NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.4162 8.2493 123.5854 52.9127 19.8021 176.6759 3 T 4.3485 7.6617 110.7293 61.0911 71.3437 173.4481 4 L 4.4043 7.6550 124.7542 53.5462 41.3209 176.4267 5 R 4.8918 8.0762 117.8913 53.4865 32.9369 175.9834 6 S 4.8109 8.6629 113.8756 58.8666 63.8854 173.0121 7 F 4.8804 8.2270 116.3849 55.9179 41.8466 173.0007 8 V 4.1458 8.2792 119.5954 62.0090 31.1957 175.2831 9 L 4.0719 8.4088 131.6572 57.2797 42.8970 176.9937 10 V 4.1775 7.4384 119.5299 61.0450 34.0543 174.2225 11 D 5.0509 8.7761 128.6816 53.2787 41.1695 176.2251 12 N 4.8075 9.2106 130.1315 52.7205 38.3031 175.8383 13 G 4.0895 8.8102 111.1510 44.8733 0.0000 174.4260 14 G 4.2109 7.2747 108.5406 45.5184 0.0000 174.1324 15 T 3.8190 8.1160 116.9295 65.5205 66.7817 176.9053 16 G 4.0406 8.9865 114.2119 45.9154 0.0000 173.9205 17 N 4.4695 8.0716 117.8646 53.4164 39.4273 175.2503 18 V 3.9590 8.4315 123.8232 61.8219 32.7890 174.5569 19 T 4.6977 8.2166 124.7210 61.9459 70.6515 174.4322 20 V 4.4811 8.0513 124.2748 61.1722 34.6475 174.8283 21 V 5.0190 9.0718 120.3848 58.8181 35.3250 173.1441 22 P 4.1906 0.0000 0.0000 62.6925 31.1913 176.2796 23 V 4.3632 8.7153 124.1496 63.9524 34.0415 175.2755 24 S 4.5581 7.5684 112.4075 56.8944 66.4299 174.0355 25 N 5.4924 8.2223 115.9672 52.3126 39.2073 173.5100 26 A 4.5458 7.6602 123.4721 51.9094 21.1551 177.2213 27 N 3.8908 9.5789 118.1333 54.4870 36.1358 175.2157 28 G 3.7976 8.5246 102.7289 45.8892 0.0000 173.9981 29 V 4.5357 7.5687 119.9148 60.6147 33.7822 174.5641 30 A 4.4744 8.8386 131.0063 51.4574 20.0882 175.4894 31 E 5.2165 8.6689 122.3420 54.1734 32.9744 174.5343 32 W 5.4602 10.0295 126.4615 55.2233 32.7713 174.6167 33 L 5.7782 9.4748 122.5931 52.0340 46.0506 176.3603 34 S 4.7113 8.5672 115.8265 56.9692 65.3060 174.4716 35 N 4.6993 8.1560 117.3193 52.1970 36.7232 173.3197 36 N 5.1320 7.3924 115.7507 50.7959 43.6435 174.9105 37 S 4.2231 8.4179 115.1168 58.8135 63.2807 176.0938 38 R 3.6796 8.8014 124.0466 59.3496 29.9614 178.2042 39 S 4.2507 8.0508 111.3777 60.7829 63.5228 174.6032 40 Q 4.4243 8.5802 119.0249 55.0881 28.2954 173.7099 41 A 4.9064 7.3341 118.4294 50.5799 22.8702 177.2278 42 Y 4.2524 8.9353 117.8236 58.2558 39.3819 175.3140 43 R 5.1946 8.8385 121.9661 54.9216 34.4012 173.9304 44 V 5.2124 9.1137 124.4371 61.6268 35.2771 174.0190 45 T 6.0563 9.5526 116.4881 59.5674 72.6764 172.4186 46 A 5.8902 8.8862 122.3599 52.1497 23.0590 175.1402 47 S 4.9836 8.6064 112.4403 57.3195 66.6635 172.5495 48 Y 4.8012 8.5937 122.6615 56.1011 40.8690 174.3938 49 R 4.5932 8.0541 124.2734 54.0684 35.2227 174.6272 50 A 4.4630 8.2234 121.8208 52.1010 19.5877 177.1786 51 S 4.1904 8.6835 113.7930 58.2418 66.1119 175.7641 52 G 4.0648 8.6151 117.0549 45.2503 0.0000 172.4139 53 A 4.4137 8.4548 120.5006 53.0633 19.4511 178.5465 54 D 4.5901 7.4737 114.8796 52.9150 40.5550 174.9553 55 K 5.1413 8.1334 117.0019 55.6267 36.9057 175.4517 56 R 4.8360 8.9925 120.1992 54.3644 34.3797 175.0174 57 K 5.0390 8.6639 122.4588 55.3586 35.4269 174.7888 58 Y 4.8224 9.3453 126.2630 57.8484 40.0603 175.3081 59 T 5.0045 8.9892 118.9044 62.2668 72.1085 172.6495 60 I 5.1990 8.8668 127.8747 59.3373 40.3543 175.2511 61 K 5.1480 9.2807 125.0642 54.5760 36.1439 175.0207 62 L 5.2849 8.9405 125.8980 53.3441 45.8029 175.0205 63 E 4.6382 9.1633 123.4142 54.6964 33.6008 174.5632 64 V 4.2063 8.5193 125.9443 60.3389 33.5068 173.1097 65 P 4.6186 0.0000 0.0000 61.8247 33.2709 175.8726 66 K 3.7140 7.6816 123.1636 54.4050 32.6181 174.8508 67 I 4.0117 7.7415 128.3239 61.2579 37.7662 175.8432 68 V 4.4563 8.3775 118.9095 60.5070 37.1065 173.7420 69 T 4.8944 8.2092 117.6267 61.9077 70.3391 174.3952 70 Q 4.3300 8.7959 128.4506 56.0575 30.8295 175.2277 71 V 4.9429 8.0272 115.6937 