NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4854 8.2893 120.3231 55.6521 33.3020 174.9379 2 T 4.3875 8.1685 109.9849 61.1249 70.6039 172.8369 3 H 4.4051 8.3437 118.9300 56.3597 30.0497 175.5219 4 D 4.8291 8.4924 117.8595 53.8061 42.4828 174.2654 5 N 5.0649 7.8460 113.4542 52.7921 42.8919 174.5114 6 K 4.3898 8.3174 120.4661 54.1481 31.5530 172.7979 7 L 4.6178 7.9557 119.8024 52.8578 43.2817 176.3488 8 Q 4.5144 8.6798 121.7019 55.5773 29.2939 176.2860 9 V 4.1040 7.2220 117.7199 63.7363 33.6352 174.8055 10 E 4.4863 7.5768 114.8803 55.7047 30.6364 173.3056 11 A 4.7670 8.1568 131.4459 51.4774 21.7397 174.1888 12 I 4.4216 7.4107 113.9568 59.9035 41.1848 173.8853 13 K 4.2597 8.2272 121.1410 56.0467 34.8585 173.5791 14 R 4.2210 7.7177 120.0837 56.1256 28.3382 175.2626 15 G 4.2257 7.6201 108.0593 44.8914 0.0000 169.8080 16 T 4.6116 8.0851 117.3530 62.8048 70.1712 174.4181 17 V 4.7539 7.9298 123.3609 61.5436 34.8518 173.8831 18 I 4.5273 8.6872 129.1607 60.2837 38.9277 174.3246 19 D 4.7597 9.7534 126.7019 52.7624 44.1239 175.0674 20 H 4.2957 8.2333 118.4070 56.9191 25.5128 175.3223 21 I 4.2155 7.5783 119.9790 59.4583 38.7356 175.0209 22 P 4.0457 0.0000 0.0000 62.1504 31.9075 175.7222 23 A 4.3732 8.3814 123.5556 54.0573 18.6858 177.8775 24 Q 3.7584 8.9244 118.1787 56.9596 26.4982 174.8410 25 I 4.5509 7.6796 118.6367 61.3655 38.5087 178.1630 26 G 3.5698 8.9854 107.7051 47.9168 0.0000 175.7678 27 F 4.3970 8.2671 123.3929 60.4402 39.3924 176.7924 28 K 3.6743 8.0983 119.0590 59.5779 31.9908 178.6230 29 L 4.2197 7.7152 118.9258 57.6421 41.5231 179.4846 30 L 4.0037 7.5627 118.9318 57.9944 41.4408 179.4536 31 S 3.9285 7.7278 115.1574 61.1480 62.6475 176.3529 32 L 3.5371 7.8038 121.8910 57.3157 41.5184 178.5884 33 F 4.5593 7.8721 113.7966 56.0316 39.8913 175.7472 34 K 3.8687 7.9731 120.2870 57.6461 29.7164 175.9272 35 L 4.2614 7.9473 116.4288 56.4044 41.9404 178.5561 36 T 4.4255 7.6865 108.4976 61.5676 69.1565 175.3412 37 E 4.3413 7.8223 121.0726 57.2020 29.4342 176.8920 38 T 4.2591 7.2732 109.4409 61.4205 69.6866 173.7714 39 D 4.7504 8.2908 119.7616 54.6964 42.8946 176.6785 40 Q 4.2242 7.7703 116.9402 55.3885 29.6853 175.9541 41 R 4.2265 8.2627 119.1497 56.8840 31.5344 175.7635 42 I 5.0244 8.0502 121.1080 60.2425 41.5683 174.6766 43 T 4.5485 10.0012 123.5004 61.9267 71.4758 172.7868 44 I 4.9798 8.5604 126.3914 59.0993 41.3274 174.8186 45 G 4.2466 9.3814 113.5949 44.6471 0.0000 171.5594 46 L 5.1260 8.4768 123.8230 52.7665 45.5105 175.4411 47 N 4.1337 8.4027 115.2882 54.2906 36.9469 174.5164 48 L 4.6040 7.7319 116.6467 52.9989 42.8561 173.9031 49 P 4.4887 0.0000 0.0000 63.3283 32.2873 176.9610 50 S 4.8840 8.2658 117.7753 57.8792 63.8566 176.2374 51 G 3.7965 8.4775 103.5195 45.6883 0.0000 173.2014 52 E 3.8075 8.7123 112.4095 56.8617 27.0655 175.3248 53 M 4.5582 7.6861 114.1355 55.8648 35.9118 174.4760 54 G 4.1080 8.2754 107.9622 45.8576 0.0000 172.7977 55 R 5.1993 8.5976 122.5683 54.9649 34.5947 174.1718 56 K 4.7084 8.6775 119.3413 56.5356 36.7583 173.9435 57 D 5.4490 10.0859 120.3433 52.6741 44.3421 175.4989 58 L 4.9523 9.3677 122.6383 53.6578 46.0189 174.8814 59 I 4.7563 8.3425 125.1517 59.4696 40.2531 174.5234 60 K 4.7993 9.3295 127.7101 54.4621 34.8331 175.4727 61 I 4.7190 8.1519 119.6236 58.7678 39.1110 175.5979 62 E 3.9520 8.7081 126.7907 55.3748 30.2693 176.3721 63 N 3.9815 8.1560 118.1888 53.6172 38.1524 174.2089 64 T 3.9807 6.3731 108.0433 61.6081 70.5742 171.6489 65 F 5.6513 8.6102 125.8132 55.0137 41.6912 174.2465 66 L 4.8125 8.4021 123.0719 53.3613 44.9788 175.3434 67 S 4.9661 8.0039 116.8853 56.4290 65.9232 174.1158 68 E 3.8747 8.7297 119.7479 59.9010 29.4778 179.2639 69 D 4.8091 7.9826 114.6660 53.8471 39.5494 176.1705 70 Q 4.3720 8.3502 118.0287 58.0054 31.2399 178.0075 71 V 3.5192 7.7241 116.7324 66.1790 31.2942 177.5540 72 D 4.3660 8.1326 118.0060 57.5727 