NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 N 4.7235 8.4093 119.2181 53.0718 40.0170 173.9666 4 Q 4.3087 8.6576 124.2518 56.3360 29.4714 174.3177 5 Y 4.7102 9.2009 118.8702 57.8218 40.2855 175.0491 6 Y 5.6061 8.0693 122.0095 54.8485 42.1365 174.7381 7 G 4.2396 7.3552 110.9508 43.6063 0.0000 171.5338 8 T 4.3617 8.0303 120.0964 61.8870 69.3306 174.5632 9 G 4.0041 8.6742 115.2056 45.6701 0.0000 171.7033 10 R 5.6392 7.7153 121.8849 55.7732 32.4660 174.1943 11 R 4.2337 8.8589 122.3235 56.6983 33.0562 173.2718 12 K 3.8090 9.2177 128.1001 58.5737 29.9102 174.3186 13 S 3.7416 7.7933 109.7739 59.6904 61.7370 171.4910 14 S 5.7866 7.7790 112.8530 55.6984 66.5513 173.8463 15 A 5.2387 8.8157 124.1068 50.3674 22.4121 175.8672 16 A 5.3615 8.4562 121.5635 50.7864 22.5844 176.0133 17 R 4.8401 8.8101 122.6536 56.2409 31.6968 176.2803 18 V 4.7944 8.2970 124.4614 61.2915 33.5525 174.0978 19 F 6.1830 9.5199 127.7108 55.0726 41.7562 174.8714 20 I 5.0493 8.4934 122.3928 59.4222 41.4461 173.8568 21 K 4.9412 10.4132 128.1737 53.7826 37.1719 173.9837 22 P 4.7593 0.0000 0.0000 63.3096 32.1678 176.1083 23 G 4.1090 7.4081 114.1939 45.8325 0.0000 172.7403 24 N 4.3932 8.3342 122.2284 52.9062 38.5021 176.4259 25 G 4.4486 8.5577 116.3608 44.6690 0.0000 172.4749 26 K 4.8963 7.3662 116.5075 54.7173 35.8889 177.7921 27 I 3.8672 8.2726 123.4462 61.5383 38.5044 175.3862 28 V 4.9528 8.8065 126.6772 60.8035 31.8719 172.1854 29 I 4.9649 8.8165 122.9534 58.2767 38.9459 174.5490 30 N 4.1837 9.0057 129.5522 55.0473 35.2830 174.3703 31 Q 3.2925 7.7048 110.2422 56.7011 28.7732 174.3411 32 R 4.3884 7.1931 117.1344 54.5823 32.1413 176.3579 33 S 5.6158 7.9947 114.7690 56.3590 64.1228 174.0499 34 L 3.9760 8.2498 120.8095 58.7027 41.6847 177.9588 35 E 4.4365 7.9447 116.3655 56.5673 30.2373 177.3560 36 Q 4.1941 7.4787 117.8947 59.2795 28.8078 177.8579 37 Y 4.8762 7.9889 109.1508 57.2526 41.9850 174.8436 38 F 5.1364 7.5976 117.7306 57.1905 39.9204 176.4989 39 G 3.6350 7.8441 110.5028 45.5592 0.0000 169.3161 40 R 3.9359 8.4869 128.7401 55.8096 28.3150 176.2137 41 E 4.3576 8.7438 121.5299 56.8426 29.7209 177.7882 42 T 4.2956 8.8018 123.9198 63.7857 69.7533 173.2795 43 A 4.2863 7.0342 123.3286 52.4257 21.7146 175.6331 44 R 4.4282 7.6122 118.0453 57.2065 34.2885 176.1669 45 M 4.1568 7.8620 117.3303 58.2087 32.2426 178.4536 46 V 3.5811 7.8887 111.4908 64.2623 31.6868 177.4799 47 V 3.9556 7.4732 110.7455 62.3366 32.2259 177.5939 48 R 4.1630 7.7200 118.1263 58.7285 30.6852 177.5810 49 Q 4.1239 10.0185 116.8567 59.0428 28.6379 177.3703 50 P 3.5802 0.0000 0.0000 65.3150 31.7983 176.4378 51 L 4.4763 7.6624 115.3770 54.8732 41.8437 178.1974 52 E 4.2091 8.2586 115.8215 57.5692 28.7507 177.1676 53 L 4.5262 7.5769 119.3080 55.2646 42.4590 177.6509 54 V 4.1237 8.7145 107.7493 62.1590 35.0483 170.3278 55 D 4.1927 8.2547 124.2202 54.4803 41.0812 172.0923 56 M 4.7563 7.6148 124.1154 54.8496 32.8289 175.9130 57 V 4.0212 8.5629 113.7792 63.0963 30.1447 173.7892 58 E 4.9557 8.0610 123.4926 56.8687 31.0231 177.2150 59 K 3.9507 7.7002 121.9333 58.1740 32.4937 175.8213 60 L 4.9993 7.3773 116.4802 53.8847 44.4059 175.9180 61 D 5.5816 9.2037 120.6463 53.3798 40.7591 176.6505 62 L 4.6721 8.3193 115.1272 53.8280 43.7418 172.9953 63 Y 4.6770 8.9206 122.7532 56.1199 39.8237 173.5563 64 I 5.2536 8.6495 127.4899 59.7308 40.9629 175.0218 65 T 5.3886 9.3506 122.2937 62.0499 72.5867 173.3988 66 V 5.5831 8.4135 122.8269 61.0969 34.8181 173.5651 67 K 4.5495 8.6120 123.9444 55.9112 36.1719 171.1878 68 G 4.2712 8.9989 123.1155 45.0771 0.0000 170.7048 69 G 4.2752 7.5545 111.1784 45.1615 0.0000 173.9538 70 G 3.6700 9.1498 110.3712 46.7339 0.0000 177.1017 71 I 2.3675 7.4352 117.1189 61.8540 42.0789 176.6243 72 S 3.7565 7.7015 120.3759 60.2915 63.2297 176.9269 73 G 3.4695 8.9846 109.7856 47.9464 0.0000 175.4561 74 Q 