NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.3567 8.3349 115.2899 58.3428 64.1106 174.2907 3 S 4.2153 7.7834 113.9716 56.9255 63.6697 171.5893 4 L 4.4156 8.8466 124.9884 53.7929 43.2592 175.6472 5 L 4.3533 8.1006 125.9109 54.6944 43.2515 176.7229 6 V 4.4857 8.0708 121.7462 61.6070 34.5785 173.4919 7 K 4.4932 9.1004 130.4869 54.7292 33.8816 175.1090 8 K 4.6061 8.6540 127.4354 56.1537 32.4060 176.7964 9 L 4.5273 9.2306 124.6377 55.1787 42.9665 176.2323 10 V 4.4155 7.4716 116.4826 60.5362 34.6699 173.1713 11 E 3.7634 8.1375 121.4516 58.7761 29.7360 178.1087 12 S 4.0948 8.3670 116.6256 61.3752 62.9630 175.0765 13 A 3.8328 6.8749 119.7957 51.6618 18.6913 176.5369 14 T 4.4742 8.1999 118.7053 61.4715 70.6525 173.9690 15 T 3.8191 8.6246 123.3912 63.2669 68.4507 172.1295 16 P 4.3273 0.0000 0.0000 63.7544 31.8348 175.4007 17 M 5.0728 8.7712 122.2582 54.0347 36.5368 173.2794 18 R 4.9997 8.3179 119.5788 53.9801 31.9500 178.0274 19 G 3.7295 8.1006 114.2615 47.9170 0.0000 172.8580 20 S 4.5095 7.4840 111.8790 57.5290 66.0002 176.7756 21 E 3.8301 9.1888 120.8774 59.8012 29.0636 178.8750 22 G 3.9020 7.9078 103.6722 45.2069 0.0000 173.2922 23 A 3.9928 7.5704 123.3404 51.6871 18.7208 178.8130 24 A 4.0534 8.5991 125.9396 54.4529 18.7945 176.9981 25 G 4.2770 7.4332 100.5378 45.1048 0.0000 171.4369 26 Y 4.8343 8.9513 117.3016 56.5852 40.0799 175.5730 27 D 4.7758 9.6155 124.8961 54.4094 41.4118 175.9159 28 I 4.4546 8.5028 126.1527 60.2603 38.3280 175.5351 29 S 5.2133 8.4732 120.2065 56.3108 66.9555 173.2206 30 S 4.6139 8.9664 116.4355 58.0508 63.4953 174.4289 31 V 4.7152 8.5347 124.3258 61.1326 31.9942 174.8004 32 E 4.7774 8.5449 117.7603 55.3859 32.7182 174.1845 33 D 4.9891 8.5949 120.9175 53.5738 42.7454 176.1054 34 V 4.4947 8.6961 116.2644 60.2144 37.1800 173.7288 35 V 4.6719 8.0418 120.1810 61.5209 34.1731 175.2281 36 V 4.1060 8.9672 129.7560 61.1816 31.8390 173.4876 37 P 4.6433 0.0000 0.0000 62.4898 32.3764 175.6063 38 A 4.2592 8.4558 122.8614 52.8338 19.0192 176.9941 39 M 3.4383 7.7563 118.1153 54.8269 30.7425 176.6529 40 G 4.5569 7.7582 106.3831 44.7675 0.0000 172.3674 41 R 5.9317 8.6369 114.2637 55.7539 32.6469 173.8515 42 I 4.5169 8.2133 111.7381 60.2761 41.2721 172.8241 43 A 4.9173 8.4772 124.3025 50.2897 20.3173 176.4021 44 V 4.2384 8.2097 122.8022 62.7776 33.6033 175.1606 45 S 5.0048 9.6174 123.2939 58.1643 63.7863 175.0479 46 T 4.4285 7.7949 112.7389 59.9750 69.9078 175.5988 47 G 3.9681 8.6376 110.6581 45.8901 0.0000 172.7463 48 I 5.2847 7.5060 112.5771 58.9760 41.5936 174.1805 49 S 5.1772 8.8207 117.3924 56.6199 66.1458 172.8241 50 I 5.0508 8.2668 114.0565 59.5020 41.3580 174.9761 51 R 4.4893 8.4174 122.0653 54.2837 31.6463 174.4229 52 V 3.9229 8.2979 118.4212 60.1330 32.6902 174.5290 53 P 4.2925 0.0000 0.0000 62.6824 31.8383 176.1054 54 D 4.4853 8.4678 121.4790 56.0344 41.5852 177.0946 55 G 3.9554 10.2084 108.5915 45.8529 0.0000 172.5860 56 T 5.2610 7.2705 107.1671 60.8393 72.3403 172.0596 57 Y 4.9460 8.6557 118.9797 55.2621 42.2171 174.2512 58 G 4.1909 8.8101 107.9352 45.0158 0.0000 172.4758 59 R 5.2921 8.8103 126.2182 54.7379 32.1605 174.9982 60 I 4.4655 8.8036 128.4097 60.8424 37.7376 175.2078 61 A 4.9083 8.9380 129.5022 49.1308 22.1540 173.8235 62 P 4.6009 0.0000 0.0000 62.6918 32.3641 176.3096 63 R 4.4254 8.4390 122.2081 54.9671 31.7589 176.9221 64 S 4.2011 9.0507 117.7666 61.7154 62.2820 176.4461 65 G 3.8664 8.2109 107.4268 48.2909 0.0000 175.3289 66 L 4.1471 8.0481 121.1998 56.8828 41.5417 179.5584 67 A 3.9661 7.7701 120.8775 55.3318 18.2636 179.0311 68 Y 4.1080 8.0066 116.6284 60.8745 39.0147 177.9956 69 K 3.7660 7.9987 117.9752 58.0511 32.3634 177.3263 70 Y 4.4330 7.5140 112.6345 56.4463 39.5913 