59.9525 35.6703 174.9678 72 V 4.2516 8.7190 125.1081 62.1905 34.2025 174.9655 73 N 4.1568 9.8412 125.4485 54.5653 35.9380 175.0189 74 G 3.8149 8.3653 101.8448 45.8317 0.0000 173.4459 75 V 4.3932 7.8812 121.0266 60.8059 33.3473 174.2384 76 E 5.1441 8.7561 126.4067 55.1317 31.5110 175.4935 77 L 4.9433 8.8769 122.2070 52.1288 46.3502 173.9052 78 P 4.7179 0.0000 0.0000 62.8792 32.1821 175.4555 79 V 4.5084 8.7270 123.7277 61.0890 35.8851 173.3735 80 S 4.9451 8.2672 116.5267 56.1717 63.5078 174.4163 81 A 4.1843 8.7386 130.4798 54.3081 18.9282 176.8303 82 W 4.3438 6.4929 108.0033 56.5171 31.7705 173.8408 83 K 5.2704 9.1915 118.1715 54.7675 35.8155 175.6321 84 A 4.9543 9.1096 124.3724 50.6435 21.4490 175.4908 85 Y 5.1765 8.8473 118.2287 56.1049 41.3447 175.0498 86 A 4.8835 8.9278 124.1830 50.2092 22.6943 174.8466 87 S 5.0838 8.7783 115.5039 56.5850 65.5607 173.1267 88 I 4.7533 9.0931 127.2969 59.5958 40.9525 173.9633 89 D 5.3750 8.9067 125.6919 52.4468 43.5983 174.8168 90 L 4.8538 9.1234 126.0312 53.4671 44.8670 174.9931 91 T 5.1880 8.6911 122.1488 61.8969 71.3591 173.4334 92 I 4.7477 8.9367 126.7898 58.6981 41.3122 173.5572 93 P 4.9979 0.0000 0.0000 62.5959 32.2331 177.3697 94 I 3.8877 8.3117 115.4699 62.4365 37.8767 177.1319 95 F 4.3082 7.4500 118.7634 58.9837 39.2304 175.4303 96 A 3.9578 7.7466 124.0221 52.4549 18.4654 177.8080 97 A 4.6001 8.7834 125.6019 50.8369 22.1557 177.4609 98 T 3.8033 8.4286 116.1385 67.5784 68.3473 176.1084 99 D 4.3862 8.1450 119.5033 57.7242 40.9196 178.5458 100 D 4.3868 8.1592 118.4968 57.6031 40.8379 178.8894 101 V 3.6067 7.8142 118.2689 66.4233 31.4639 177.8962 102 T 3.8267 8.0731 115.4674 66.7707 68.2867 176.2831 103 V 3.5327 7.8283 119.7020 66.2360 31.6263 177.6876 104 I 3.6584 7.7893 119.3288 64.6557 36.8956 177.8696 105 S 4.0132 8.5668 113.8822 61.7523 62.1696 176.6424 106 K 3.9975 8.4052 121.1447 59.2470 31.6482 179.5447 107 S 4.0655 8.4411 116.0152 61.6364 62.8236 176.5081 108 L 4.0259 7.7971 120.9952 57.8680 41.1858 179.3777 109 A 4.1198 7.5698 119.3231 55.2491 18.6542 179.4530 110 G 3.7509 8.5544 104.3306 47.8933 0.0000 175.0654 111 L 3.7520 8.1317 122.2302 57.8438 42.0984 178.5176 112 F 4.5079 7.7977 113.4010 56.1186 39.9999 176.1177 113 K 3.9457 7.5748 121.4822 56.3541 32.5655 176.0482 114 V 3.9274 8.1981 125.4173 64.0799 31.9478 175.4231 115 G 4.1059 9.0547 115.1594 45.8359 0.0000 174.1682 116 N 4.6907 7.9798 116.7129 51.4050 40.8428 174.0506 117 P 4.2086 0.0000 0.0000 66.6751 31.0225 178.3362 118 I 3.9316 7.8598 119.3965 63.7570 36.9379 178.1159 119 A 4.0385 7.9390 120.8013 55.0871 18.1316 178.8128 120 E 3.8413 7.9610 116.2728 59.5125 29.9571 178.4890 121 A 4.0414 8.4209 120.7920 55.3051 18.4842 179.4064 122 I 3.7243 7.9004 118.3424 64.6658 37.0407 178.4408 123 S 4.6552 8.1085 110.8190 58.9193 62.6091 174.4950 124 S 4.5812 7.3664 113.8265 58.1367 63.7267 173.6272 125 Q 3.4020 8.2473 116.3679 57.5791 26.0550 173.6276 126 S 4.6855 7.9691 113.0124 57.0783 65.2673 173.1489 127 G 3.8835 8.1422 109.9824 43.9870 0.0000 172.3228 128 F 4.3933 8.2738 119.7719 55.9632 39.1681 174.2614 129 Y 4.9210 8.0317 122.9784 54.8502 41.1563 175.4699 130 A 4.2925 8.7807 121.3880 53.4221 19.2140 176.3617 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 A 8.25 4.42 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 3 T 7.66 4.35 4.32 0.00 0.00 0.00 0.00 0.00 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 4 L 7.66 4.40 0.00 1.54 1.58 0.20 0.65 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 R 8.08 4.89 0.00 2.02 1.92 0.00 3.16 0.00 0.00 3.43 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.77 0.00 6 S 8.66 4.81 0.00 4.06 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 7 F 8.23 4.88 0.00 3.05 