NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1633 8.1727 122.0502 56.2886 34.1223 174.0964 2 V 4.5538 8.1615 127.0134 60.6225 32.3388 174.4554 3 F 4.3986 10.0088 128.8937 57.6393 40.1655 174.9022 4 E 4.2777 9.1622 121.0976 55.5083 31.1213 176.7144 5 R 3.3347 8.9884 120.3917 60.8725 29.9008 179.4329 6 C 4.3398 8.0094 115.3116 59.6625 39.0496 175.7741 7 E 3.8839 8.0902 120.7232 59.2488 29.3330 178.4889 8 L 3.5958 8.0195 120.1224 57.7903 41.9874 178.6032 9 A 3.9246 7.8490 120.7352 55.4469 18.2694 179.9255 10 R 3.8711 7.9706 116.4538 59.5238 29.9528 179.4719 11 T 3.8465 7.9116 115.6409 66.6577 68.5959 176.7475 12 L 3.8487 8.1995 121.3092 57.4622 41.6002 179.4223 13 K 3.9090 8.1975 119.7780 59.5982 31.9430 178.8746 14 R 3.9745 8.0343 117.8612 58.8975 29.9869 177.4251 15 L 4.4243 7.2738 116.8470 54.1177 41.6779 177.0241 16 G 3.8992 7.7771 106.7514 46.7054 0.0000 175.1273 17 M 3.9659 7.7695 121.0114 56.5854 32.3003 175.6887 18 D 4.6116 8.0491 117.8807 55.6432 41.1544 175.6617 19 G 3.9308 9.3991 115.4135 45.6884 0.0000 171.4017 20 Y 4.1999 8.3715 121.9890 58.6381 38.9773 176.4608 21 R 3.5809 8.9596 127.2215 57.2951 27.7796 177.2979 22 G 3.8186 8.0930 103.4256 45.6804 0.0000 174.0109 23 I 4.0485 7.6254 122.2710 59.2611 37.9648 175.9155 24 S 4.6223 8.3530 120.3577 57.7980 63.7852 175.0253 25 L 4.2646 8.6148 123.2245 58.4582 41.7280 179.3317 26 A 4.1405 8.1332 120.3218 55.1528 18.3458 179.2612 27 N 4.4574 8.1082 114.8470 56.3664 38.5709 177.7252 28 W 4.2757 8.0458 119.9014 59.9166 29.1064 178.3826 29 M 4.1327 8.5261 119.0250 58.5754 31.4629 177.9429 30 C 3.0927 8.0690 118.6085 59.0246 43.8886 175.3952 31 L 3.9867 8.1200 121.6780 58.2950 41.7895 178.8758 32 A 4.1898 8.4231 120.9192 54.8437 18.2540 179.4685 33 K 2.8251 8.1898 118.3364 59.3961 32.0623 179.1617 34 W 4.3514 7.7751 117.2639 59.1658 29.0602 178.3935 35 E 4.3549 8.4125 118.8809 58.7218 29.1886 177.8207 36 S 4.5142 7.6320 107.7872 56.8077 64.9012 174.0046 37 G 3.4030 8.2516 108.8704 46.9590 0.0000 173.2821 38 Y 3.6256 7.6807 113.6667 58.8162 34.7171 168.6428 39 N 5.3089 7.9025 119.0234 51.9765 40.1821 175.4605 40 T 4.1608 8.9024 117.2385 63.9965 69.2281 176.2454 41 R 4.3216 8.0732 119.4444 56.4235 30.9212 176.5084 42 A 4.3024 7.8685 121.0618 52.8561 19.3162 176.5799 43 T 5.0618 8.2843 110.4183 60.1717 72.4399 172.8906 44 N 4.9057 8.8335 122.0017 52.1639 41.9178 172.4816 45 Y 4.6459 8.7325 127.8182 57.3730 40.8345 173.8704 46 N 4.5950 8.4375 124.3718 50.9457 38.9188 175.1216 47 A 3.6740 8.2123 127.2845 54.6117 18.9902 179.3703 48 G 3.7126 8.0493 104.4797 48.1267 0.0000 174.0158 49 D 4.7661 7.4900 115.3243 52.0042 40.0501 175.4854 50 R 3.9735 8.1606 116.1527 57.1960 28.1211 175.7767 51 S 4.9898 7.7575 111.0433 56.9719 66.8807 172.4389 52 T 5.1300 8.9539 115.6328 62.0438 72.9940 172.9738 53 D 5.4191 9.1517 125.6659 53.4902 42.9249 175.0210 54 Y 4.8917 9.1893 121.3291 57.3880 41.2804 177.5359 55 G 4.2864 8.9259 111.9339 45.2125 0.0000 173.5904 56 I 3.7325 8.2298 116.9564 62.8584 37.9699 177.5547 57 F 4.8014 7.9494 115.7259 56.4686 39.9629 175.1325 58 Q 3.5931 7.9476 119.3606 57.0710 26.6786 174.2550 59 I 4.3586 8.1058 118.8122 61.1394 39.2018 177.0310 60 N 5.3623 9.2081 125.9842 53.5565 39.7268 175.8142 61 S 4.5795 9.0451 120.4603 61.0140 63.4796 175.5091 62 R 3.7090 8.6972 121.9173 58.6081 30.2685 177.8931 63 Y 4.3635 7.6909 114.0890 57.5639 40.7582 176.7334 64 W 4.9262 8.1786 118.7518 57.5971 31.2522 174.0300 65 C 5.6323 8.1729 111.5227 53.7277 43.4598 172.8749 66 N 5.0522 8.9129 118.9967 52.0460 40.3102 174.7669 67 D 4.7323 8.5691 123.1795 52.1120 40.5536 178.2387 68 G 4.0532 8.4135 108.1726 46.3090 0.0000 174.8287 69 K 4.3990 8.0516 116.6581 56.6887 32.9634 175.8847 70 T 4.5894 7.7371 116.9255 61.4145 69.0584 172.8410 