175.4347 71 G 3.9095 7.7967 107.9337 45.5743 0.0000 173.9654 72 I 4.5829 7.5304 118.0544 59.7955 38.6303 176.4814 73 D 4.8740 9.4597 127.6043 52.8066 43.8900 175.5157 74 V 4.6853 8.1800 123.0209 61.0806 32.5189 175.1604 75 L 4.3393 8.4220 127.9423 53.0593 42.7282 180.5582 76 A 3.3674 9.8766 124.3909 53.3923 17.8937 180.0867 77 G 3.9604 9.0295 107.7873 47.3071 0.0000 172.3870 78 V 4.4388 7.5246 119.5896 62.0920 32.3230 175.1872 79 I 4.3517 8.6171 130.2330 59.6502 38.8800 175.5148 80 D 5.0286 8.6032 127.3838 53.7537 41.8464 177.9849 81 S 4.3124 8.9413 115.3647 60.4147 63.3077 174.5891 82 D 4.6947 7.9137 118.8539 53.3451 40.2639 176.0697 83 Y 4.2771 7.8404 122.8946 58.1364 39.1347 176.1439 84 R 4.2718 7.7775 123.3446 55.5431 31.7912 175.9368 85 G 3.7682 5.3800 106.4844 43.2366 0.0000 172.8900 86 E 4.2066 8.3764 119.7093 55.9171 28.8549 176.1865 87 V 4.1099 8.7889 125.9534 62.6072 32.5411 174.7884 88 K 4.8801 8.7461 127.1536 54.7957 34.7212 176.5247 89 V 4.2367 8.1215 124.0461 60.8581 32.4819 173.7063 90 I 4.3568 8.1724 127.9680 61.2822 38.3402 174.6752 91 L 5.0953 9.4281 127.7109 53.0121 44.7432 174.7220 92 Y 5.0774 9.0192 125.4043 55.8924 41.3617 173.8727 93 N 4.8555 8.7787 126.9818 52.6016 39.5145 175.2299 94 T 4.1362 8.7828 117.8134 62.9422 70.2469 174.7228 95 T 4.4839 8.2461 114.0389 60.6120 70.8423 175.7639 96 E 4.0726 8.7845 120.7174 57.9767 30.1570 177.0201 97 R 4.6030 7.4473 120.0713 54.7533 32.3510 175.5910 98 D 4.8855 8.5207 124.0524 54.4982 42.5251 174.9786 99 Y 4.6425 8.5171 119.7319 56.5564 42.3159 173.3857 100 I 4.5669 7.3479 127.2445 59.7295 39.1535 174.9315 101 I 4.4192 8.6497 127.6226 59.4210 39.9662 174.8111 102 K 5.0273 9.0431 126.2678 53.2648 34.8566 176.2532 103 K 4.1195 8.4904 122.6608 58.6445 32.4484 177.6234 104 G 4.0201 9.2165 111.9221 45.1678 0.0000 173.6540 105 D 4.5292 7.9471 120.3554 54.1797 42.1668 176.1926 106 R 4.5861 8.6385 122.1936 56.3007 29.7857 176.2813 107 I 4.2182 8.3686 118.2642 61.9092 39.0285 175.1798 108 A 4.6238 7.3681 122.6995 51.9227 22.8973 174.2802 109 Q 4.9058 8.4128 113.0181 54.8861 32.4958 174.0691 110 L 4.9169 9.6564 126.6212 54.2738 43.3321 174.9378 111 I 4.5661 8.5846 128.3684 59.9913 39.2803 175.4560 112 L 4.7967 8.6286 127.2399 53.6417 41.6647 174.9707 113 E 4.4250 8.1155 123.5251 54.8978 31.2996 175.7495 114 Q 4.7749 8.6218 123.8530 55.8939 29.7875 175.1937 115 I 4.8608 8.2157 115.8417 59.5891 41.1637 174.6215 116 V 4.5931 8.3406 113.4476 60.2603 35.6185 175.6393 117 T 4.6929 8.1199 110.7902 60.1857 68.5423 171.4913 118 P 4.4589 0.0000 0.0000 62.8090 32.6279 176.3148 119 G 3.7662 8.3226 108.0972 45.4224 0.0000 172.9405 120 V 4.2129 8.1696 118.7253 60.7487 32.9954 174.5718 121 A 4.7431 8.4504 129.7457 50.3021 21.1899 175.3879 122 V 4.2898 8.1307 120.4376 61.2597 33.0935 175.3779 123 V 4.6002 8.0264 118.5588 59.9494 35.4850 174.8003 124 L 4.5080 8.3821 118.3894 55.1812 43.0235 176.6758 125 D 4.6364 7.7390 117.0441 52.5645 43.4500 174.7689 126 L 4.2066 8.5801 126.5520 56.5548 42.2478 177.4315 127 S 4.3896 8.4041 114.8401 58.4754 63.9266 173.7184 128 D 4.8240 8.5403 119.8151 54.8654 41.6716 173.6163 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 2 S 8.33 4.36 0.00 3.85 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 3 S 7.78 4.22 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 4 L 8.85 4.42 0.00 1.40 1.37 0.81 0.17 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 5 L 8.10 4.35 0.00 1.71 1.53 0.90 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 6 V 8.07 4.49 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 0.71 0.00 0.00 0.91 0.00 0.00 7 K 9.10 4.49 0.00 1.81 1.62 0.00 1.64 0.00 0.00 1.61 0.00 0.00 2.80 