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 8 V 8.28 4.15 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 0.73 0.00 0.00 0.89 0.00 0.00 9 L 8.41 4.07 0.00 1.22 1.43 0.91 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 10 V 7.44 4.18 1.88 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 0.88 0.00 0.00 0.71 0.00 0.00 11 D 8.78 5.05 0.00 2.63 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 N 9.21 4.81 0.00 2.72 2.75 0.00 0.00 6.71 7.87 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 13 G 8.81 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 G 7.27 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 T 8.12 3.82 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 16 G 8.99 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 N 8.07 4.47 0.00 2.55 2.71 0.00 0.00 6.68 8.37 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 18 V 8.43 3.96 1.60 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 0.14 0.00 0.00 0.60 0.00 0.00 19 T 8.22 4.70 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 1.18 0.00 0.00 20 V 8.05 4.48 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 1.02 0.00 0.00 0.64 0.00 0.00 21 V 9.07 5.02 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.97 0.00 0.00 22 P 0.00 4.19 0.00 1.80 1.56 0.00 3.66 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.25 0.00 23 V 8.72 4.36 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 0.78 0.00 0.00 0.93 0.00 0.00 24 S 7.57 4.56 0.00 3.84 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 25 N 8.22 5.49 0.00 2.49 2.64 0.00 0.00 7.23 7.96 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 26 A 7.66 4.55 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 27 N 9.58 3.89 0.00 2.88 2.91 0.00 0.00 7.04 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 28 G 8.52 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 29 V 7.57 4.54 2.23 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 1.00 0.00 0.00 0.96 0.00 0.00 30 A 8.84 4.47 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 E 8.67 5.22 0.00 2.05 1.73 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 2.25 2.34 0.00 32 W 10.03 5.46 0.00 3.47 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 33 L 9.47 5.78 0.00 1.56 1.55 0.95 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 34 S 8.57 4.71 0.00 3.88 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 35 N 8.16 4.70 0.00 2.72 2.82 0.00 0.00 6.59 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 N 7.39 5.13 0.00 2.71 2.68 0.00 0.00 7.25 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 37 S 8.42 4.22 0.00 3.86 3.78 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 38 R 8.80 3.68 0.00 1.80 2.03 0.00 3.39 0.00 0.00 3.43 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.60 0.00 39 S 8.05 4.25 0.00 3.95 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 40 Q 8.58 4.42 0.00 1.97 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.70 0.00 0.00 0.00 0.00 0.00 2.20 2.41 0.00 41 A 7.33 4.91 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 42 Y 8.94 4.25 0.00 2.91 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 43 R 8.84 5.19 0.00 1.90 1.73 0.00 3.09 0.00 0.00 3.33 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 44 V 9.11 5.21 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.95 0.00 0.00 45 T 9.55 6.06 4.44 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 1.34 0.00 0.00 46 A 8.89 5.89 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 S 8.61 4.98 0.00 3.90 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 48 Y 8.59 4.80 0.00 2.58 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 49 R 8.05 4.59 0.00 1.60 1.62 0.00 3.14 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 1.46 1.50 0.00 