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 1.12 0.00 0.00 26 L 8.58 5.19 0.00 1.59 1.31 0.93 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 27 E 9.34 5.24 0.00 1.87 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 0.00 2.22 2.15 0.00 28 K 9.00 4.47 0.00 1.83 1.55 0.00 1.73 0.00 0.00 1.51 0.00 0.00 2.56 0.00 0.00 3.20 0.00 0.00 0.00 0.00 0.93 0.45 7.81 29 K 7.92 3.42 0.00 0.79 1.12 0.00 1.50 0.00 0.00 1.39 0.00 0.00 2.61 0.00 0.00 2.52 0.00 0.00 0.00 0.00 0.82 0.21 7.81 30 A 8.00 4.31 1.19 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 0.00 0.00 0.00 31 D 8.52 4.24 0.00 2.60 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 32 N 7.78 4.56 0.00 2.66 2.79 0.00 0.00 7.07 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 33 G 7.42 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 0.00 0.00 0.00 34 W 8.48 4.49 0.00 3.24 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 35 L 8.85 4.74 0.00 1.69 1.57 0.91 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 36 Q 8.91 4.42 0.00 2.08 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 6.64 0.00 0.00 0.00 0.00 0.00 2.27 2.43 0.00 37 L 8.62 4.49 0.00 1.21 1.31 0.61 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 38 N 7.48 4.77 0.00 2.62 2.50 0.00 0.00 6.58 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 39 T 8.16 5.07 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 1.17 0.00 0.00 40 A 8.51 4.59 1.19 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 0.00 0.00 0.00 41 K 8.31 5.15 0.00 1.59 1.68 0.00 1.75 0.00 0.00 1.95 0.00 0.00 2.76 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.31 1.37 7.81 42 T 8.62 4.23 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 43 D 8.61 5.00 0.00 2.94 2.89 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 44 K 8.58 4.07 0.00 1.89 2.00 0.00 1.57 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.41 1.46 7.81 45 D 8.31 4.59 0.00 2.81 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 46 G 8.19 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 0.00 0.00 0.00 47 R 8.31 4.98 0.00 2.17 1.82 0.00 3.07 0.00 0.00 3.13 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.75 0.00 48 I 8.40 4.79 1.86 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 1.28 1.05 0.90 0.00 0.00 49 K 8.55 4.01 0.00 1.75 1.89 0.00 1.70 0.00 0.00 1.72 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.45 7.81 50 A 7.55 4.64 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.82 4.28 0.00 1.58 1.84 0.84 1.13 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 52 W 8.14 3.92 0.00 3.41 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 53 P 0.00 4.60 0.00 2.19 2.13 0.00 2.57 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 1.78 1.68 0.00 54 E 8.64 4.20 0.00 2.00 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 2.34 2.40 0.00 55 Q 7.94 4.25 0.00 2.25 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.90 0.00 0.00 0.00 0.00 0.00 2.37 2.53 0.00 56 T 8.48 3.90 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 1.22 0.00 0.00 57 A 8.29 4.61 0.44 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 58 T 7.87 4.73 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 1.30 0.00 0.00 59 T 7.61 4.74 4.33 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 1.28 0.00 0.00 60 G 8.08 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 61 D 7.85 5.21 0.00 2.38 2.52 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 62 Y 8.20 5.42 0.00 1.81 2.44 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 63 R 9.15 5.12 0.00 1.66 1.53 0.00 2.21 0.00 0.00 2.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 1.14 0.00 64 V 8.75 4.63 1.49 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 0.67 0.00 0.00 0.84 0.00 0.00 65 V 8.06 4.60 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 0.94 0.00 0.00 0.77 0.00 0.00 66 F 8.89 4.54 0.00 2.80 2.79 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 0.00 0.00 0.00 67 K 8.73 4.63 0.00 1.80 1.77 0.00 1.65 0.00 0.00 1.74 0.00 0.00 2.90 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.55 7.81 68 T 7.68 4.13 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 1.07 0.00 0.00 69 G 8.19 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 70 D 8.13 4.41 0.00 