40.5197 178.4093 73 Q 3.9174 7.7833 116.5665 57.9820 28.9923 178.0054 74 L 4.3681 8.0725 119.7499 55.4250 40.8783 178.1888 75 A 4.0683 8.7114 123.1425 55.4906 18.0872 179.5010 76 L 3.8999 7.9975 115.8566 57.2072 42.1568 176.7111 77 Y 4.4864 7.3512 114.4954 59.1010 39.5907 176.3319 78 A 4.6911 8.3562 123.8433 49.2147 18.1184 173.8802 79 P 4.3328 0.0000 0.0000 65.3938 32.2193 178.2831 80 Q 4.3156 7.7587 117.3402 56.5148 29.1436 175.7078 81 A 4.8937 7.8810 119.0715 50.9555 20.6880 177.6233 82 T 4.4222 8.5332 118.7884 62.3393 71.1201 174.4293 83 V 4.5963 7.8200 124.1369 59.9935 32.4527 173.9107 84 N 4.5212 8.3753 124.2131 51.7993 38.3758 174.6526 85 R 4.2551 8.5381 123.8339 56.0134 31.8577 177.3154 86 I 5.0463 8.1210 123.9360 61.0534 37.4530 177.1980 87 D 4.5124 8.8521 122.2251 56.1011 42.0999 173.7657 88 N 4.1306 8.2688 121.4692 53.7817 40.5036 174.1370 89 Y 3.6059 7.6105 111.6190 59.1440 36.5572 171.6079 90 E 4.3441 8.1621 118.6893 56.3223 29.0182 177.1633 91 V 4.0645 7.4719 117.3363 61.8193 32.7778 173.2895 92 V 4.0480 7.6297 121.2299 63.7135 33.9387 176.5036 93 G 3.8542 7.9266 109.0505 44.7254 0.0000 174.2527 94 K 4.1174 8.2847 120.5927 56.2708 29.5560 175.3923 95 S 4.3263 8.1424 115.6745 58.6760 63.1434 173.1762 96 R 4.6839 8.1076 123.8354 53.5484 33.8729 173.1807 97 P 4.2389 0.0000 0.0000 63.4419 31.7641 176.3202 98 S 4.6468 8.8782 121.1152 56.4038 64.9307 173.9687 99 L 4.2043 8.1524 121.8611 53.8625 41.6385 175.9542 100 P 4.5548 0.0000 0.0000 62.3568 32.1845 176.3894 101 E 4.2920 8.6645 119.4271 58.8409 30.6177 177.0531 102 R 5.1559 7.8917 116.2668 54.3970 34.6446 175.0335 103 I 4.7427 8.9567 122.8791 60.0335 40.4877 174.5373 104 D 5.4103 8.7373 126.1564 52.8164 44.2518 177.2079 105 N 4.3050 9.0276 114.0119 54.4244 37.8396 175.5607 106 V 4.0838 7.6710 109.4617 62.6184 33.6037 176.6774 107 L 4.1234 7.7458 117.1796 54.4470 42.0624 176.3854 108 V 4.4345 7.7230 119.5604 60.7445 32.6310 174.9678 109 C 4.4460 9.0452 127.5825 59.2285 31.8525 172.5981 110 P 4.1132 0.0000 0.0000 64.8093 31.3440 175.8320 111 N 4.5484 7.4815 115.0241 53.1525 38.1755 175.4566 112 S 4.1398 8.6950 121.8373 60.9508 63.1891 174.6624 113 N 4.7009 8.3764 117.7009 53.2775 38.7841 174.1107 114 C 4.3140 8.0476 118.9282 59.2135 30.8191 174.3348 115 I 3.6484 8.4678 127.0356 63.8129 37.7908 177.7917 116 S 3.9039 7.7357 113.8048 61.1341 63.0288 175.4263 117 H 4.2893 7.8162 118.0575 58.7050 28.3934 176.4616 118 A 4.6595 7.2256 117.5269 51.8201 18.9539 176.2540 119 E 4.7259 7.6716 116.6507 55.4823 33.6518 174.8592 120 P 4.6120 0.0000 0.0000 61.8848 30.0626 175.7223 121 V 4.5781 6.9533 110.8454 59.5585 36.1460 175.6384 122 S 4.8993 8.4177 117.3384 57.2402 64.3174 174.7244 123 S 4.5626 8.6595 117.9255 59.0875 64.7869 173.1332 124 S 5.6041 7.8816 113.5280 58.6033 65.6332 173.2274 125 F 5.3653 9.2196 125.5385 55.5869 42.8810 174.2169 126 A 4.7492 9.0825 125.1297 51.5440 20.0636 176.2991 127 V 4.8396 8.4864 121.1157 61.3110 34.0088 175.5273 128 R 4.6400 8.6611 125.6252 54.5587 34.4261 174.1028 129 K 4.5191 8.7914 125.8867 55.9873 33.2900 176.0620 130 R 4.5788 9.1051 125.3020 53.6977 33.4228 174.9450 131 A 3.9923 8.3319 122.2807 53.4580 17.8935 177.6272 132 N 4.4600 9.9309 118.7792 54.1111 36.3849 173.3228 133 D 4.7405 7.7106 117.1428 53.2913 44.8941 173.5583 134 I 5.0599 8.1902 120.5903 59.5856 41.2943 174.2538 135 A 5.0714 9.2374 129.8970 50.6865 20.9140 175.6712 136 L 5.2236 9.1716 122.9441 52.8909 44.9339 175.4268 137 K 4.9415 8.9480 126.4191 54.5309 34.2496 175.0271 138 C 3.7833 8.9435 129.1595 59.1762 31.8485 174.2329 139 K 3.4557 8.5389 128.6201 59.7586 31.8213 177.2135 140 Y 4.2724 7.7722 117.2411 60.2499 37.1287 176.2307 141 C 4.2456 7.9443 114.3479 59.0681 30.5637 174.5939 142 E 3.9885 7.9287 118.3378 57.1497 27.2481 173.9799 143 K 4.3458 7.3466 117.3966 55.4012 33.9937 175.2839 144 E 5.0762 8.1384 