NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 11 C 4.3838 8.4549 118.1426 55.4588 42.9048 173.1302 12 D 4.0397 7.9250 118.6279 54.8275 37.7522 172.6092 13 C 4.6341 8.5331 117.6063 55.8116 44.1279 174.3096 14 L 4.3383 8.7540 125.2433 53.9540 42.7973 175.7752 15 N 3.9090 9.1303 113.6165 54.6100 35.4629 175.8321 16 G 3.8197 8.4240 103.5568 45.5550 0.0000 174.6568 17 G 3.8753 7.8102 106.4663 46.2538 0.0000 173.4996 18 T 4.6913 8.8671 117.7227 61.4841 71.1213 173.0086 19 C 4.7663 8.7534 127.0661 56.2128 45.3587 172.4655 20 V 4.1762 8.4070 126.8310 60.9507 33.2609 174.2197 21 S 4.8349 8.0617 121.4193 56.2104 66.0750 172.6934 22 N 4.5026 9.0822 126.1049 53.3489 39.6019 175.5871 23 K 4.1608 8.7239 123.5441 57.3053 31.8956 177.0271 24 Y 4.6464 8.5673 115.7209 57.6628 41.0406 175.4253 25 F 4.7750 8.1768 117.5684 54.6946 39.5283 175.3232 26 S 4.1781 8.5463 119.9605 60.8411 63.0531 176.2897 27 N 4.4435 8.3131 116.8581 54.4986 37.4084 174.7042 28 I 4.4699 8.0738 121.8563 60.8360 37.7232 174.2431 29 H 5.1064 8.5173 120.7489 54.9296 31.1931 172.4299 30 W 5.2190 8.4885 116.2224 56.2337 32.0634 172.0439 31 C 5.3931 8.9538 117.0261 55.4226 37.1639 173.3903 32 N 5.0828 9.2532 121.3129 52.2806 39.8348 173.6037 33 C 5.1824 8.7398 121.1313 54.5594 42.5744 172.1531 34 P 4.6144 0.0000 0.0000 62.1265 31.8547 177.6304 35 K 3.9141 8.7870 119.4654 59.8980 32.0636 178.7354 36 K 4.0304 8.0576 115.9797 57.2984 32.4621 176.2590 37 F 5.1421 8.0915 117.9188 55.4523 41.5547 174.9935 38 G 4.2173 9.0510 113.0300 44.2656 0.0000 173.0883 39 G 4.3978 8.8527 105.3203 45.9736 0.0000 175.3832 40 Q 4.1293 8.6091 117.0528 57.3728 28.4144 177.6998 41 H 4.9118 8.5373 112.4948 55.6138 29.2728 173.6165 42 C 4.5348 8.0232 114.7862 58.1086 37.9925 173.8685 43 E 4.1278 8.3573 115.9881 56.5690 30.2815 175.6135 44 I 4.1754 8.0607 122.8334 60.0461 38.1190 174.5206 45 D 4.4168 8.6526 126.8727 52.9114 40.2433 176.9817 46 K 3.9695 8.3313 127.9528 58.1875 32.2696 178.5258 47 S 4.4439 7.4405 111.4187 58.2277 64.3782 174.6602 48 K 3.8749 8.0953 122.7011 57.1047 31.9679 176.0441 49 T 4.4984 8.4432 115.3535 61.7909 69.7028 172.3717 50 C 5.0721 7.8846 115.5690 54.9912 43.0355 172.3010 51 Y 5.1838 8.6026 117.6127 55.3508 40.9086 174.4039 52 E 4.8856 8.9057 119.1868 54.4013 33.1778 177.5576 53 G 3.8592 8.9025 112.0947 47.3174 0.0000 174.3133 54 N 4.8900 8.5457 122.6142 51.1851 37.6377 175.9850 55 G 4.0203 8.6416 107.3991 46.2272 0.0000 174.9937 56 H 4.0647 8.3073 120.1201 57.8674 29.6605 175.9303 57 F 4.7217 7.7863 114.2090 56.9861 39.1912 174.9488 58 Y 4.2812 7.9656 123.5475 58.2009 38.9031 175.9606 59 R 4.3273 7.7940 124.6228 55.6800 31.9833 176.0315 60 G 3.9143 5.4162 107.9448 44.9576 0.0000 174.6033 61 K 3.2696 8.1113 118.6750 55.3831 32.6907 176.3865 62 A 4.2298 8.2189 123.5083 53.1275 18.8433 179.6169 63 S 5.0904 8.8216 113.3205 58.5785 64.3728 173.4386 64 T 5.0689 7.7632 110.1787 60.3851 71.9303 172.9531 65 D 5.3121 8.5989 122.6438 52.1673 41.5148 177.1414 66 T 3.9558 7.9410 108.5137 64.5949 68.7347 175.0433 67 M 4.2198 8.2253 119.9143 55.1460 32.2926 176.7681 68 G 3.9400 8.2738 107.2812 45.5621 0.0000 174.0592 69 R 4.2686 8.4349 119.7779 54.4906 30.9234 174.2437 70 P 4.8176 0.0000 0.0000 62.9000 31.9940 176.9169 71 C 4.6095 8.7250 120.4760 57.0365 40.9237 173.4680 72 L 4.3239 8.5485 122.9850 53.5163 42.2393 175.6005 73 P 4.3443 0.0000 0.0000 62.3376 32.0270 177.7110 74 W 4.3490 8.9164 121.8862 58.8871 29.1095 177.4889 75 N 5.0036 8.0028 114.1426 52.2901 37.2746 175.5420 76 S 4.2714 7.8525 114.7729 58.3444 64.8455 174.6949 77 A 3.9217 8.5219 125.5760 55.8537 18.4361 180.0363 78 T 