3.9290 7.9856 120.5288 58.5911 28.5091 178.7180 75 A 4.0685 8.4689 122.3749 55.3568 18.2503 179.8415 76 G 3.7654 7.8017 103.0556 47.8908 0.0000 175.6588 77 A 4.0537 7.9343 123.5929 54.8104 18.4226 179.3369 78 I 3.8724 8.5832 119.5034 65.0917 37.2307 177.8573 79 R 3.6525 8.8823 119.7071 60.0863 29.7204 177.4135 80 H 4.1046 9.2207 118.5085 59.4779 29.5937 177.3844 81 G 3.4576 8.6023 107.0935 47.8608 0.0000 175.0748 82 I 3.8037 7.9794 123.5182 64.5096 37.1950 178.3931 83 T 3.7951 7.7648 113.3740 65.1417 67.2563 176.1105 84 R 4.0133 8.4936 119.3744 57.7546 29.7564 177.4574 85 A 5.4033 7.6866 120.0895 50.3817 20.1259 175.6354 86 L 4.8358 7.9404 120.0769 55.2035 42.5512 176.5981 87 M 4.8791 7.9897 111.1706 54.6166 33.2264 175.9714 88 E 4.1562 8.5198 120.2080 59.8935 30.2737 177.8571 89 Y 4.3102 8.6618 118.0308 60.2190 38.7788 176.1292 90 D 4.8505 7.9850 116.4128 52.6546 44.0707 173.9412 91 E 4.5075 9.0087 126.3150 56.3244 29.5045 176.0827 92 S 4.8336 9.1847 112.3238 58.2649 63.1632 174.5734 93 L 4.6286 7.8274 120.0176 55.9600 43.4269 178.9279 94 R 3.7688 8.0214 118.4440 59.3417 29.5100 178.1565 95 S 4.0879 8.1656 112.1384 61.7957 62.0736 175.5643 96 E 4.3123 7.5192 116.8031 57.3451 29.3569 177.2038 97 L 4.6885 8.4385 119.9529 55.4850 44.4445 179.1043 98 R 3.8982 8.1749 116.9548 59.0346 30.0645 178.4461 99 K 3.9405 7.4665 116.3509 60.1629 32.3991 178.6580 100 A 3.8160 7.5581 120.4328 52.2173 18.9268 177.1519 101 G 3.5564 7.8697 104.3002 46.8776 0.0000 174.0591 102 F 5.1033 7.8075 117.9591 59.1166 41.0844 179.1160 103 V 4.1969 7.8806 110.3347 61.8461 30.8162 175.5876 104 T 4.4771 8.0782 117.1830 61.5611 70.7453 173.9771 105 R 3.9364 8.5405 127.3546 55.2367 29.5911 176.2158 106 D 4.5454 8.3719 126.0848 53.2520 37.5774 176.5761 107 A 4.3094 8.0681 132.7137 53.0374 18.4937 179.2561 108 R 4.2420 7.6710 118.7781 56.9268 28.5090 176.2014 109 Q 4.2513 7.5224 120.9129 55.0670 30.5056 175.6370 110 V 3.8519 7.9852 114.4774 61.0964 32.2834 175.2827 111 E 4.4816 8.3494 122.6398 54.1302 30.7969 176.0154 112 R 3.9443 8.4769 123.0049 55.8441 29.9731 176.2161 113 K 4.2030 8.5874 122.9175 56.7409 32.9298 175.6252 114 K 4.6487 8.1756 121.0501 53.9003 35.6746 176.3837 115 V 3.7619 8.3311 122.7528 63.3966 31.4447 176.3907 116 G 4.0293 9.1785 113.2088 44.7300 0.0000 172.8540 117 L 4.7971 7.8414 119.9929 52.6136 44.0188 177.9823 118 R 4.0721 8.3878 121.6082 58.6738 30.1486 177.1893 119 K 4.2417 7.5417 110.9579 56.8652 34.0412 173.9348 120 A 4.3527 9.0806 134.1462 53.5555 17.7828 178.8669 121 R 4.4607 7.6299 108.5114 57.3044 35.7224 174.3159 122 R 3.8540 8.0287 118.5155 56.5795 29.4205 174.9338 123 R 4.3864 8.1670 125.2788 54.8210 31.0782 174.5223 124 P 4.5262 0.0000 0.0000 62.0919 32.2279 177.4250 125 Q 4.5046 8.3359 119.6786 57.2170 29.6231 176.2820 126 F 4.7919 8.1985 109.5096 55.9047 38.1854 174.2400 127 S 3.8851 7.6820 117.3315 59.9441 63.5253 174.5280 128 K 3.8250 8.9053 118.3598 56.3901 31.5315 176.1706 129 R 4.0429 7.3246 121.0413 57.0147 30.3321 175.7598 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 N 8.41 4.72 0.00 2.71 2.83 0.00 0.00 7.03 6.19 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 4 Q 8.66 4.31 0.00 2.42 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 6.81 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 5 Y 9.20 4.71 0.00 2.97 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 6 Y 8.07 5.61 0.00 2.84 2.80 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 7 G 7.36 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 8 T 8.03 4.36 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 1.23 0.00 0.00 9 G 8.67 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 0.00 0.00 0.00 10 R 7.72 5.64 0.00 1.82 1.76 0.00 3.16 0.00 0.00 3.83 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.83 0.00 11 R 8.86 4.23 0.00 