NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1695 8.1727 122.0522 56.3035 34.1242 174.1069 2 V 4.5542 8.1792 127.0958 60.6845 32.2158 174.4847 3 F 4.2632 10.0403 128.8927 57.5736 40.2052 174.8025 4 E 4.2742 8.7788 121.0514 55.3936 31.1325 176.6449 5 R 3.2413 8.9618 120.6637 60.9389 29.9555 179.3686 6 C 4.3203 8.0049 115.2346 59.7345 35.3883 175.7106 7 E 3.9074 8.1471 120.6449 59.2354 29.1988 178.5208 8 L 3.6278 8.0542 120.0515 57.9034 42.1323 178.5904 9 A 3.9406 7.8506 120.7006 55.4559 18.3959 179.9057 10 R 3.9033 8.0965 116.3995 59.5319 30.2027 179.5086 11 T 3.8556 7.8249 115.3845 66.6676 68.4804 176.7533 12 L 3.8719 8.0791 121.2218 57.5425 41.5949 179.5201 13 K 3.9175 7.9737 119.5530 59.5473 31.9398 178.9323 14 R 3.9716 7.7416 117.6786 58.8409 30.0526 177.4723 15 L 4.3486 7.4708 116.2236 53.9379 41.9824 176.5360 16 G 3.8047 7.8744 106.8341 47.1198 0.0000 175.0744 17 M 3.9094 7.8301 120.6742 56.2125 32.6134 175.8723 18 D 4.4788 7.9997 117.7102 56.1218 41.1217 175.6467 19 G 3.9332 9.3575 115.5187 45.5321 0.0000 171.2542 20 Y 4.1523 8.3428 122.0688 58.4464 38.8373 176.2155 21 R 3.6434 8.9750 126.4665 57.2631 27.7038 177.3257 22 G 3.8142 8.1141 104.1076 45.5387 0.0000 174.1319 23 I 4.0711 7.6334 122.1449 59.1600 37.9018 175.8373 24 S 4.6348 8.3322 120.4542 57.7278 63.9696 174.8230 25 L 4.1836 8.9363 123.7221 58.7760 41.7224 179.3968 26 A 4.1435 8.2315 119.8859 55.4433 18.2384 179.2356 27 N 4.4485 8.2790 115.0420 56.2342 38.5859 177.7422 28 W 4.2295 8.0283 120.0105 59.9000 29.2192 178.3932 29 M 4.1777 8.4847 118.9237 58.5391 31.4653 177.9453 30 C 3.1691 8.1272 118.6941 59.0266 44.8548 175.3590 31 L 3.9487 8.1084 121.6693 58.2799 41.7772 178.8026 32 A 4.1824 8.3126 120.7405 54.9339 18.2009 179.4355 33 K 2.9032 8.0647 118.0302 59.3687 32.0616 179.0676 34 W 4.2897 7.6205 116.9399 58.8716 29.0849 178.3901 35 E 4.3409 8.2215 118.6249 58.5684 29.3963 177.6493 36 S 4.5294 7.8985 109.5746 56.5446 64.5327 174.3399 37 G 3.1922 7.9120 108.6293 47.0458 0.0000 173.3710 38 Y 3.6857 7.6938 113.1946 58.6043 35.6445 168.5589 39 N 5.3289 7.6198 117.8833 51.9996 40.3232 175.7094 40 T 4.1548 8.9503 117.0981 63.8048 69.2743 175.9767 41 R 4.4757 8.0080 116.9579 55.6304 29.9685 176.0452 42 A 4.3427 7.6117 121.8615 52.6241 19.2537 177.1964 43 T 4.9694 8.4179 111.6943 59.9293 72.4248 173.2968 44 N 4.8214 8.8611 122.0331 51.9937 42.0347 172.8683 45 F 4.6387 8.9492 129.5506 58.1417 40.6853 174.7723 46 N 4.4957 8.3980 124.4641 51.1748 38.3899 175.2558 47 A 3.6861 8.3401 127.6921 54.8802 18.8665 179.1107 48 G 3.7696 8.0867 104.0122 48.1269 0.0000 173.7849 49 D 4.7093 7.4721 114.9199 51.9734 40.1870 175.9079 50 R 3.8565 7.8879 117.0229 57.2808 28.2156 175.8927 51 S 4.9206 7.5772 112.7179 57.2905 66.1302 172.9000 52 T 5.1089 8.7239 116.0226 61.9402 72.6394 172.7999 53 D 5.4366 8.9493 125.3845 53.3693 42.9970 175.0547 54 Y 4.9906 9.0306 121.1068 57.3912 41.4834 177.5260 55 G 4.3924 9.0316 112.4190 45.7303 0.0000 173.4168 56 I 3.9842 8.2516 116.8589 62.9138 37.8086 177.3045 57 F 4.7411 7.9264 115.4041 56.4102 39.9048 175.2014 58 Q 3.6038 7.9896 119.2403 57.1090 26.5671 174.2108 59 I 4.3844 8.1324 118.9400 61.0850 39.2662 176.9605 60 N 5.2964 9.2342 126.3016 53.5256 39.7072 175.6892 61 S 4.6915 9.0829 120.5691 60.1388 63.3635 175.4324 62 R 3.7419 8.8153 122.3010 58.6860 30.3975 177.7095 63 Y 4.2172 7.7041 114.5013 58.3098 40.6739 177.2962 64 W 4.6557 8.0373 118.9386 57.9153 29.8940 173.7075 65 C 5.6056 7.9385 110.6589 53.4819 45.7662 171.7921 66 N 5.0810 8.8596 119.3165 52.0205 39.8501 174.6483 67 D 4.8041 8.5299 123.0461 52.1987 40.5283 178.2030 68 G 4.0687 8.3087 108.4273 46.0929 0.0000 174.7227 69 K 4.3785 7.8085 116.0847 56.8895 33.4563 176.4593 70 T 4.2998 7.5304 116.6896 62.1217 69.0411 172.9565 71 P 4.2873 0.0000 0.0000 63.7182 31.9205 176.2540 72 