NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 22 L 4.2688 8.1801 120.6341 55.2474 42.9847 176.6710 23 A 4.4710 7.9664 117.8639 50.0241 20.1021 175.3826 24 D 5.8500 8.2689 119.4804 50.4085 44.4269 175.1546 25 S 4.1815 9.0249 116.8979 61.8390 62.7534 177.3453 26 K 4.0181 8.0659 120.3432 59.4544 31.8208 179.0939 27 A 4.0131 8.5733 121.4361 55.1178 18.2540 180.0982 28 V 3.6862 7.9871 117.7840 64.8041 31.5724 178.6692 29 L 4.2055 8.4206 119.9978 57.7711 41.4916 179.0047 30 N 4.3228 8.5260 117.2285 56.4679 38.7235 176.6387 31 Q 4.2494 8.5649 121.1026 59.3714 29.1489 178.3352 32 A 4.2126 8.5270 121.8407 55.0255 18.5158 179.6226 33 V 3.5456 8.1065 116.6831 66.1991 31.6148 178.1527 34 A 4.0926 8.4286 120.2284 55.5118 18.3033 179.4302 35 D 4.4029 8.6166 117.8062 57.5213 40.8235 179.0764 36 L 4.2215 8.7496 119.9309 57.7724 41.6836 179.7493 37 S 3.8988 7.7910 115.0330 61.5127 62.5597 176.9374 38 V 3.6416 7.8442 120.7705 65.7483 31.1760 177.8233 39 A 4.0176 8.5060 121.1264 55.4830 18.2117 179.0416 40 H 4.0071 8.6010 116.9875 59.4894 29.9115 177.4409 41 S 4.1453 8.0329 114.4486 61.4085 62.1257 176.2717 42 I 3.7250 8.0627 122.7333 64.3535 36.7928 178.3038 43 L 3.9321 8.2094 120.2214 58.1180 41.3422 179.1718 44 H 3.7107 8.1820 118.1655 58.8679 29.5918 177.0542 45 Q 4.3359 8.1829 121.5350 59.3172 28.7868 178.4951 46 V 3.6421 8.0340 119.3712 66.2461 31.3487 177.2687 47 H 4.1487 8.2336 116.9961 59.3209 29.7368 176.9548 48 W 4.6751 8.2915 119.3292 59.7499 29.1138 177.4959 49 Y 4.3744 8.6480 114.8153 57.2903 37.7265 175.2548 50 M 4.4232 7.5899 121.2414 55.9588 32.9101 175.5794 51 R 4.7222 8.9612 123.4418 55.2285 34.5949 173.6423 52 G 4.2439 8.8980 105.7978 42.9611 0.0000 173.3958 53 R 4.2160 8.2769 119.7982 57.4508 30.4280 177.5268 54 G 4.2697 9.4824 110.4446 45.2956 0.0000 174.8951 55 F 4.0968 8.7525 122.2440 62.0433 39.0028 176.8208 56 M 4.2483 8.2929 115.5444 57.9503 32.0867 177.0780 57 I 3.8251 7.5895 118.0765 62.7658 38.6324 177.1826 58 W 4.1848 8.3396 119.8057 58.9216 28.7951 178.1857 59 H 3.8728 8.0001 118.5856 58.6959 29.6603 175.3844 60 P 4.2266 0.0000 0.0000 65.4392 31.0637 178.0935 61 K 3.5596 7.4047 119.4199 59.5047 31.9413 178.5574 62 M 4.0035 7.8729 118.9611 58.3836 31.7395 178.4439 63 D 4.1664 7.6668 118.6474 57.1961 40.9235 178.5464 64 E 3.8694 7.8578 118.5481 59.7244 29.4373 178.9514 65 Y 4.4237 7.9352 116.8093 61.3897 37.8476 178.3367 66 M 4.0194 8.5345 120.1123 58.4804 32.0225 178.6842 67 E 3.9124 8.3680 118.8239 59.1186 29.5945 178.9534 68 E 3.6352 8.1726 119.3995 59.3015 29.6218 178.9778 69 I 3.5705 7.8722 120.0649 64.4865 37.0884 178.1167 70 D 4.4308 8.4573 120.1682 57.2881 40.5965 179.2315 71 G 3.4845 7.9048 106.1803 47.8679 0.0000 175.2657 72 Y 4.2570 7.6608 119.3814 60.8563 37.8276 178.5920 73 L 3.9699 8.3594 121.1711 58.1159 42.1706 178.9388 74 A 3.9640 8.2802 120.8333 55.2012 18.3924 179.4482 75 E 3.8671 8.2344 117.0937 59.8505 29.5131 179.6397 76 M 3.8933 8.3264 119.2398 58.1234 32.1200 178.8902 77 S 4.1217 8.3223 114.7872 61.6697 62.9971 176.4812 78 E 3.9537 8.2632 122.3135 58.9673 29.1665 179.3441 79 R 3.8238 7.9273 118.7903 59.1188 30.0262 178.2488 80 L 3.9239 8.0405 120.2801 58.2331 42.0037 179.1119 81 I 3.8400 7.8432 119.6252 64.7804 36.8365 178.4581 82 T 3.8606 7.9380 115.6570 66.5782 68.3848 175.8410 83 L 4.3179 7.8167 117.8184 55.1260 41.7627 177.7602 84 G 3.8427 8.2399 107.9607 45.3365 0.0000 173.9286 85 G 3.8275 7.8864 109.2262 43.7728 0.0000 173.5503 86 A 4.4440 7.9907 121.4191 49.2230 20.2235 174.2033 87 P 4.4881 0.0000 0.0000 63.0222 32.1469 176.7597 88 F 4.5377 8.3983 120.4688 58.9679 39.3065 176.5648 89 S 4.7556 8.7775 118.3574 56.7623 63.5519 174.8030 90 T 4.4721 6.8564 109.8267 59.8822 72.8915 173.6007 91 L 3.9788 8.2353 122.2355 57.7806 41.6328 179.8018 92 K 3.8764 7.7899 119.1989 59.4953 32.2212 178.5900 93 E 3.7270 7.7904 118.5292 59.2042 29.3284 179.3727 94 F 4.3875 7.6788 117.8020 60.7842 38.8077 177.7329 95 S 4.1540 8.1585 111.5914 61.4762 62.2727 175.7240 96 E 4.0788 8.1643 120.4649 