71 P 4.2306 0.0000 0.0000 64.0438 31.8642 176.5989 72 G 4.5598 8.5877 109.2250 46.3528 0.0000 172.8315 73 A 4.6004 7.1531 118.9904 50.6145 20.6006 177.4813 74 R 4.4967 8.5450 118.2443 54.0504 33.8701 176.1179 75 N 4.9579 7.9740 115.8731 51.9629 37.7015 174.5293 76 A 3.9554 8.9182 124.8197 54.7712 19.1313 178.4812 77 C 4.5316 8.4973 111.4738 57.3596 41.2342 173.0678 78 H 4.0833 7.8355 116.4961 56.4560 26.2841 174.1042 79 L 4.7914 8.2688 117.9831 52.9016 46.5997 176.6870 80 S 4.5959 8.3845 115.5461 58.0733 63.2891 176.0206 81 C 4.0890 8.8751 124.3257 59.6367 40.6044 176.3863 82 S 3.9442 7.9910 115.0121 61.3079 61.6687 175.9644 83 A 4.0576 7.7856 122.3607 54.4240 18.1798 177.9316 84 L 4.4612 7.7613 116.4560 55.0585 41.7620 177.5905 85 L 5.5428 7.8318 116.6986 53.6703 42.4451 176.6888 86 Q 4.3943 7.8844 117.5649 55.2697 29.6646 175.9607 87 D 4.4096 8.5682 120.2285 57.2214 41.1251 176.8255 88 N 4.5598 8.0354 118.2081 53.2961 39.2207 174.5591 89 I 4.2391 8.4500 118.9640 61.0027 37.9213 177.0511 90 A 3.9323 8.3694 124.8199 56.0051 18.1749 180.1857 91 D 4.2641 8.0747 116.4724 57.4457 40.8781 178.7412 92 A 4.0875 7.9558 120.8644 55.1541 18.4310 179.7192 93 V 3.4119 8.2809 117.0473 65.9710 31.6844 178.1257 94 A 3.8415 8.1670 120.7997 55.2212 18.1349 178.8581 95 C 4.2415 8.4352 116.8659 59.6836 39.6522 175.5860 96 A 3.9484 8.2458 122.7410 55.0974 17.5989 179.8084 97 K 3.7945 7.6646 116.2980 59.3583 32.4127 179.2042 98 R 4.0780 7.6893 118.5918 59.3250 30.0155 178.5690 99 V 2.5292 7.5253 118.0157 65.8522 31.1308 178.0580 100 V 3.8815 7.7300 110.0388 62.7918 31.2742 177.9107 101 R 4.2813 7.6783 117.1233 56.9430 30.5529 176.4062 102 D 4.7354 7.5320 119.7309 52.5771 41.9256 175.3082 103 P 4.2334 0.0000 0.0000 66.3769 31.1874 177.9040 104 Q 3.9942 8.2105 117.4355 56.3144 29.9351 177.3899 105 G 3.6954 8.0158 107.4174 46.7565 0.0000 175.7921 106 I 3.4881 7.8122 119.7178 63.5524 37.8692 177.8781 107 R 4.1911 7.3517 117.3739 57.6642 29.9909 177.4337 108 A 4.0247 7.7490 121.3097 54.2649 18.7245 177.7392 109 W 4.6671 8.0461 117.2009 55.5241 29.7205 177.6545 110 V 3.7730 8.6509 123.6956 65.8074 30.8810 177.6779 111 A 4.0730 8.2605 120.4215 54.5719 18.1700 179.2345 112 W 3.9766 8.3840 126.8514 60.6828 30.6115 178.3256 113 R 3.8310 8.2976 116.1792 59.5504 29.6630 178.3939 114 N 4.4050 8.0685 114.7613 55.3344 38.6661 176.7409 115 R 4.2001 7.8288 115.7667 55.7851 31.6357 175.5568 116 C 4.5264 7.1486 114.6178 57.9145 43.0172 174.2966 117 Q 3.1542 6.6493 119.8098 57.3019 28.6503 175.6488 118 N 4.1987 8.6288 120.8120 54.3559 36.2504 173.9209 119 R 4.5323 7.3270 114.5331 53.9956 33.2618 175.7257 120 D 4.5199 8.5064 119.3518 54.3852 40.5186 175.8821 121 V 4.5744 8.1838 118.9985 61.1681 32.4807 178.3133 122 R 4.0315 8.0769 122.8513 59.2804 30.0657 178.9601 123 Q 4.0078 8.1220 115.4330 59.1717 28.4502 178.4102 124 Y 4.0713 7.7645 115.6694 60.1162 38.1977 176.8286 125 V 4.3759 7.9321 110.9792 60.7779 32.6929 175.4647 126 Q 4.1917 7.5295 120.4239 57.1347 28.7792 176.9848 127 G 3.9641 8.9282 110.4875 45.9293 0.0000 174.5031 128 C 4.4356 7.9676 115.5885 56.7655 40.5841 173.8364 129 G 3.8456 8.1293 107.2822 46.8855 0.0000 174.1925 130 V 4.0170 7.8692 117.9875 61.1022 32.1921 175.8511 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 4.16 0.00 1.96 1.68 0.00 1.27 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 0.87 1.11 7.81 2 V 8.16 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 0.91 0.00 0.00 0.95 0.00 0.00 3 F 10.01 4.40 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 9.16 4.28 0.00 1.95 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 2.31 2.24 0.00 5 R 8.99 3.33 0.00 1.95 1.91 0.00 3.44 0.00 0.00 3.47 7.