G 3.9247 8.5549 109.9529 46.4373 0.0000 172.8377 73 A 4.6068 7.7998 118.7574 50.5627 20.8084 177.6703 74 V 4.2659 8.2857 113.0692 59.2902 35.2206 176.0090 75 N 4.9288 8.0369 117.4317 51.8806 37.6395 174.3313 76 A 3.8944 8.9429 125.4144 55.0867 19.0905 178.6693 77 C 4.4757 8.5258 110.9966 57.6166 41.0917 173.0692 78 H 4.1564 7.8630 116.5056 56.6057 26.3090 173.9944 79 L 4.8253 8.4161 118.0145 52.9201 46.5482 176.5940 80 S 4.6579 8.3500 115.2345 57.9297 63.3437 176.0461 81 C 4.1223 8.6287 124.1532 59.5937 40.4898 176.3723 82 S 3.9213 7.6685 114.7777 61.2308 61.6396 175.8992 83 A 4.0873 7.7818 122.7290 54.6485 17.8926 177.9701 84 L 4.4487 7.7587 115.9960 55.1015 41.6648 177.6560 85 L 5.0129 7.8903 117.0255 54.5631 42.3288 176.7130 86 Q 4.3874 7.7689 117.8674 55.3297 29.6149 175.8992 87 D 4.4196 8.5093 119.4885 57.0595 41.1525 176.7947 88 N 4.5776 8.0462 118.2203 53.1774 39.1416 174.5168 89 I 4.2415 8.4550 119.1479 61.0689 37.9584 177.0607 90 A 3.9362 8.6248 125.2614 56.0815 18.1946 180.2741 91 D 4.3105 8.0843 116.4928 57.3667 40.9349 178.7209 92 A 4.1159 7.9634 120.9752 55.1172 18.4223 179.7340 93 V 3.4386 8.1317 116.8010 65.9605 31.4722 178.1688 94 A 3.8407 7.9245 120.6604 55.2014 18.1093 178.8294 95 C 4.2539 8.3333 116.8989 59.5806 38.8707 175.5930 96 A 3.9117 8.1060 122.5522 55.0423 17.6225 179.7388 97 K 3.7675 7.6606 116.1969 59.3835 32.3125 179.2253 98 R 4.0730 7.6414 118.7968 59.3279 30.0470 178.4784 99 V 2.2117 7.4675 118.0913 65.8278 30.8683 177.9874 100 V 3.8940 7.6700 109.6383 62.5191 31.2893 177.7596 101 R 4.1465 7.7245 118.4531 57.3924 30.4875 176.0408 102 D 4.7078 7.3708 118.5177 53.0844 41.7615 175.1819 103 P 4.2363 0.0000 0.0000 66.3286 31.1051 177.8306 104 Q 4.0078 8.1439 117.4149 56.5886 30.0662 177.1379 105 G 3.7505 7.9175 106.9710 46.9739 0.0000 176.4068 106 I 3.5591 7.7802 120.9169 63.4196 37.9348 177.7836 107 R 4.2137 7.2486 117.8578 57.8210 29.9697 177.5036 108 A 3.8933 7.5531 120.6298 54.1706 18.7432 177.6476 109 W 4.6502 8.0006 117.1969 55.4979 29.8062 177.5474 110 V 3.7453 8.7117 123.7700 65.9620 30.9128 177.6149 111 A 4.0681 8.2997 120.1943 54.7621 18.1016 179.2394 112 W 3.9804 8.3464 126.6234 60.6836 30.5698 178.4648 113 R 3.6927 8.1390 116.4905 59.1887 29.6539 178.4345 114 N 4.3426 7.9015 115.1378 55.8406 38.7682 176.9554 115 R 4.0701 7.7146 115.8136 55.9375 31.4087 176.0398 116 C 4.5405 7.1134 114.6374 57.8688 42.8294 174.2357 117 Q 3.2208 6.5149 119.7398 57.4292 28.6126 175.8723 118 N 4.2146 8.7409 120.2496 54.0602 36.0578 173.6588 119 R 4.4769 7.3928 116.0569 54.0882 32.9433 175.5644 120 D 4.5750 8.4048 118.7810 53.9458 40.3181 175.8309 121 V 4.5472 8.1956 119.0784 61.4082 32.4611 178.3822 122 R 4.0211 8.1292 122.3063 59.4991 29.6128 178.5780 123 Q 3.9759 8.1217 115.7934 59.6854 28.2122 178.3099 124 Y 4.3641 7.8025 117.4536 59.8246 38.1931 176.7020 125 V 4.3701 7.8577 110.9506 60.5892 33.0267 175.1144 126 Q 4.1303 7.9862 122.4439 57.3460 29.1383 176.3012 127 G 3.9775 8.9741 113.2029 45.9029 0.0000 174.3762 128 C 4.4174 7.9596 115.7493 56.8447 40.6016 173.7352 129 G 3.8319 8.0936 107.2346 47.0112 0.0000 174.1726 130 V 4.0133 7.8816 117.7741 61.1049 32.1594 175.9409 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 K 8.17 4.17 0.00 2.00 1.66 0.00 1.29 0.00 0.00 1.07 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.95 1.15 7.81 2 V 8.18 4.55 2.09 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 0.90 0.00 0.00 0.95 0.00 0.00 3 F 10.04 4.26 0.00 2.86 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 4 E 8.78 4.27 0.00 1.87 1.86 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 2.29 2.23 0.00 5 R 8.96 3.24 0.00 1.93 1.90 0.00 3.44 0.00 0.00 3.47 7.