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.33 1.37 7.81 8 K 8.65 4.61 0.00 1.68 1.73 0.00 1.78 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.46 7.81 9 L 9.23 4.53 0.00 1.57 1.70 0.91 0.85 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 10 V 7.47 4.42 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 0.79 0.00 0.00 0.93 0.00 0.00 11 E 8.14 3.76 0.00 2.08 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 2.38 2.38 0.00 12 S 8.37 4.09 0.00 3.86 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 13 A 6.87 3.83 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 14 T 8.20 4.47 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 1.22 0.00 0.00 15 T 8.62 3.82 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 1.22 0.00 0.00 16 P 0.00 4.33 0.00 1.89 2.08 0.00 3.61 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.13 0.00 17 M 8.77 5.07 0.00 2.08 1.91 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.57 0.00 18 R 8.32 5.00 0.00 1.61 1.60 0.00 2.88 0.00 0.00 2.31 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.81 0.00 19 G 8.10 3.73 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 0.00 0.00 0.00 20 S 7.48 4.51 0.00 3.96 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 21 E 9.19 3.83 0.00 1.95 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 0.00 2.30 2.26 0.00 22 G 7.91 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 23 A 7.57 3.99 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 24 A 8.60 4.05 1.26 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 0.00 0.00 25 G 7.43 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 26 Y 8.95 4.83 0.00 2.95 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 27 D 9.62 4.78 0.00 2.49 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 28 I 8.50 4.45 1.91 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.89 0.94 0.00 0.00 29 S 8.47 5.21 0.00 3.87 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 30 S 8.97 4.61 0.00 3.94 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 31 V 8.53 4.72 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 0.85 0.00 0.00 0.96 0.00 0.00 32 E 8.54 4.78 0.00 1.92 1.90 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 2.21 2.29 0.00 33 D 8.59 4.99 0.00 2.68 2.61 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 0.00 34 V 8.70 4.49 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 0.67 0.00 0.00 0.94 0.00 0.00 35 V 8.04 4.67 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 0.77 0.00 0.00 0.87 0.00 0.00 36 V 8.97 4.11 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 0.93 0.00 0.00 1.04 0.00 0.00 37 P 0.00 4.64 0.00 2.15 2.17 0.00 3.78 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 2.08 2.00 0.00 38 A 8.46 4.26 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 39 M 7.76 3.44 0.00 2.13 2.09 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.54 0.00 40 G 7.76 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 41 R 8.64 5.93 0.00 1.99 2.15 0.00 2.74 0.00 0.00 4.01 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.54 0.00 42 I 8.21 4.52 1.90 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 1.31 0.61 0.93 0.00 0.00 43 A 8.48 4.92 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 44 V 8.21 4.24 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 1.01 0.00 0.00 0.96 0.00 0.00 45 S 9.62 5.00 0.00 3.84 3.84 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 46 T 7.79 4.43 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 47 G 8.64 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 I 7.51 5.28 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.07 0.96 0.00 0.00 49 S 8.82 5.18 0.00 3.98 