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.82 0.00 6 C 8.01 4.34 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 8.09 3.88 0.00 2.06 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 0.00 2.60 2.42 0.00 8 L 8.02 3.60 0.00 1.39 1.35 -0.18 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.85 3.92 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 7.97 3.87 0.00 1.89 1.99 0.00 3.14 0.00 0.00 3.27 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.80 0.00 11 T 7.91 3.85 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 1.22 0.00 0.00 12 L 8.20 3.85 0.00 1.71 1.56 0.90 0.37 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 13 K 8.20 3.91 0.00 1.91 1.92 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.44 1.47 7.81 14 R 8.03 3.97 0.00 2.05 1.93 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 1.64 1.67 0.00 15 L 7.27 4.42 0.00 1.62 1.55 0.87 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.78 3.90 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 0.00 0.00 0.00 17 M 7.77 3.97 0.00 1.39 1.99 0.00 0.00 0.00 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.23 0.00 18 D 8.05 4.61 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 9.40 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 8.37 4.20 0.00 3.35 3.22 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 21 R 8.96 3.58 0.00 1.88 1.84 0.00 3.37 0.00 0.00 3.01 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 1.40 0.00 22 G 8.09 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 23 I 7.63 4.05 1.76 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.57 -0.25 0.00 0.00 24 S 8.35 4.62 0.00 4.06 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 0.00 25 L 8.61 4.26 0.00 2.03 1.81 0.97 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.13 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 8.11 4.46 0.00 2.83 2.80 0.00 0.00 6.95 6.97 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 28 W 8.05 4.28 0.00 3.53 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 8.53 4.13 0.00 2.13 2.35 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.92 0.00 30 C 8.07 3.09 0.00 2.66 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 31 L 8.12 3.99 0.00 1.89 1.84 0.65 -0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.42 4.19 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 0.00 0.00 0.00 0.00 0.00 0.00 33 K 8.19 2.83 0.00 1.66 1.59 0.00 0.61 0.00 0.00 0.77 0.00 0.00 2.75 0.00 0.00 2.39 0.00 0.00 0.00 0.00 1.14 0.34 7.81 34 W 7.78 4.35 0.00 3.35 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 35 E 8.41 4.35 0.00 2.04 2.11 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 2.59 2.45 0.00 36 S 7.63 4.51 0.00 4.05 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.25 3.40 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 0.00 38 Y 7.68 3.63 0.00 3.27 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 39 N 7.90 5.31 0.00 2.85 2.82 0.00 0.00 7.02 6.72 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 40 T 8.90 4.16 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 1.45 0.00 0.00 41 R 8.07 4.32 0.00 2.02 2.04 0.00 3.19 0.00 0.00 3.24 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.58 0.00 42 A 7.87 4.30 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 0.00 0.00 43 T 8.28 5.06 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 1.14 0.00 0.00 44 N 8.83 4.91 0.00 2.90 2.74 0.00 0.00 6.79 7.07 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 45 Y 8.73 4.65 0.00 3.01 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 46 N 8.44 4.60 0.00 2.61 2.58 0.00 0.00 6.69 7.59 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 47 A 8.21 3.67 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 G 8.05 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 49 D 7.49 4.77 0.00 2.71 