3.8762 7.7528 113.4680 66.9093 68.6054 176.9409 79 V 3.3514 7.5498 119.5285 65.6151 31.3400 177.6595 80 L 4.0016 7.9331 117.5539 56.6500 41.5015 178.2385 81 Q 4.3253 7.4947 116.1689 55.6104 29.4118 175.2324 82 Q 4.4878 7.6798 119.7283 54.2149 30.8483 175.7659 83 T 3.8237 8.6349 114.9441 66.1581 68.4342 174.4376 84 Y 4.6683 8.0635 119.6405 56.5322 39.3695 174.4732 85 H 5.3015 8.2593 118.8212 54.1900 31.5453 174.0429 86 A 4.4322 8.8101 121.8489 53.7859 18.1904 178.0282 87 H 4.9674 8.2539 111.4946 55.3198 29.6377 175.4315 88 R 4.1604 7.5700 120.1587 56.0692 30.3820 178.1407 89 S 4.2086 8.7045 116.8746 61.0919 63.3204 175.5639 90 D 4.8799 7.9307 119.0541 53.3066 39.8270 178.0802 91 A 3.9455 7.8131 124.9428 55.6240 18.4173 180.2148 92 L 3.8347 7.8219 118.3896 58.4762 42.0474 178.8433 93 Q 3.9877 8.0231 117.4902 58.8483 29.0889 177.3193 94 L 4.2393 7.6198 117.4014 54.0400 42.0479 177.0554 95 G 3.6941 7.5223 106.4757 46.3436 0.0000 173.5642 96 L 3.8457 7.7989 121.0303 52.6371 42.2440 175.7094 97 G 4.2795 7.6568 114.6827 44.5888 0.0000 171.7840 98 K 4.5003 8.5850 115.7637 54.3894 30.6242 174.5466 99 H 4.5116 7.2405 116.2459 55.1205 31.1986 174.0849 100 N 4.9298 7.6744 115.0157 52.4782 37.5576 173.5421 101 Y 5.1637 8.2083 115.7600 58.7389 39.1665 176.8106 102 C 4.8521 9.2908 121.4619 57.8145 40.7516 173.0924 103 R 4.5664 8.7414 120.1028 54.6471 34.8751 174.5280 104 N 4.7187 7.6717 115.8917 51.7072 38.8195 172.9899 105 P 4.0876 0.0000 0.0000 64.7594 32.1156 177.7438 106 D 4.7026 7.8928 116.1116 52.1425 39.8640 175.7265 107 N 4.0536 8.1122 114.3985 54.8619 35.8394 173.9436 108 R 4.2040 8.2992 117.0663 55.7780 31.4246 177.0392 109 R 4.0165 8.5303 117.5822 59.7671 30.2145 176.4959 110 R 4.4636 7.1587 110.5554 54.8545 32.0604 172.2397 111 P 4.5933 0.0000 0.0000 62.7887 32.6855 175.5634 112 W 5.7991 8.5593 118.9468 56.0137 32.3591 170.4252 113 C 4.9876 9.1951 113.6498 54.2151 42.5999 172.6387 114 Y 5.0523 7.9422 116.8770 57.8740 39.0044 175.0759 115 V 4.7098 8.8555 122.9450 60.7724 35.5375 174.2396 116 Q 4.3613 8.7614 128.2613 56.1210 29.6537 175.6004 117 V 4.2260 8.7605 127.1053 61.5067 33.6678 175.8318 118 G 3.9138 8.1577 119.7150 47.1390 0.0000 173.9632 119 L 4.3727 8.6442 124.4809 54.8551 42.0572 175.8896 120 K 4.8756 7.6762 118.4405 53.6471 36.6617 173.6851 121 P 5.0416 0.0000 0.0000 62.6003 32.5724 175.3768 122 L 4.9740 9.1168 121.9158 52.6597 45.6010 175.9953 123 V 4.1301 8.4778 122.7766 63.2035 32.1296 175.1797 124 Q 4.7379 9.2312 126.5548 53.5480 32.9840 174.4914 125 E 4.3959 8.7718 123.4561 56.6863 30.7478 176.6083 126 C 4.6180 8.8146 127.2044 56.7909 44.6200 173.6870 127 M 4.4633 8.6143 126.3181 54.1296 29.9069 175.0002 128 V 4.4891 7.5198 119.8111 60.1243 34.9826 174.0921 129 H 5.0819 8.5344 119.0963 53.7693 32.4033 173.1625 130 D 3.4809 8.1442 120.0002 54.1693 41.5268 177.5894 131 C 4.2481 8.9710 123.9473 60.1904 40.1767 175.4607 132 A 3.7401 8.1516 120.7789 53.9442 18.2874 177.0270 133 D 4.7710 7.5770 119.8396 54.7862 41.9134 175.4923 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 11 C 8.45 4.38 0.00 2.93 3.20 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 12 D 7.92 4.04 0.00 2.84 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 13 C 8.53 4.63 0.00 3.01 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.75 4.34 0.00 1.55 1.46 0.89 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 15 N 9.13 3.91 0.00 2.14 1.42 0.00 0.00 6.94 7.65 0.00 0.00 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 G 8.42 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 17 G 7.81 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 