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.80 0.00 6 C 8.00 4.32 0.00 3.00 3.12 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 0.00 0.00 0.00 7 E 8.15 3.91 0.00 2.05 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 0.00 2.61 2.42 0.00 8 L 8.05 3.63 0.00 1.42 1.43 -0.06 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.85 3.94 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.10 3.90 0.00 1.88 1.99 0.00 3.14 0.00 0.00 3.29 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 11 T 7.82 3.86 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 1.21 0.00 0.00 12 L 8.08 3.87 0.00 1.73 1.58 0.93 0.60 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 13 K 7.97 3.92 0.00 1.96 1.93 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.46 7.81 14 R 7.74 3.97 0.00 1.99 2.08 0.00 3.30 0.00 0.00 3.22 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 15 L 7.47 4.35 0.00 1.69 1.55 0.84 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.87 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 17 M 7.83 3.91 0.00 1.30 1.95 0.00 0.00 0.00 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.20 0.00 18 D 8.00 4.48 0.00 2.67 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 19 G 9.36 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 20 Y 8.34 4.15 0.00 3.32 3.19 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 21 R 8.98 3.64 0.00 1.93 1.86 0.00 3.19 0.00 0.00 2.96 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.44 0.00 22 G 8.11 3.81 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 0.00 23 I 7.63 4.07 1.79 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.71 -0.19 0.00 0.00 24 S 8.33 4.63 0.00 4.06 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 25 L 8.94 4.18 0.00 2.07 1.82 0.98 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.23 4.14 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 0.00 0.00 0.00 0.00 0.00 27 N 8.28 4.45 0.00 2.82 2.73 0.00 0.00 6.94 7.70 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 28 W 8.03 4.23 0.00 3.55 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 29 M 8.48 4.18 0.00 2.17 2.36 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.90 0.00 30 C 8.13 3.17 0.00 2.51 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 L 8.11 3.95 0.00 1.87 1.84 0.66 -0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.31 4.18 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.06 2.90 0.00 1.58 1.75 0.00 0.70 0.00 0.00 1.08 0.00 0.00 2.59 0.00 0.00 2.59 0.00 0.00 0.00 0.00 1.10 0.21 7.81 34 W 7.62 4.29 0.00 3.35 3.27 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 35 E 8.22 4.34 0.00 2.03 2.09 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 2.58 2.39 0.00 36 S 7.90 4.53 0.00 4.06 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 37 G 7.91 3.19 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 0.00 38 Y 7.69 3.69 0.00 3.22 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 39 N 7.62 5.33 0.00 2.85 2.80 0.00 0.00 7.01 7.10 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 40 T 8.95 4.15 4.45 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 1.44 0.00 0.00 41 R 8.01 4.48 0.00 2.00 2.09 0.00 3.08 0.00 0.00 3.25 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.72 0.00 42 A 7.61 4.34 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.42 4.97 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 1.32 0.00 0.00 44 N 8.86 4.82 0.00 3.03 2.68 0.00 0.00 6.83 7.26 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 45 F 8.95 4.64 0.00 3.00 2.97 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 46 N 8.40 4.50 0.00 2.61 2.57 0.00 0.00 6.52 6.78 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 47 A 8.34 3.69 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 48 G 8.09 3.77 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 D 7.47 4.71 0.00 2.70 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 50 R 7.89 3.86 0.00 2.05 2.24 