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 50 R 8.16 3.97 0.00 2.04 2.18 0.00 3.11 0.00 0.00 3.19 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.53 0.00 51 S 7.76 4.99 0.00 3.95 3.90 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 52 T 8.95 5.13 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 0.67 0.00 0.00 53 D 9.15 5.42 0.00 2.70 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 54 Y 9.19 4.89 0.00 2.95 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 55 G 8.93 4.29 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 0.00 56 I 8.23 3.73 1.66 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 1.28 -0.01 0.00 0.00 57 F 7.95 4.80 0.00 3.22 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 58 Q 7.95 3.59 0.00 2.55 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 6.84 0.00 0.00 0.00 0.00 0.00 2.54 2.73 0.00 59 I 8.11 4.36 2.15 0.00 0.00 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 1.35 1.11 1.14 0.00 0.00 60 N 9.21 5.36 0.00 3.13 3.14 0.00 0.00 6.98 7.31 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 61 S 9.05 4.58 0.00 4.08 4.40 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 62 R 8.70 3.71 0.00 1.49 1.03 0.00 2.68 0.00 0.00 2.91 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.02 0.00 63 Y 7.69 4.36 0.00 1.45 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 0.00 0.00 0.00 0.00 64 W 8.18 4.93 0.00 3.54 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 65 C 8.17 5.63 0.00 3.08 3.07 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 66 N 8.91 5.05 0.00 2.85 2.69 0.00 0.00 7.06 8.04 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 67 D 8.57 4.73 0.00 2.89 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 68 G 8.41 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 0.00 0.00 0.00 69 K 8.05 4.40 0.00 1.91 1.92 0.00 1.61 0.00 0.00 1.73 0.00 0.00 3.07 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.57 1.46 7.81 70 T 7.74 4.59 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 1.20 0.00 0.00 71 P 0.00 4.23 0.00 2.15 1.97 0.00 3.74 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.10 0.00 72 G 8.59 4.56 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 0.00 0.00 0.00 73 A 7.15 4.60 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 74 R 8.54 4.50 0.00 1.46 1.71 0.00 3.02 0.00 0.00 3.08 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.45 0.00 75 N 7.97 4.96 0.00 2.75 2.59 0.00 0.00 6.76 8.28 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 76 A 8.92 3.96 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 77 C 8.50 4.53 0.00 3.28 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 7.84 4.08 0.00 3.31 3.34 0.00 5.81 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.27 4.79 0.00 1.69 1.50 0.99 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.38 4.60 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 8.88 4.09 0.00 2.24 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 S 7.99 3.94 0.00 3.87 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 7.79 4.06 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 84 L 7.76 4.46 0.00 1.95 1.82 1.06 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.83 5.54 0.00 1.75 1.70 1.13 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.88 4.39 0.00 2.23 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.41 7.08 0.00 0.00 0.00 0.00 0.00 2.36 2.50 0.00 87 D 8.57 4.41 0.00 2.63 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 88 N 8.04 4.56 0.00 2.69 2.75 0.00 0.00 6.95 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 1.73 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.98 0.93 0.00 0.00 90 A 8.37 3.93 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 91 D 8.07 4.26 0.00 2.75 