0.00 0.00 0.00 18 T 8.87 4.69 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 1.16 0.00 0.00 19 C 8.75 4.77 0.00 2.91 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 20 V 8.41 4.18 0.67 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 0.10 0.00 0.00 0.69 0.00 0.00 21 S 8.06 4.83 0.00 3.72 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 N 9.08 4.50 0.00 2.95 3.09 0.00 0.00 7.09 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 23 K 8.72 4.16 0.00 1.26 1.43 0.00 1.63 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.32 1.37 7.81 24 Y 8.57 4.65 0.00 3.15 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 25 F 8.18 4.78 0.00 3.18 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 26 S 8.55 4.18 0.00 3.99 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 27 N 8.31 4.44 0.00 2.91 3.07 0.00 0.00 5.98 7.81 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 28 I 8.07 4.47 2.10 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.79 1.11 0.00 0.00 29 H 8.52 5.11 0.00 3.13 3.19 0.00 5.54 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 W 8.49 5.22 0.00 3.37 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 31 C 8.95 5.39 0.00 3.03 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 32 N 9.25 5.08 0.00 2.66 2.82 0.00 0.00 6.70 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 33 C 8.74 5.18 0.00 2.93 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 P 0.00 4.61 0.00 2.42 2.07 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 2.35 2.14 0.00 35 K 8.79 3.91 0.00 2.02 1.89 0.00 1.86 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.45 1.05 7.81 36 K 8.06 4.03 0.00 1.53 1.29 0.00 1.61 0.00 0.00 1.76 0.00 0.00 2.85 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.39 1.38 7.81 37 F 8.09 5.14 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 38 G 9.05 4.22 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 0.00 39 G 8.85 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 0.00 0.00 0.00 40 Q 8.61 4.13 0.00 2.08 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.29 0.00 0.00 0.00 0.00 0.00 2.28 1.95 0.00 41 H 8.54 4.91 0.00 3.35 3.42 0.00 5.74 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 42 C 8.02 4.53 0.00 3.24 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 43 E 8.36 4.13 0.00 2.09 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 2.28 2.31 0.00 44 I 8.06 4.18 1.91 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.01 0.75 0.00 0.00 45 D 8.65 4.42 0.00 2.66 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 K 8.33 3.97 0.00 1.70 1.75 0.00 1.68 0.00 0.00 1.74 0.00 0.00 3.08 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.43 7.81 47 S 7.44 4.44 0.00 3.88 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 48 K 8.10 3.87 0.00 1.96 1.68 0.00 1.69 0.00 0.00 1.78 0.00 0.00 3.29 0.00 0.00 3.43 0.00 0.00 0.00 0.00 1.49 1.82 7.81 49 T 8.44 4.50 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 1.24 0.00 0.00 50 C 7.88 5.07 0.00 3.09 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 51 Y 8.60 5.18 0.00 3.06 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 52 E 8.91 4.89 0.00 2.05 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 2.31 2.34 0.00 53 G 8.90 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 0.00 0.00 0.00 54 N 8.55 4.89 0.00 3.16 3.08 0.00 0.00 6.71 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 55 G 8.64 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 56 H 8.31 4.06 0.00 3.10 2.85 0.00 5.78 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 F 7.79 4.72 0.00 3.17 