1.85 1.79 0.00 3.41 0.00 0.00 3.70 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.59 0.00 12 K 9.22 3.81 0.00 1.89 1.77 0.00 1.96 0.00 0.00 1.62 0.00 0.00 2.80 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.32 1.40 7.81 13 S 7.79 3.74 0.00 3.99 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 14 S 7.78 5.79 0.00 4.10 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 15 A 8.82 5.24 1.31 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 0.00 0.00 16 A 8.46 5.36 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 17 R 8.81 4.84 0.00 2.00 2.00 0.00 3.31 0.00 0.00 3.31 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.74 0.00 18 V 8.30 4.79 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 1.01 0.00 0.00 0.89 0.00 0.00 19 F 9.52 6.18 0.00 2.68 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 20 I 8.49 5.05 1.93 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.44 0.82 0.00 0.00 21 K 10.41 4.94 0.00 1.61 1.65 0.00 1.77 0.00 0.00 1.73 0.00 0.00 3.10 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.46 7.81 22 P 0.00 4.76 0.00 2.19 2.09 0.00 3.86 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.02 0.00 23 G 7.41 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 24 N 8.33 4.39 0.00 2.89 2.99 0.00 0.00 5.82 6.95 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 25 G 8.56 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 0.00 0.00 0.00 0.00 26 K 7.37 4.90 0.00 1.74 1.78 0.00 1.58 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.30 1.43 7.81 27 I 8.27 3.87 1.97 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 1.26 0.85 1.05 0.00 0.00 28 V 8.81 4.95 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.86 0.00 0.00 29 I 8.82 4.96 2.02 0.00 0.00 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 1.49 1.84 1.16 0.00 0.00 30 N 9.01 4.18 0.00 2.85 2.77 0.00 0.00 7.24 7.69 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 31 Q 7.70 3.29 0.00 2.20 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.58 6.80 0.00 0.00 0.00 0.00 0.00 2.12 2.21 0.00 32 R 7.19 4.39 0.00 1.76 1.48 0.00 2.99 0.00 0.00 2.85 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.57 0.00 33 S 7.99 5.62 0.00 4.00 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 34 L 8.25 3.98 0.00 1.77 1.71 0.97 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 35 E 7.94 4.44 0.00 2.03 2.01 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 2.31 2.35 0.00 36 Q 7.48 4.19 0.00 2.36 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.66 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 37 Y 7.99 4.88 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 38 F 7.60 5.14 0.00 2.81 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 39 G 7.84 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 40 R 8.49 3.94 0.00 2.02 2.11 0.00 3.16 0.00 0.00 3.24 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.64 0.00 41 E 8.74 4.36 0.00 1.89 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 2.21 2.29 0.00 42 T 8.80 4.30 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 1.20 0.00 0.00 43 A 7.03 4.29 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 0.00 0.00 44 R 7.61 4.43 0.00 1.77 1.82 0.00 3.27 0.00 0.00 3.50 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.66 0.00 45 M 7.86 4.16 0.00 2.31 2.10 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.63 0.00 46 V 7.89 3.58 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 0.65 0.00 0.00 0.82 0.00 0.00 47 V 7.47 3.96 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 0.62 0.00 0.00 0.98 0.00 0.00 48 R 7.72 4.16 0.00 1.85 1.96 0.00 3.38 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.58 0.00 49 Q 10.02 4.12 0.00 2.05 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.13 6.54 0.00 0.00 0.00 0.00 0.00 2.44 2.45 0.00 50 P 0.00 3.58 