123.9869 54.5543 31.9775 174.6589 145 F 5.1436 8.9304 124.4831 55.8590 43.9936 173.4715 146 S 5.3768 8.5901 113.4237 57.2917 64.9121 175.2584 147 H 4.2443 9.1663 118.4138 59.0657 27.7391 177.6553 148 N 4.2047 7.1075 118.6206 55.8790 38.6059 177.2854 149 V 3.6825 8.0624 120.2006 66.0353 31.5842 178.4441 150 V 3.4437 7.6873 116.0807 65.1508 31.4681 176.1864 151 L 4.3229 7.8145 117.1896 54.5609 41.6353 176.1151 152 A 4.2476 7.1477 119.7908 48.2904 21.3452 176.2263 153 N 4.5650 8.2304 118.9151 52.9875 39.7331 174.3566 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 8.29 4.49 0.00 1.99 2.05 0.00 0.00 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.47 0.00 2 T 8.17 4.39 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 3 H 8.34 4.41 0.00 3.14 3.27 0.00 5.66 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 D 8.49 4.83 0.00 2.57 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 5 N 7.85 5.06 0.00 2.69 2.66 0.00 0.00 6.74 7.61 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 6 K 8.32 4.39 0.00 1.67 1.69 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.78 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.30 1.41 7.81 7 L 7.96 4.62 0.00 1.64 1.57 0.98 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 8 Q 8.68 4.51 0.00 2.02 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.85 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 9 V 7.22 4.10 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 0.80 0.00 0.00 0.93 0.00 0.00 10 E 7.58 4.49 0.00 1.90 1.80 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 2.12 2.22 0.00 11 A 8.16 4.77 1.20 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 0.00 0.00 0.00 0.00 0.00 0.00 12 I 7.41 4.42 1.87 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 1.30 0.39 0.95 0.00 0.00 13 K 8.23 4.26 0.00 1.68 1.74 0.00 1.65 0.00 0.00 1.49 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 0.92 1.14 7.81 14 R 7.72 4.22 0.00 1.96 1.82 0.00 3.34 0.00 0.00 3.51 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.92 0.00 15 G 7.62 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 0.00 0.00 0.00 0.00 16 T 8.09 4.61 4.18 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 1.19 0.00 0.00 17 V 7.93 4.75 2.05 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 1.00 0.00 0.00 0.91 0.00 0.00 18 I 8.69 4.53 1.84 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 1.04 0.84 0.87 0.00 0.00 19 D 9.75 4.76 0.00 2.68 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 0.00 0.00 0.00 0.00 20 H 8.23 4.30 0.00 3.35 3.29 0.00 5.74 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 21 I 7.58 4.22 1.96 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 1.31 0.89 0.97 0.00 0.00 22 P 0.00 4.05 0.00 2.22 2.01 0.00 3.66 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.12 0.00 23 A 8.38 4.37 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 24 Q 8.92 3.76 0.00 2.27 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.80 0.00 0.00 0.00 0.00 0.00 2.28 2.34 0.00 25 I 7.68 4.55 2.17 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.88 1.05 0.00 0.00 26 G 8.99 3.57 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 0.00 0.00 0.00 27 F 8.27 4.40 0.00 3.10 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 28 K 8.10 3.67 0.00 1.92 1.97 0.00 1.56 0.00 0.00 1.80 0.00 0.00 3.08 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.55 1.43 7.81 29 L 7.72 4.22 0.00 1.84 1.69 0.91 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 30 L 7.56 4.00 0.00 1.73 1.69 1.11 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 31 S 7.73 3.93 0.00 3.63 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 32 L 7.80 3.54 0.00 1.29 0.62 0.76 0.21 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 33 F 7.87 4.56 0.00 3.08 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 34 K 7.97 3.87 0.00 