58.9869 29.2870 178.3441 97 N 4.4805 7.7846 115.2506 53.9286 39.3101 175.8864 98 S 4.4582 7.4325 114.6268 58.2913 62.9535 173.8784 99 Q 4.2111 8.6019 124.3233 56.3584 29.0025 176.3343 100 L 4.0464 7.6680 121.3765 54.4004 42.5294 176.8427 101 K 4.5889 8.2664 123.1466 52.7427 34.1253 174.9093 102 E 4.7768 8.4956 122.1376 54.0005 31.7746 175.5628 103 V 4.5411 7.7414 113.4187 58.9276 35.6218 175.6288 104 L 4.0418 8.2622 121.1684 54.4634 42.0149 177.8987 105 G 2.5765 8.0234 111.0794 45.4056 0.0000 172.8101 106 D 4.3728 7.2580 120.9405 52.6926 43.7001 175.7283 107 Y 4.7781 8.6165 124.0394 60.1506 38.1400 176.4355 108 N 4.7077 8.6082 115.8538 53.4797 39.0069 175.6435 109 V 3.7042 7.2621 118.7092 62.9173 32.2330 176.4066 110 T 4.3596 8.9570 117.9662 61.0374 71.1054 175.8232 111 I 3.6523 8.2220 121.2219 64.2722 38.0273 177.8063 112 E 3.8472 8.1168 119.0521 59.4662 29.3038 179.0569 113 E 3.9596 7.9398 118.6850 59.3553 29.5066 179.4411 114 Q 3.9397 8.1705 118.2952 58.9615 28.7336 178.7952 115 L 3.7078 7.9590 119.9174 57.5434 41.5489 179.3872 116 A 3.8639 7.9411 120.7828 54.9947 18.2346 179.6531 117 R 3.7447 7.9520 117.3306 59.4985 30.0659 178.9387 118 V 3.2243 7.5921 118.0382 65.7718 31.4570 178.0753 119 V 3.4353 7.6729 118.0578 66.0458 31.3134 177.8461 120 E 3.9808 8.1860 118.2432 59.3285 29.2227 179.4871 121 V 3.6465 7.8342 118.2458 66.2186 31.5846 178.1886 122 F 4.4582 8.5327 117.8881 60.5735 38.6744 177.8754 123 R 3.9454 8.6538 118.3125 59.3219 29.8418 178.3975 124 Y 3.9291 8.0483 119.2227 60.7422 38.7888 178.1943 125 L 3.3812 8.1469 119.7462 57.4034 41.5577 179.3577 126 A 3.7651 8.1024 120.8921 54.9511 18.2557 179.5466 127 A 3.7527 7.7945 119.2628 55.0990 18.3575 179.5733 128 L 3.6131 7.5191 119.1978 58.2902 41.9803 179.3130 129 F 4.4573 8.0467 118.1528 60.4277 38.6977 177.4617 130 Q 3.9249 8.2623 119.5520 58.9529 28.7541 178.2030 131 K 3.9158 8.1411 120.8581 59.5149 32.2464 179.0137 132 G 2.2533 7.8643 106.2954 47.0330 0.0000 175.3935 133 F 3.9937 8.1415 123.2153 61.2553 39.3915 177.0412 134 D 4.4167 8.4671 118.7285 57.3110 40.5864 178.9894 135 V 3.5396 8.0435 119.3613 66.0386 31.7194 178.2852 136 S 4.2072 7.9850 115.3598 60.8804 62.8644 175.9760 137 D 4.1405 8.0419 121.7007 57.1086 40.7242 178.0483 138 E 3.9933 8.1795 118.2745 58.9113 29.7709 178.2824 139 E 4.3884 8.1391 116.5850 55.6611 29.6536 177.5065 140 G 3.8084 7.5422 106.7215 46.7464 0.0000 174.9755 141 D 4.5927 7.8230 121.7132 52.8056 39.5111 176.4698 142 S 4.0969 8.0950 120.4458 60.4895 63.4549 176.6501 143 V 3.5047 7.6426 121.5785 66.2988 31.4335 177.9473 144 T 3.7538 7.7923 115.6268 66.4971 68.2580 176.0475 145 N 4.5970 8.1733 120.3147 56.2290 38.8380 176.3855 146 D 4.3893 8.1216 119.3189 57.3148 41.3494 178.1837 147 I 3.5378 7.6288 120.3305 64.5359 37.0323 178.5047 148 F 3.9966 7.9991 118.4925 60.2035 38.6862 177.3799 149 N 4.3708 8.4957 116.9722 56.7162 38.8179 177.1372 150 V 3.5649 8.1243 119.7537 65.9749 31.6145 177.9027 151 A 3.7188 7.6615 120.4061 54.7196 17.9693 179.4897 152 K 4.0477 8.2263 118.1792 59.5263 32.3001 178.8341 153 A 3.9756 7.9986 121.0710 55.3488 18.3678 179.6483 154 S 4.0593 7.9413 111.2162 61.5070 62.4336 176.1616 155 I 3.6494 8.0367 121.4537 64.0459 37.6993 177.7719 156 E 4.0255 8.4637 119.7147 59.0797 29.2293 179.1812 157 K 4.3014 8.1583 119.8123 59.9322 32.2230 178.5999 158 H 4.3968 8.3243 116.5136 59.0035 28.5290 177.7401 159 I 3.8279 8.2603 121.8420 64.1276 36.8825 178.1410 160 W 4.3519 8.4541 129.0973 60.9399 30.5199 177.9851 161 M 3.3730 7.8421 118.4369 58.0330 31.3402 178.7682 162 L 3.9853 8.3129 119.4551 58.0050 41.7547 179.5775 163 Q 3.9866 8.4156 117.9790 58.8920 28.5591 178.8062 164 A 4.1365 8.3992 122.1802 55.2050 18.2081 179.1391 165 E 3.9718 8.1469 116.7504 59.4253 29.7588 178.2725 166 L 4.3724 7.5925 115.7621 54.4603 41.6332 177.2533 167 G 3.9280 8.1850 106.9752 46.2975 0.0000 173.6162 168 Q 4.6083 8.2133 116.6835 53.1800 32.5050 175.2020 169 A 4.4026 8.3244 122.3593 51.2763 19.2469 176.2727 170 P 4.4073 0.0000 0.0000 64.0985 