2.90 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 71 Y 7.58 4.05 0.00 2.95 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 72 F 8.33 4.46 0.00 3.16 3.16 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 0.00 73 K 8.38 4.04 0.00 2.01 1.96 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.50 7.81 74 K 7.85 4.03 0.00 1.89 1.79 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.46 7.81 75 Q 7.30 4.30 0.00 2.28 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.77 0.00 0.00 0.00 0.00 0.00 2.23 2.07 0.00 76 N 7.69 4.23 0.00 2.89 2.88 0.00 0.00 6.69 7.13 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 77 L 7.87 4.79 0.00 1.86 1.48 1.09 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 78 E 8.50 4.37 0.00 2.03 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 2.32 2.32 0.00 79 S 7.81 3.96 0.00 3.55 3.67 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 80 F 7.58 4.27 0.00 2.30 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 81 F 7.11 4.85 0.00 3.05 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 82 P 0.00 4.39 0.00 2.22 2.31 0.00 3.75 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 2.07 1.93 0.00 83 E 7.49 5.05 0.00 2.08 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 2.13 2.26 0.00 84 I 8.49 4.34 1.56 0.00 0.00 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.42 0.01 0.00 0.00 85 P 0.00 4.94 0.00 1.94 1.89 0.00 3.66 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.89 0.00 86 V 8.93 4.46 2.26 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 1.10 0.00 0.00 1.09 0.00 0.00 87 E 8.97 5.30 0.00 1.94 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 2.52 2.13 0.00 88 F 8.59 5.03 0.00 3.18 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 89 H 8.97 5.00 0.00 3.19 3.32 0.00 5.64 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 I 8.67 4.20 1.96 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 -0.10 0.85 0.79 0.00 0.00 91 N 9.09 4.57 0.00 2.88 3.01 0.00 0.00 6.06 7.13 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 92 K 8.22 4.54 0.00 1.88 1.77 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.92 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.41 1.69 7.81 93 V 8.43 3.75 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 0.64 0.00 0.00 0.91 0.00 0.00 94 N 8.00 4.48 0.00 2.67 2.81 0.00 0.00 7.01 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 95 E 7.76 4.30 0.00 2.01 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 2.18 2.17 0.00 96 H 8.19 5.06 0.00 3.05 3.11 0.00 5.87 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 97 Y 8.94 4.55 0.00 2.97 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 98 H 8.67 5.05 0.00 3.10 3.03 0.00 5.63 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 V 8.48 4.46 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 1.09 0.00 0.00 0.38 0.00 0.00 100 P 0.00 4.31 0.00 1.41 1.41 0.00 2.72 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.76 0.00 101 L 8.39 4.83 0.00 0.54 0.66 0.47 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 102 L 9.01 5.02 0.00 1.68 1.77 1.02 0.22 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 0.00 103 L 8.95 5.15 0.00 1.60 1.59 1.03 0.70 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 0.00 104 S 9.31 5.34 0.00 4.06 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 0.00 105 Q 9.57 3.44 0.00 2.07 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.81 0.00 0.00 0.00 0.00 0.00 1.16 1.90 0.00 106 Y 7.39 4.80 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 0.00 107 G 8.30 4.42 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 0.00 0.00 0.00 108 Y 7.79 5.42 0.00 2.93 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 0.00 109 S 9.20 4.89 0.00 3.85 3.83 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 0.00 110 T 8.53 5.14 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 1.32 0.00 0.00 111 Y 7.52 4.68 0.00 3.10 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 0.00 112 R 8.92 4.51 0.00 1.93 1.99 0.00 3.38 0.00 0.00 3.30 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 113 G 8.79 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 0.00 0.00 0.00 114 S 8.47 4.45 0.00 3.89 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