1.89 1.77 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.34 1.43 7.81 35 L 7.95 4.26 0.00 1.68 1.72 0.92 0.85 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 36 T 7.69 4.43 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 1.25 0.00 0.00 37 E 7.82 4.34 0.00 1.94 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 2.38 2.39 0.00 38 T 7.27 4.26 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 1.25 0.00 0.00 39 D 8.29 4.75 0.00 2.63 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 40 Q 7.77 4.22 0.00 2.06 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.77 0.00 0.00 0.00 0.00 0.00 2.35 2.47 0.00 41 R 8.26 4.23 0.00 1.88 1.84 0.00 3.32 0.00 0.00 3.33 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.66 0.00 42 I 8.05 5.02 1.87 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 1.33 0.66 0.91 0.00 0.00 43 T 10.00 4.55 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 1.21 0.00 0.00 44 I 8.56 4.98 1.90 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.05 0.94 0.00 0.00 45 G 9.38 4.25 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 0.00 46 L 8.48 5.13 0.00 1.49 1.56 0.93 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 47 N 8.40 4.13 0.00 2.81 2.87 0.00 0.00 6.88 9.05 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 48 L 7.73 4.60 0.00 1.87 1.80 0.94 0.85 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 49 P 0.00 4.49 0.00 2.07 2.06 0.00 3.65 0.00 0.00 3.71 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 50 S 8.27 4.88 0.00 3.96 3.76 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 51 G 8.48 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 52 E 8.71 3.81 0.00 2.15 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 2.20 2.23 0.00 53 M 7.69 4.56 0.00 1.89 1.97 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.52 0.00 54 G 8.28 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 55 R 8.60 5.20 0.00 1.66 1.79 0.00 3.54 0.00 0.00 3.28 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 56 K 8.68 4.71 0.00 1.99 1.90 0.00 1.34 0.00 0.00 1.74 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.36 1.44 7.81 57 D 10.09 5.45 0.00 2.67 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 58 L 9.37 4.95 0.00 1.67 1.59 0.94 0.43 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 59 I 8.34 4.76 1.85 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 1.25 0.57 0.90 0.00 0.00 60 K 9.33 4.80 0.00 1.72 1.67 0.00 1.59 0.00 0.00 1.69 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.32 1.33 7.81 61 I 8.15 4.72 1.83 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 1.17 0.59 0.89 0.00 0.00 62 E 8.71 3.95 0.00 1.86 1.87 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 2.29 2.22 0.00 63 N 8.16 3.98 0.00 2.63 2.92 0.00 0.00 6.95 7.49 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 64 T 6.37 3.98 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 1.19 0.00 0.00 65 F 8.61 5.65 0.00 3.10 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 66 L 8.40 4.81 0.00 1.57 1.52 0.88 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 67 S 8.00 4.97 0.00 3.99 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 68 E 8.73 3.87 0.00 2.01 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 2.37 2.29 0.00 69 D 7.98 4.81 0.00 2.85 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 70 Q 8.35 4.37 0.00 2.28 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.81 0.00 0.00 0.00 0.00 0.00 2.28 2.26 0.00 71 V 7.72 3.52 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 1.08 0.00 0.00 0.98 0.00 0.00 72 D 8.13 4.37 0.00 2.82 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 73 Q 7.78 3.92 0.00 2.24 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.87 0.00 0.00 0.00 0.00 0.00 2.60 2.68 0.00 74 L 8.07 4.37 0.00 1.83 1.69 0.80 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 