31.6634 177.4827 171 K 3.8570 8.1215 115.0112 57.0199 29.5084 175.1331 172 L 4.1750 8.0626 122.2718 55.2878 41.4808 177.6289 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 22 L 8.18 4.27 0.00 1.67 1.76 0.97 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 23 A 7.97 4.47 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 24 D 8.27 5.85 0.00 3.08 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 25 S 9.02 4.18 0.00 3.89 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 26 K 8.07 4.02 0.00 1.93 1.84 0.00 1.65 0.00 0.00 1.98 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.52 1.51 7.81 27 A 8.57 4.01 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 28 V 7.99 3.69 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 0.89 0.00 0.00 0.80 0.00 0.00 29 L 8.42 4.21 0.00 1.91 1.78 0.96 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 30 N 8.53 4.32 0.00 2.80 2.61 0.00 0.00 6.85 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 31 Q 8.56 4.25 0.00 2.44 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.48 2.76 0.00 32 A 8.53 4.21 1.70 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 0.00 0.00 33 V 8.11 3.55 2.59 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 1.26 0.00 0.00 1.02 0.00 0.00 34 A 8.43 4.09 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 D 8.62 4.40 0.00 2.89 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 L 8.75 4.22 0.00 1.76 1.82 1.17 1.29 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 37 S 7.79 3.90 0.00 3.33 3.17 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 38 V 7.84 3.64 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 1.08 0.00 0.00 1.02 0.00 0.00 39 A 8.51 4.02 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 40 H 8.60 4.01 0.00 3.33 3.44 0.00 5.60 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 S 8.03 4.15 0.00 4.03 4.10 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 42 I 8.06 3.73 2.00 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 1.51 0.60 0.88 0.00 0.00 43 L 8.21 3.93 0.00 1.74 1.67 1.09 1.05 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 44 H 8.18 3.71 0.00 3.04 2.71 0.00 5.61 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 Q 8.18 4.34 0.00 2.28 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.58 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 46 V 8.03 3.64 2.24 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 0.95 0.00 0.00 0.96 0.00 0.00 47 H 8.23 4.15 0.00 3.03 3.36 0.00 6.00 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 W 8.29 4.68 0.00 3.73 2.82 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 49 Y 8.65 4.37 0.00 3.20 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 M 7.59 4.42 0.00 2.27 2.39 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.85 0.00 51 R 8.96 4.72 0.00 1.89 1.80 0.00 3.45 0.00 0.00 3.21 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 2.01 0.00 52 G 8.90 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 R 8.28 4.22 0.00 1.87 1.96 0.00 3.38 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.61 0.00 54 G 9.48 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 F 8.75 4.10 0.00 3.35 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 56 M 8.29 4.25 0.00 2.11 2.25 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.70 0.00 57 I 7.59 3.83 1.67 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 1.14 0.45 0.57 0.00 0.00 58 W 8.34 4.18 0.00 3.49 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 59 H 8.00 3.87 0.00 1.67 2.46 0.00 5.95 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 60 P 0.00 4.23 0.00 2.16 2.21 0.00 3.57 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.95 0.00 61 K 7.40 3.56 0.00 1.51 1.83 0.00 1.06 0.00 0.00 1.16 0.00 0.00 2.56 0.00 0.00 2.51 0.00 0.00 0.00 0.00 1.06 0.45 7.81 62 M 7.87 4.00 0.00 2.04 2.19 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 3.00 0.00 63 D 7.67 4.17 0.00 2.80 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 64 E 7.86 3.87 0.00 1.89 