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 50 I 8.27 5.05 1.92 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.77 0.90 0.00 0.00 51 R 8.42 4.49 0.00 1.79 1.77 0.00 3.08 0.00 0.00 3.15 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.75 0.00 52 V 8.30 3.92 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 0.77 0.00 0.00 1.01 0.00 0.00 53 P 0.00 4.29 0.00 2.17 1.98 0.00 3.59 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.33 0.00 54 D 8.47 4.49 0.00 2.65 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 55 G 10.21 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 56 T 7.27 5.26 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 57 Y 8.66 4.95 0.00 3.15 3.04 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 58 G 8.81 4.19 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 59 R 8.81 5.29 0.00 1.56 1.77 0.00 3.32 0.00 0.00 3.27 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.94 0.00 60 I 8.80 4.47 1.91 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.96 0.94 0.00 0.00 61 A 8.94 4.91 1.22 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 0.00 0.00 62 P 0.00 4.60 0.00 1.97 2.02 0.00 3.69 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.14 0.00 63 R 8.44 4.43 0.00 1.88 1.86 0.00 3.34 0.00 0.00 3.40 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.56 0.00 64 S 9.05 4.20 0.00 3.89 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 65 G 8.21 3.87 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 0.00 0.00 0.00 66 L 8.05 4.15 0.00 1.70 1.57 0.94 1.01 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 67 A 7.77 3.97 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 68 Y 8.01 4.11 0.00 2.93 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 69 K 8.00 3.77 0.00 1.77 1.09 0.00 1.90 0.00 0.00 1.78 0.00 0.00 3.11 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.36 1.53 7.81 70 Y 7.51 4.43 0.00 2.66 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 G 7.80 3.91 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 0.00 0.00 0.00 72 I 7.53 4.58 1.73 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.23 0.81 0.00 0.00 73 D 9.46 4.87 0.00 2.87 2.72 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 0.00 0.00 0.00 74 V 8.18 4.69 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 0.96 0.00 0.00 0.95 0.00 0.00 75 L 8.42 4.34 0.00 1.54 1.59 0.91 1.05 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 76 A 9.88 3.37 1.03 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 77 G 9.03 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 78 V 7.52 4.44 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 0.50 0.00 0.00 0.71 0.00 0.00 79 I 8.62 4.35 2.11 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.93 1.04 0.00 0.00 80 D 8.60 5.03 0.00 2.74 2.61 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 0.00 81 S 8.94 4.31 0.00 4.15 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 82 D 7.91 4.69 0.00 2.81 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 Y 7.84 4.28 0.00 2.99 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 R 7.78 4.27 0.00 1.59 1.73 0.00 3.34 0.00 0.00 3.13 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.44 0.00 85 G 5.38 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 86 E 8.38 4.21 0.00 1.96 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.51 0.00 87 V 8.79 4.11 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 0.93 0.00 0.00 1.04 0.00 0.00 88 K 8.75 4.88 0.00 1.67 1.71 0.00 1.80 0.00 0.00 1.67 0.00 0.00 2.91 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.56 1.38 7.81 89 V 8.12 4.24 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 1.00 0.00 0.00 0.96 0.00 0.00 90 I 8.17 4.36 