0.00 1.92 1.86 0.00 3.57 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.86 0.00 51 L 7.66 4.48 0.00 1.71 1.64 0.87 0.87 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 52 E 8.26 4.21 0.00 2.02 2.01 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 2.57 2.42 0.00 53 L 7.58 4.53 0.00 1.64 1.67 0.93 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 54 V 8.71 4.12 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 0.56 0.00 0.00 0.92 0.00 0.00 55 D 8.25 4.19 0.00 2.76 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 56 M 7.61 4.76 0.00 2.17 1.99 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 2.48 2.60 0.00 57 V 8.56 4.02 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 0.65 0.00 0.00 0.93 0.00 0.00 58 E 8.06 4.96 0.00 2.08 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.08 0.00 59 K 7.70 3.95 0.00 1.77 1.83 0.00 1.55 0.00 0.00 1.79 0.00 0.00 3.29 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.38 7.81 60 L 7.38 5.00 0.00 1.87 1.63 0.89 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 61 D 9.20 5.58 0.00 2.64 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 L 8.32 4.67 0.00 1.77 1.62 0.94 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 63 Y 8.92 4.68 0.00 3.29 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 I 8.65 5.25 1.97 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.67 1.03 0.00 0.00 65 T 9.35 5.39 4.61 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 1.44 0.00 0.00 66 V 8.41 5.58 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 1.12 0.00 0.00 67 K 8.61 4.55 0.00 1.91 1.67 0.00 1.76 0.00 0.00 1.88 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.55 7.81 68 G 9.00 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 0.00 0.00 0.00 0.00 69 G 7.55 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 0.00 0.00 0.00 0.00 70 G 9.15 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 0.00 0.00 0.00 71 I 7.44 2.37 1.70 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.60 0.99 0.00 0.00 72 S 7.70 3.76 0.00 3.82 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 73 G 8.98 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 Q 7.99 3.93 0.00 2.15 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.71 0.00 0.00 0.00 0.00 0.00 2.50 2.50 0.00 75 A 8.47 4.07 1.04 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 0.00 0.00 76 G 7.80 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 77 A 7.93 4.05 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 78 I 8.58 3.87 1.96 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 1.47 0.69 0.93 0.00 0.00 79 R 8.88 3.65 0.00 1.74 2.02 0.00 2.63 0.00 0.00 2.95 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.45 0.00 80 H 9.22 4.10 0.00 3.26 3.50 0.00 5.84 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 81 G 8.60 3.46 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 0.00 82 I 7.98 3.80 1.86 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.81 0.86 0.00 0.00 83 T 7.76 3.80 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 1.27 0.00 0.00 84 R 8.49 4.01 0.00 1.77 1.73 0.00 3.12 0.00 0.00 3.05 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.42 0.00 85 A 7.69 5.40 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 L 7.94 4.84 0.00 1.68 1.60 0.86 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 87 M 7.99 4.88 0.00 2.08 2.10 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.64 0.00 88 E 8.52 4.16 0.00 2.29 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 2.40 2.38 0.00 89 Y 8.66 4.31 0.00 3.12 3.05 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 90 D 7.98 4.85 0.00 2.83 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.01 4.51 0.00 1.97 1.94 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 2.28 2.37 0.00 92 S 9.18 4.83 0.00 3.93 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 93 L 7.83 4.63 0.00 1.83 1.73 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 94 R 8.02 3.77 0.00 1.83 1.98 0.00 3.33 0.00 0.00 3.28 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.65 0.00 95 S 8.17 4.09 0.00 3.88 3.89 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 96 E 7.52 4.31 0.00 1.86 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 2.35 2.50 0.00 97 L 8.44 4.69 0.00 1.82 1.75 1.