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.23 0.00 65 Y 7.94 4.42 0.00 3.19 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 66 M 8.53 4.02 0.00 1.79 2.10 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.18 0.00 67 E 8.37 3.91 0.00 2.07 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 2.45 2.41 0.00 68 E 8.17 3.64 0.00 2.14 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 2.12 1.47 0.00 69 I 7.87 3.57 2.07 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 1.77 0.96 1.05 0.00 0.00 70 D 8.46 4.43 0.00 2.86 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 71 G 7.90 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 Y 7.66 4.26 0.00 3.14 2.79 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 73 L 8.36 3.97 0.00 1.76 1.85 0.92 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 74 A 8.28 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 75 E 8.23 3.87 0.00 2.04 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 2.50 2.46 0.00 76 M 8.33 3.89 0.00 1.93 2.12 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 1.94 0.00 77 S 8.32 4.12 0.00 4.05 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 78 E 8.26 3.95 0.00 2.09 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.40 0.00 79 R 7.93 3.82 0.00 1.95 1.96 0.00 3.10 0.00 0.00 3.03 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.62 0.00 80 L 8.04 3.92 0.00 1.84 1.81 0.93 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 81 I 7.84 3.84 2.00 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 1.52 0.55 0.90 0.00 0.00 82 T 7.94 3.86 4.41 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 1.19 0.00 0.00 83 L 7.82 4.32 0.00 1.76 1.69 0.94 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 84 G 8.24 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 0.00 0.00 0.00 85 G 7.89 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 A 7.99 4.44 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 P 0.00 4.49 0.00 2.28 2.08 0.00 3.78 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 2.02 2.01 0.00 88 F 8.40 4.54 0.00 3.41 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 89 S 8.78 4.76 0.00 4.01 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 90 T 6.86 4.47 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 1.17 0.00 0.00 91 L 8.24 3.98 0.00 1.70 1.81 1.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 92 K 7.79 3.88 0.00 1.76 1.71 0.00 1.69 0.00 0.00 1.78 0.00 0.00 3.10 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.49 7.81 93 E 7.79 3.73 0.00 1.95 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 0.00 2.29 2.26 0.00 94 F 7.68 4.39 0.00 3.23 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 95 S 8.16 4.15 0.00 3.90 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 E 8.16 4.08 0.00 1.93 1.93 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 2.30 2.46 0.00 97 N 7.78 4.48 0.00 2.40 2.72 0.00 0.00 6.98 7.70 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 98 S 7.43 4.46 0.00 4.07 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 99 Q 8.60 4.21 0.00 1.66 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.61 0.00 0.00 0.00 0.00 0.00 2.41 2.62 0.00 100 L 7.67 4.05 0.00 1.52 1.47 0.94 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 101 K 8.27 4.59 0.00 1.75 1.56 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.26 0.99 7.81 102 E 8.50 4.78 0.00 1.92 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 2.22 2.29 0.00 103 V 7.74 4.54 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 0.70 0.00 0.00 0.86 0.00 0.00 104 L 8.26 4.04 0.00 1.55 1.51 0.90 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 105 G 8.02 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 0.00 0.00 0.00 106 D 7.26 4.37 0.00 2.55 2.34 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 0.00 0.00 0.00 0.00 107 Y 8.62 4.78 0.00 3.13 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 0.00 108 N 8.61 4.71 0.00 2.88 2.90 0.00 0.00 6.91 7.67 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 