75 A 8.71 4.07 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 76 L 8.00 3.90 0.00 1.49 1.39 0.68 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 77 Y 7.35 4.49 0.00 3.18 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 78 A 8.36 4.69 1.24 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 79 P 0.00 4.33 0.00 2.06 2.05 0.00 3.70 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.36 0.00 80 Q 7.76 4.32 0.00 2.03 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.72 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 81 A 7.88 4.89 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 82 T 8.53 4.42 4.20 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 0.00 0.00 0.00 1.24 0.00 0.00 83 V 7.82 4.60 2.05 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 0.98 0.00 0.00 0.89 0.00 0.00 84 N 8.38 4.52 0.00 2.55 2.40 0.00 0.00 7.03 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 85 R 8.54 4.26 0.00 1.79 2.06 0.00 3.00 0.00 0.00 3.42 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.70 0.00 86 I 8.12 5.05 2.03 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.41 1.00 0.00 0.00 87 D 8.85 4.51 0.00 3.06 2.88 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 88 N 8.27 4.13 0.00 2.97 3.01 0.00 0.00 7.03 7.34 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 89 Y 7.61 3.61 0.00 3.25 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 90 E 8.16 4.34 0.00 2.00 1.95 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 2.38 2.27 0.00 91 V 7.47 4.06 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 0.68 0.00 0.00 0.90 0.00 0.00 92 V 7.63 4.05 2.05 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 0.86 0.00 0.00 0.91 0.00 0.00 93 G 7.93 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 94 K 8.28 4.12 0.00 1.75 1.80 0.00 1.76 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.43 7.81 95 S 8.14 4.33 0.00 3.87 4.02 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 96 R 8.11 4.68 0.00 1.65 1.81 0.00 3.22 0.00 0.00 3.23 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.62 0.00 97 P 0.00 4.24 0.00 1.93 2.22 0.00 3.78 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 2.21 2.11 0.00 98 S 8.88 4.65 0.00 3.97 3.79 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 99 L 8.15 4.20 0.00 1.63 1.61 0.89 0.99 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 0.00 100 P 0.00 4.55 0.00 2.22 2.01 0.00 3.70 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.13 0.00 101 E 8.66 4.29 0.00 1.94 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 2.40 2.35 0.00 102 R 7.89 5.16 0.00 1.66 1.81 0.00 3.14 0.00 0.00 3.23 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.66 0.00 103 I 8.96 4.74 1.99 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 1.48 0.83 1.04 0.00 0.00 104 D 8.74 5.41 0.00 2.64 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 0.00 105 N 9.03 4.30 0.00 2.88 2.92 0.00 0.00 6.82 6.98 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 0.00 106 V 7.67 4.08 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 0.13 0.00 0.00 1.05 0.00 0.00 107 L 7.75 4.12 0.00 1.24 1.01 0.52 0.73 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 0.00 108 V 7.72 4.43 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 0.85 0.00 0.00 0.93 0.00 0.00 109 C 9.05 4.45 0.00 3.27 2.90 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 0.00 110 P 0.00 4.11 0.00 0.97 1.68 0.00 2.67 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 1.63 0.00 111 N 7.48 4.55 0.00 3.15 2.92 0.00 0.00 6.78 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 S 8.69 4.14 0.00 4.01 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 0.00 113 N 8.38 4.70 0.00 2.73 2.99 0.00 0.00 7.15 7.23 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 0.00 114 C 8.05 4.31 0.00 3.13 2.77 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 