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 98 R 8.17 3.90 0.00 1.75 1.97 0.00 3.22 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.84 0.00 99 K 7.47 3.94 0.00 1.88 1.91 0.00 1.57 0.00 0.00 1.68 0.00 0.00 3.07 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.51 1.39 7.81 100 A 7.56 3.82 0.60 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 0.00 101 G 7.87 3.56 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 0.00 102 F 7.81 5.10 0.00 3.07 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 0.00 103 V 7.88 4.20 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 0.00 104 T 8.08 4.48 4.26 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 1.21 0.00 0.00 105 R 8.54 3.94 0.00 1.69 1.82 0.00 3.36 0.00 0.00 3.22 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.49 0.00 106 D 8.37 4.55 0.00 2.79 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 0.00 107 A 8.07 4.31 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 0.00 108 R 7.67 4.24 0.00 1.81 1.90 0.00 3.20 0.00 0.00 3.14 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.60 0.00 109 Q 7.52 4.25 0.00 2.01 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.45 7.05 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 110 V 7.99 3.85 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.93 0.00 0.00 111 E 8.35 4.48 0.00 1.89 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 0.00 2.22 2.33 0.00 112 R 8.48 3.94 0.00 2.03 2.06 0.00 3.04 0.00 0.00 3.26 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.62 0.00 113 K 8.59 4.20 0.00 1.73 1.77 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.14 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.48 7.81 114 K 8.18 4.65 0.00 1.79 1.61 0.00 1.97 0.00 0.00 1.86 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.41 1.59 7.81 115 V 8.33 3.76 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 0.69 0.00 0.00 0.93 0.00 0.00 116 G 9.18 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 0.00 0.00 0.00 117 L 7.84 4.80 0.00 1.77 1.54 0.95 0.72 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 0.00 118 R 8.39 4.07 0.00 1.79 2.00 0.00 3.21 0.00 0.00 3.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.58 0.00 119 K 7.54 4.24 0.00 1.98 1.77 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.22 1.25 7.81 120 A 9.08 4.35 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.63 4.46 0.00 1.75 1.90 0.00 3.39 0.00 0.00 3.14 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.55 0.00 122 R 8.03 3.85 0.00 1.88 1.88 0.00 3.22 0.00 0.00 3.27 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.70 0.00 123 R 8.17 4.39 0.00 1.78 1.80 0.00 3.29 0.00 0.00 3.20 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.69 0.00 124 P 0.00 4.53 0.00 2.11 1.98 0.00 3.74 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 125 Q 8.34 4.50 0.00 2.08 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 7.54 0.00 0.00 0.00 0.00 0.00 2.39 2.46 0.00 126 F 8.20 4.79 0.00 3.10 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 0.00 127 S 7.68 3.89 0.00 3.91 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 0.00 128 K 8.91 3.82 0.00 1.84 1.93 0.00 1.68 0.00 0.00 1.68 0.00 0.00 3.04 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.28 1.47 7.81 129 R 7.32 4.04 0.00 2.02 1.96 0.00 3.33 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.64 0.00