0.00 3.19 0.00 0.00 3.36 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.59 0.00 51 S 7.58 4.92 0.00 3.95 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 52 T 8.72 5.11 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 0.63 0.00 0.00 53 D 8.95 5.44 0.00 2.67 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 54 Y 9.03 4.99 0.00 3.02 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 55 G 9.03 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.25 3.98 1.65 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 1.71 -0.01 0.00 0.00 57 F 7.93 4.74 0.00 3.21 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 58 Q 7.99 3.60 0.00 2.52 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.83 6.84 0.00 0.00 0.00 0.00 0.00 2.51 2.69 0.00 59 I 8.13 4.38 2.15 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.10 1.16 0.00 0.00 60 N 9.23 5.30 0.00 3.02 3.06 0.00 0.00 6.97 7.27 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 61 S 9.08 4.69 0.00 4.08 4.39 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.82 3.74 0.00 1.60 1.40 0.00 2.67 0.00 0.00 2.87 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.08 0.00 63 Y 7.70 4.22 0.00 1.55 1.88 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 64 W 8.04 4.66 0.00 3.58 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 65 C 7.94 5.61 0.00 3.15 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 66 N 8.86 5.08 0.00 2.79 2.69 0.00 0.00 7.10 8.33 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 67 D 8.53 4.80 0.00 2.97 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 68 G 8.31 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 0.00 0.00 0.00 69 K 7.81 4.38 0.00 1.90 1.95 0.00 1.62 0.00 0.00 1.72 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.49 7.81 70 T 7.53 4.30 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 1.17 0.00 0.00 71 P 0.00 4.29 0.00 2.02 1.98 0.00 3.82 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 72 G 8.55 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 73 A 7.80 4.61 1.23 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 0.00 0.00 0.00 74 V 8.29 4.27 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 0.62 0.00 0.00 0.86 0.00 0.00 75 N 8.04 4.93 0.00 2.78 2.64 0.00 0.00 6.76 7.83 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 76 A 8.94 3.89 1.23 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 0.00 0.00 0.00 77 C 8.53 4.48 0.00 3.31 3.24 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 78 H 7.86 4.16 0.00 3.30 3.35 0.00 5.80 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 79 L 8.42 4.83 0.00 1.66 1.50 0.97 0.86 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 80 S 8.35 4.66 0.00 3.83 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 81 C 8.63 4.12 0.00 2.25 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 S 7.67 3.92 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 83 A 7.78 4.09 1.40 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 0.00 0.00 0.00 0.00 0.00 0.00 84 L 7.76 4.45 0.00 1.93 1.80 1.05 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.89 5.01 0.00 1.79 1.71 1.11 0.91 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 86 Q 7.77 4.39 0.00 2.25 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.56 7.10 0.00 0.00 0.00 0.00 0.00 2.37 2.59 0.00 87 D 8.51 4.42 0.00 2.63 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 88 N 8.05 4.58 0.00 2.70 2.75 0.00 0.00 6.96 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 89 I 8.45 4.24 1.76 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.39 0.95 0.00 0.00 90 A 8.62 3.94 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 0.00 0.00 0.00 0.00 0.00 91 D 8.08 4.31 0.00 2.72 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 92 A 7.96 4.12 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 