1.89 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 1.35 1.08 0.95 0.00 0.00 91 L 9.43 5.10 0.00 1.55 1.56 0.95 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 92 Y 9.02 5.08 0.00 3.02 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 N 8.78 4.86 0.00 2.63 2.62 0.00 0.00 6.55 7.09 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 94 T 8.78 4.14 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 95 T 8.25 4.48 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 1.24 0.00 0.00 96 E 8.78 4.07 0.00 1.97 2.04 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 2.30 2.23 0.00 97 R 7.45 4.60 0.00 1.86 1.80 0.00 3.18 0.00 0.00 3.29 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 98 D 8.52 4.89 0.00 2.59 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 99 Y 8.52 4.64 0.00 3.00 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 0.00 100 I 7.35 4.57 1.56 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.53 0.77 0.00 0.00 101 I 8.65 4.42 1.87 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 1.37 0.88 0.92 0.00 0.00 102 K 9.04 5.03 0.00 1.64 1.66 0.00 1.66 0.00 0.00 1.68 0.00 0.00 2.81 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.29 1.26 7.81 103 K 8.49 4.12 0.00 1.75 1.77 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.59 1.67 7.81 104 G 9.22 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 0.00 0.00 0.00 105 D 7.95 4.53 0.00 2.69 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 0.00 106 R 8.64 4.59 0.00 1.70 1.93 0.00 3.26 0.00 0.00 3.45 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.71 0.00 107 I 8.37 4.22 1.90 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 1.31 0.60 1.01 0.00 0.00 108 A 7.37 4.62 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 0.00 109 Q 8.41 4.91 0.00 2.13 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.99 6.81 0.00 0.00 0.00 0.00 0.00 2.44 2.32 0.00 110 L 9.66 4.92 0.00 1.78 1.72 1.00 0.77 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 0.00 111 I 8.58 4.57 1.83 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.43 0.92 0.00 0.00 112 L 8.63 4.80 0.00 1.59 1.64 0.91 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 0.00 113 E 8.12 4.42 0.00 1.43 1.74 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 2.15 1.97 0.00 114 Q 8.62 4.77 0.00 1.95 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.74 0.00 0.00 0.00 0.00 0.00 2.36 2.35 0.00 115 I 8.22 4.86 1.95 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 1.34 0.73 1.17 0.00 0.00 116 V 8.34 4.59 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 0.80 0.00 0.00 0.95 0.00 0.00 117 T 8.12 4.69 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 1.23 0.00 0.00 118 P 0.00 4.46 0.00 2.20 2.11 0.00 3.85 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 119 G 8.32 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 0.00 120 V 8.17 4.21 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 0.85 0.00 0.00 0.93 0.00 0.00 121 A 8.45 4.74 1.22 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 0.00 0.00 122 V 8.13 4.29 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 0.86 0.00 0.00 0.93 0.00 0.00 123 V 8.03 4.60 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 0.81 0.00 0.00 0.95 0.00 0.00 124 L 8.38 4.51 0.00 1.59 1.69 0.92 0.90 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 0.00 125 D 7.74 4.64 0.00 2.56 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 0.00 126 L 8.58 4.21 0.00 1.67 1.71 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 127 S 8.40 4.39 0.00 3.91 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 0.00 128 D 8.54 4.82 0.00 2.80 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