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 4.09 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 93 V 8.28 3.41 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 0.72 0.00 0.00 0.90 0.00 0.00 94 A 8.17 3.84 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 0.00 0.00 95 C 8.44 4.24 0.00 3.14 3.31 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 0.00 96 A 8.25 3.95 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.66 3.79 0.00 1.57 1.26 0.00 1.27 0.00 0.00 0.81 0.00 0.00 2.36 0.00 0.00 2.54 0.00 0.00 0.00 0.00 0.30 0.87 7.81 98 R 7.69 4.08 0.00 2.00 2.16 0.00 3.29 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.97 0.00 99 V 7.53 2.53 1.79 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 -0.29 0.00 0.00 -0.48 0.00 0.00 100 V 7.73 3.88 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 1.45 0.00 0.00 101 R 7.68 4.28 0.00 2.08 2.05 0.00 3.25 0.00 0.00 3.41 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 2.15 0.00 102 D 7.53 4.74 0.00 3.03 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 0.00 103 P 0.00 4.23 0.00 2.15 2.21 0.00 3.79 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.02 0.00 104 Q 8.21 3.99 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.97 0.00 0.00 0.00 0.00 0.00 2.42 2.32 0.00 105 G 8.02 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 0.00 0.00 0.00 106 I 7.81 3.49 0.98 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.29 -0.67 0.00 0.00 107 R 7.35 4.19 0.00 2.06 2.00 0.00 3.20 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.52 0.00 108 A 7.75 4.02 0.74 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 0.00 0.00 109 W 8.05 4.67 0.00 3.48 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 0.00 110 V 8.65 3.77 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 8.26 4.07 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 0.00 112 W 8.38 3.98 0.00 3.49 3.48 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 0.00 0.00 0.00 0.00 113 R 8.30 3.83 0.00 2.06 2.02 0.00 3.34 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.15 0.00 114 N 8.07 4.41 0.00 2.54 2.73 0.00 0.00 6.92 6.96 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 0.00 115 R 7.83 4.20 0.00 1.00 0.72 0.00 2.21 0.00 0.00 2.25 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 1.30 0.00 116 C 7.15 4.53 0.00 1.65 2.59 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 0.00 117 Q 6.65 3.15 0.00 0.93 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.79 0.00 0.00 0.00 0.00 0.00 2.20 2.21 0.00 118 N 8.63 4.20 0.00 2.79 2.81 0.00 0.00 6.86 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 7.33 4.53 0.00 1.83 1.77 0.00 3.24 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 1.43 1.58 0.00 120 D 8.51 4.52 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 8.18 4.57 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 1.05 0.00 0.00 122 R 8.08 4.03 0.00 1.86 2.01 0.00 3.16 0.00 0.00 3.24 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.71 0.00 123 Q 8.12 4.01 0.00 2.05 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 6.91 0.00 0.00 0.00 0.00 0.00 2.15 1.63 0.00 124 Y 7.76 4.07 0.00 3.26 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 0.00 125 V 7.93 4.38 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 1.01 0.00 0.00 1.06 0.00 0.00 126 Q 7.53 4.19 0.00 2.15 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.65 0.00 0.00 0.00 0.00 0.00 2.50 2.45 0.00 127 G 8.93 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 0.00 0.00 0.00 128 C 7.97 4.44 0.00 3.06 3.14 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 0.00 129 G 8.13 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 0.00 130 V 7.87 4.02 2.11 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 0.75 0.00 0.00 0.96 0.00 0.00