0.00 0.00 0.00 0.00 0.00 93 V 8.13 3.44 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 0.71 0.00 0.00 0.90 0.00 0.00 94 A 7.92 3.84 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 95 C 8.33 4.25 0.00 3.16 3.28 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 96 A 8.11 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.66 3.77 0.00 1.65 1.45 0.00 1.30 0.00 0.00 0.83 0.00 0.00 2.25 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.30 1.01 7.81 98 R 7.64 4.07 0.00 1.93 2.17 0.00 3.30 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 2.00 0.00 99 V 7.47 2.21 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 -0.30 0.00 0.00 -0.54 0.00 0.00 100 V 7.67 3.89 2.12 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 1.15 0.00 0.00 1.44 0.00 0.00 101 R 7.72 4.15 0.00 2.21 2.02 0.00 3.34 0.00 0.00 3.30 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.76 0.00 102 D 7.37 4.71 0.00 3.10 2.60 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 0.00 103 P 0.00 4.24 0.00 2.15 2.20 0.00 3.78 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.01 0.00 104 Q 8.14 4.01 0.00 2.06 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.80 0.00 0.00 0.00 0.00 0.00 2.41 2.31 0.00 105 G 7.92 3.75 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 0.00 0.00 0.00 106 I 7.78 3.56 1.02 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 -0.30 -0.23 -0.54 0.00 0.00 107 R 7.25 4.21 0.00 1.97 2.02 0.00 3.22 0.00 0.00 3.27 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.57 0.00 108 A 7.55 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.00 4.65 0.00 3.53 3.26 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 0.00 110 V 8.71 3.75 2.17 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 1.09 0.00 0.00 0.99 0.00 0.00 111 A 8.30 4.07 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 0.00 0.00 0.00 0.00 0.00 112 W 8.35 3.98 0.00 3.49 3.50 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.14 3.69 0.00 2.06 1.98 0.00 3.60 0.00 0.00 3.58 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 2.14 0.00 114 N 7.90 4.34 0.00 2.68 2.70 0.00 0.00 6.96 7.72 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 0.00 115 R 7.71 4.07 0.00 0.84 0.72 0.00 2.82 0.00 0.00 2.85 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.96 0.00 116 C 7.11 4.54 0.00 1.71 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 0.00 117 Q 6.51 3.22 0.00 0.93 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.57 0.00 0.00 0.00 0.00 0.00 2.17 2.16 0.00 118 N 8.74 4.21 0.00 2.81 2.84 0.00 0.00 6.92 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 0.00 119 R 7.39 4.48 0.00 1.87 1.82 0.00 3.25 0.00 0.00 3.08 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.56 0.00 120 D 8.40 4.58 0.00 2.64 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 0.00 121 V 8.20 4.55 2.39 0.00 0.00 0.00 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 1.06 0.00 0.00 122 R 8.13 4.02 0.00 1.92 2.02 0.00 3.33 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.74 0.00 123 Q 8.12 3.98 0.00 2.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.12 0.00 0.00 0.00 0.00 0.00 2.04 1.59 0.00 124 Y 7.80 4.36 0.00 3.24 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 0.00 125 V 7.86 4.37 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 1.00 0.00 0.00 1.07 0.00 0.00 126 Q 7.99 4.13 0.00 1.99 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.75 0.00 0.00 0.00 0.00 0.00 2.34 2.43 0.00 127 G 8.97 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 0.00 128 C 7.96 4.42 0.00 3.07 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 0.00 129 G 8.09 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 0.00 0.00 0.00 130 V 7.88 4.01 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 0.80 0.00 0.00 0.96 0.00 0.00