0.00 115 I 8.47 3.65 1.84 0.00 0.00 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 1.40 0.93 0.76 0.00 0.00 116 S 7.74 3.90 0.00 3.77 3.62 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 0.00 117 H 7.82 4.29 0.00 3.11 3.37 0.00 5.66 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 A 7.23 4.66 1.24 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 0.00 119 E 7.67 4.73 0.00 1.76 1.72 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 0.00 2.15 2.17 0.00 120 P 0.00 4.61 0.00 2.02 2.00 0.00 3.57 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 2.00 2.07 0.00 121 V 6.95 4.58 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 0.68 0.00 0.00 0.52 0.00 0.00 122 S 8.42 4.90 0.00 3.82 4.01 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 0.00 123 S 8.66 4.56 0.00 4.35 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 0.00 124 S 7.88 5.60 0.00 3.86 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 F 9.22 5.37 0.00 3.07 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 0.00 126 A 9.08 4.75 1.24 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 0.00 127 V 8.49 4.84 2.28 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 0.81 0.00 0.00 0.98 0.00 0.00 128 R 8.66 4.64 0.00 1.78 1.76 0.00 3.17 0.00 0.00 3.10 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 129 K 8.79 4.52 0.00 1.76 1.70 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.72 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.40 7.81 130 R 9.11 4.58 0.00 1.91 1.78 0.00 3.23 0.00 0.00 3.25 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 131 A 8.33 3.99 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 0.00 132 N 9.93 4.46 0.00 2.92 3.02 0.00 0.00 6.88 8.06 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 0.00 133 D 7.71 4.74 0.00 2.75 2.49 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 I 8.19 5.06 1.83 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.46 0.92 0.00 0.00 135 A 9.24 5.07 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 0.00 136 L 9.17 5.22 0.00 1.68 1.74 0.78 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 137 K 8.95 4.94 0.00 1.85 1.69 0.00 1.62 0.00 0.00 1.55 0.00 0.00 2.77 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.32 1.33 7.81 138 C 8.94 3.78 0.00 3.10 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 0.00 139 K 8.54 3.46 0.00 1.50 1.30 0.00 1.36 0.00 0.00 0.61 0.00 0.00 2.59 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.91 1.12 7.81 140 Y 7.77 4.27 0.00 2.97 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 0.00 141 C 7.94 4.25 0.00 3.17 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 0.00 142 E 7.93 3.99 0.00 2.17 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 2.18 2.42 0.00 143 K 7.35 4.35 0.00 1.80 1.32 0.00 1.57 0.00 0.00 1.53 0.00 0.00 2.84 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.65 7.81 144 E 8.14 5.08 0.00 1.83 1.64 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 2.15 2.33 0.00 145 F 8.93 5.14 0.00 3.00 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 0.00 146 S 8.59 5.38 0.00 4.17 4.02 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 0.00 147 H 9.17 4.24 0.00 3.27 3.54 0.00 5.27 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 N 7.11 4.20 0.00 2.59 2.85 0.00 0.00 6.95 7.56 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 0.00 149 V 8.06 3.68 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 0.92 0.00 0.00 1.00 0.00 0.00 150 V 7.69 3.44 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 0.53 0.00 0.00 0.83 0.00 0.00 151 L 7.81 4.32 0.00 1.67 1.66 0.83 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 152 A 7.15 4.25 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 0.00 153 N 8.23 4.56 0.00 2.80 2.81 0.00 0.00 6.77 7.56 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