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 58 Y 7.97 4.28 0.00 3.01 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 59 R 7.79 4.33 0.00 1.72 1.87 0.00 3.29 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.54 0.00 60 G 5.42 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 61 K 8.11 3.27 0.00 1.42 1.20 0.00 1.55 0.00 0.00 1.49 0.00 0.00 2.79 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.30 0.88 7.81 62 A 8.22 4.23 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 63 S 8.82 5.09 0.00 4.33 4.46 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 64 T 7.76 5.07 4.33 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 1.24 0.00 0.00 65 D 8.60 5.31 0.00 3.05 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 66 T 7.94 3.96 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 1.30 0.00 0.00 67 M 8.23 4.22 0.00 2.03 2.22 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 2.57 2.48 0.00 68 G 8.27 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 69 R 8.43 4.27 0.00 2.14 1.86 0.00 3.14 0.00 0.00 3.23 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.57 0.00 70 P 0.00 4.82 0.00 2.06 2.05 0.00 3.77 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 1.98 2.00 0.00 71 C 8.73 4.61 0.00 2.99 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 72 L 8.55 4.32 0.00 1.46 1.48 0.90 0.96 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 73 P 0.00 4.34 0.00 2.11 1.90 0.00 3.51 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 2.05 2.02 0.00 74 W 8.92 4.35 0.00 3.54 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 75 N 8.00 5.00 0.00 2.83 2.93 0.00 0.00 6.08 7.64 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 76 S 7.85 4.27 0.00 4.04 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 77 A 8.52 3.92 1.29 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 78 T 7.75 3.88 4.16 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 1.12 0.00 0.00 79 V 7.55 3.35 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.81 0.00 0.00 80 L 7.93 4.00 0.00 1.72 1.60 0.87 0.74 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 81 Q 7.49 4.33 0.00 2.03 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.99 6.72 0.00 0.00 0.00 0.00 0.00 2.59 2.47 0.00 82 Q 7.68 4.49 0.00 1.87 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.97 0.00 0.00 0.00 0.00 0.00 2.14 1.43 0.00 83 T 8.63 3.82 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 84 Y 8.06 4.67 0.00 3.65 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 85 H 8.26 5.30 0.00 3.49 3.70 0.00 5.46 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 A 8.81 4.43 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 H 8.25 4.97 0.00 3.21 3.38 0.00 5.73 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 R 7.57 4.16 0.00 1.79 1.93 0.00 3.20 0.00 0.00 3.25 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.26 0.00 89 S 8.70 4.21 0.00 3.87 3.94 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 0.00 0.00 0.00 90 D 7.93 4.88 0.00 2.89 2.86 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 91 A 7.81 3.95 1.46 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 92 L 7.82 3.83 0.00 1.67 1.62 0.76 0.53 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 93 Q 8.02 3.99 0.00 2.34 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.73 0.00 0.00 0.00 0.00 0.00 2.34 2.03 0.00 94 L 7.62 4.24 0.00 1.57 1.49 1.09 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 95 G 7.52 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 0.00 0.00 0.00 96 L 7.80 3.85 0.00 1.53 1.27 0.86 -0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 97 G 7.66 