50 A 8.22 4.46 1.08 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 0.00 0.00 51 S 8.68 4.19 0.00 3.83 3.61 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 52 G 8.62 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 A 8.45 4.41 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 54 D 7.47 4.59 0.00 2.63 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 55 K 8.13 5.14 0.00 1.88 1.66 0.00 1.61 0.00 0.00 1.66 0.00 0.00 2.88 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.35 1.38 7.81 56 R 8.99 4.84 0.00 1.68 1.28 0.00 3.01 0.00 0.00 2.92 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.68 0.00 57 K 8.66 5.04 0.00 1.72 1.54 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.56 7.81 58 Y 9.35 4.82 0.00 3.06 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 59 T 8.99 5.00 4.32 0.00 0.00 0.00 0.00 0.00 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 60 I 8.87 5.20 1.89 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 1.30 0.94 0.90 0.00 0.00 61 K 9.28 5.15 0.00 1.73 1.74 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.43 7.81 62 L 8.94 5.28 0.00 1.73 1.47 1.01 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 63 E 9.16 4.64 0.00 2.01 1.63 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 1.79 2.23 0.00 64 V 8.52 4.21 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 0.87 0.00 0.00 1.01 0.00 0.00 65 P 0.00 4.62 0.00 1.76 1.70 0.00 2.32 0.00 0.00 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.28 0.00 66 K 7.68 3.71 0.00 0.79 0.74 0.00 1.10 0.00 0.00 1.12 0.00 0.00 2.90 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.30 0.81 7.81 67 I 7.74 4.01 1.76 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.43 0.84 0.00 0.00 68 V 8.38 4.46 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 0.57 0.00 0.00 0.89 0.00 0.00 69 T 8.21 4.89 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 1.19 0.00 0.00 70 Q 8.80 4.33 0.00 2.14 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.75 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 71 V 8.03 4.94 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 0.71 0.00 0.00 0.93 0.00 0.00 72 V 8.72 4.25 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 1.09 0.00 0.00 0.93 0.00 0.00 73 N 9.84 4.16 0.00 2.88 2.85 0.00 0.00 7.15 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 74 G 8.37 3.81 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 0.00 0.00 0.00 75 V 7.88 4.39 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 1.00 0.00 0.00 1.00 0.00 0.00 76 E 8.76 5.14 0.00 1.99 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 2.20 2.32 0.00 77 L 8.88 4.94 0.00 1.53 1.52 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 78 P 0.00 4.72 0.00 2.04 2.05 0.00 3.69 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 79 V 8.73 4.51 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 0.91 0.00 0.00 0.98 0.00 0.00 80 S 8.27 4.95 0.00 3.93 3.61 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 A 8.74 4.18 1.06 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 0.00 0.00 0.00 0.00 0.00 0.00 82 W 6.49 4.34 0.00 3.46 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 83 K 9.19 5.27 0.00 1.38 1.18 0.00 1.73 0.00 0.00 1.44 0.00 0.00 2.68 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.16 1.42 7.81 84 A 9.11 4.95 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.85 5.18 0.00 2.81 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 86 A 8.93 4.88 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 S 8.78 5.08 0.00 3.90 3.75 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 88 I 9.09 4.75 1.88 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.45 0.94 0.00 0.00 89 D 8.91 5.37 0.00 2.54 