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 98 K 8.59 4.50 0.00 1.80 1.82 0.00 1.83 0.00 0.00 1.79 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.48 7.81 99 H 7.24 4.51 0.00 2.07 3.09 0.00 5.59 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.67 4.93 0.00 2.70 2.91 0.00 0.00 5.93 7.57 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 0.00 101 Y 8.21 5.16 0.00 3.03 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 0.00 102 C 9.29 4.85 0.00 2.96 3.03 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 0.00 103 R 8.74 4.57 0.00 0.89 1.28 0.00 3.05 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 1.76 1.22 0.00 104 N 7.67 4.72 0.00 2.60 2.66 0.00 0.00 6.63 7.71 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 0.00 105 P 0.00 4.09 0.00 1.81 1.86 0.00 3.23 0.00 0.00 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.36 0.00 106 D 7.89 4.70 0.00 2.81 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.11 4.05 0.00 2.79 2.84 0.00 0.00 7.09 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 0.00 108 R 8.30 4.20 0.00 1.90 1.84 0.00 3.21 0.00 0.00 3.02 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.17 0.00 109 R 8.53 4.02 0.00 1.82 1.91 0.00 3.23 0.00 0.00 3.39 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.63 0.00 110 R 7.16 4.46 0.00 1.39 1.75 0.00 2.74 0.00 0.00 2.65 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.52 0.00 111 P 0.00 4.59 0.00 1.76 1.80 0.00 2.57 0.00 0.00 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.66 0.00 112 W 8.56 5.80 0.00 3.47 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 0.00 113 C 9.20 4.99 0.00 2.64 3.11 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 0.00 114 Y 7.94 5.05 0.00 2.81 2.85 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 0.00 115 V 8.86 4.71 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 1.00 0.00 0.00 116 Q 8.76 4.36 0.00 2.08 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.70 0.00 0.00 0.00 0.00 0.00 2.33 2.51 0.00 117 V 8.76 4.23 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 0.93 0.00 0.00 0.95 0.00 0.00 118 G 8.16 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 0.00 119 L 8.64 4.37 0.00 1.64 1.71 0.91 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 120 K 7.68 4.88 0.00 1.61 1.63 0.00 1.65 0.00 0.00 1.70 0.00 0.00 2.85 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.33 1.35 7.81 121 P 0.00 5.04 0.00 2.05 1.98 0.00 3.67 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.83 0.00 122 L 9.12 4.97 0.00 1.61 1.59 0.94 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 123 V 8.48 4.13 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 0.03 0.00 0.00 0.36 0.00 0.00 124 Q 9.23 4.74 0.00 2.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.46 2.44 0.00 125 E 8.77 4.40 0.00 2.07 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 2.39 2.33 0.00 126 C 8.81 4.62 0.00 3.06 2.92 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 0.00 127 M 8.61 4.46 0.00 2.13 2.17 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 2.55 2.53 0.00 128 V 7.52 4.49 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 0.48 0.00 0.00 0.74 0.00 0.00 129 H 8.53 5.08 0.00 3.05 3.15 0.00 5.62 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 D 8.14 3.48 0.00 2.42 2.47 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 0.00 131 C 8.97 4.25 0.00 2.79 3.10 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 0.00 0.00 0.00 0.00 132 A 8.15 3.74 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 0.00 133 D 7.58 4.77 0.00 2.71 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