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 90 L 9.12 4.85 0.00 1.79 1.74 0.89 0.83 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 91 T 8.69 5.19 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 92 I 8.94 4.75 2.03 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.96 1.00 0.00 0.00 93 P 0.00 5.00 0.00 2.22 2.18 0.00 3.66 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.17 0.00 94 I 8.31 3.89 1.62 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 -0.36 0.74 0.00 0.00 95 F 7.45 4.31 0.00 3.17 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 96 A 7.75 3.96 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 A 8.78 4.60 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 98 T 8.43 3.80 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 1.22 0.00 0.00 99 D 8.15 4.39 0.00 2.69 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 0.00 100 D 8.16 4.39 0.00 2.93 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 0.00 101 V 7.81 3.61 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 1.04 0.00 0.00 1.02 0.00 0.00 102 T 8.07 3.83 4.47 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 1.20 0.00 0.00 103 V 7.83 3.53 2.25 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 1.09 0.00 0.00 1.00 0.00 0.00 104 I 7.79 3.66 2.08 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 1.43 1.13 0.92 0.00 0.00 105 S 8.57 4.01 0.00 3.83 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 K 8.41 4.00 0.00 1.93 1.83 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.65 7.81 107 S 8.44 4.07 0.00 3.94 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 0.00 108 L 7.80 4.03 0.00 1.88 1.81 0.90 0.87 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 0.00 109 A 7.57 4.12 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 0.00 110 G 8.55 3.75 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 0.00 0.00 0.00 111 L 8.13 3.75 0.00 1.59 1.71 0.68 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 112 F 7.80 4.51 0.00 3.11 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 0.00 113 K 7.57 3.95 0.00 1.96 1.84 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.83 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.45 1.41 7.81 114 V 8.20 3.93 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 0.85 0.00 0.00 0.96 0.00 0.00 115 G 9.05 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 0.00 116 N 7.98 4.69 0.00 2.97 2.70 0.00 0.00 6.54 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 0.00 117 P 0.00 4.21 0.00 2.28 2.34 0.00 3.68 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 2.03 2.06 0.00 118 I 7.86 3.93 1.88 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.40 0.84 0.00 0.00 119 A 7.94 4.04 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 0.00 120 E 7.96 3.84 0.00 1.99 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.35 0.00 121 A 8.42 4.04 1.15 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 0.00 0.00 122 I 7.90 3.72 2.12 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.12 0.98 0.00 0.00 123 S 8.11 4.66 0.00 4.02 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 0.00 124 S 7.37 4.58 0.00 3.98 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 0.00 125 Q 8.25 3.40 0.00 2.18 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.14 6.85 0.00 0.00 0.00 0.00 0.00 2.25 2.35 0.00 126 S 7.97 4.69 0.00 3.82 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 0.00 127 G 8.14 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 0.00 128 F 8.27 4.39 0.00 3.11 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 0.00 129 Y 8.03 4.92 0.00 3.00 2.95 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 0.00 0.00 0.00 130 A 8.78 4.29 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00