0.00 109 V 7.26 3.70 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 0.77 0.00 0.00 0.96 0.00 0.00 110 T 8.96 4.36 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 1.27 0.00 0.00 111 I 8.22 3.65 2.09 0.00 0.00 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 1.52 1.55 1.01 0.00 0.00 112 E 8.12 3.85 0.00 2.06 1.93 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 2.37 2.42 0.00 113 E 7.94 3.96 0.00 2.11 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 0.00 2.30 2.33 0.00 114 Q 8.17 3.94 0.00 2.15 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.60 2.60 0.00 115 L 7.96 3.71 0.00 1.36 1.25 -0.31 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 116 A 7.94 3.86 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 0.00 117 R 7.95 3.74 0.00 1.87 2.05 0.00 3.09 0.00 0.00 3.04 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 118 V 7.59 3.22 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.07 0.00 0.00 0.84 0.00 0.00 119 V 7.67 3.44 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.90 0.00 0.00 120 E 8.19 3.98 0.00 2.19 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 2.31 2.39 0.00 121 V 7.83 3.65 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 1.26 0.00 0.00 0.96 0.00 0.00 122 F 8.53 4.46 0.00 3.10 2.99 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 0.00 123 R 8.65 3.95 0.00 1.99 2.00 0.00 3.14 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.88 0.00 124 Y 8.05 3.93 0.00 3.13 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 0.00 125 L 8.15 3.38 0.00 1.55 0.80 1.04 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 126 A 8.10 3.77 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 0.00 127 A 7.79 3.75 1.17 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 0.00 0.00 128 L 7.52 3.61 0.00 1.02 1.25 0.90 1.10 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 0.00 129 F 8.05 4.46 0.00 3.08 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 0.00 130 Q 8.26 3.92 0.00 2.08 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.80 0.00 0.00 0.00 0.00 0.00 2.29 2.52 0.00 131 K 8.14 3.92 0.00 1.80 1.83 0.00 1.53 0.00 0.00 1.61 0.00 0.00 3.03 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.37 1.40 7.81 132 G 7.86 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 F 8.14 3.99 0.00 3.30 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 0.00 134 D 8.47 4.42 0.00 2.86 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 0.00 135 V 8.04 3.54 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 1.03 0.00 0.00 0.99 0.00 0.00 136 S 7.99 4.21 0.00 4.27 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 0.00 137 D 8.04 4.14 0.00 2.53 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 E 8.18 3.99 0.00 2.09 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.34 0.00 139 E 8.14 4.39 0.00 1.97 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 2.26 2.43 0.00 140 G 7.54 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 0.00 141 D 7.82 4.59 0.00 2.71 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 0.00 142 S 8.09 4.10 0.00 4.05 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 0.00 143 V 7.64 3.50 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 1.01 0.00 0.00 0.90 0.00 0.00 144 T 7.79 3.75 4.43 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 1.33 0.00 0.00 145 N 8.17 4.60 0.00 2.64 2.85 0.00 0.00 6.46 8.05 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 0.00 146 D 8.12 4.39 0.00 2.76 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 0.00 147 I 7.63 3.54 1.66 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.89 0.47 0.00 0.00 148 F 8.00 4.00 0.00 3.40 3.26 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 0.00 149 N 8.50 4.37 0.00 3.38 3.04 0.00 0.00 6.78 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 V 8.12 3.56 2.03 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 0.96 0.00 0.00 1.00 0.00 0.00 151 A 7.66 3.72 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 K 8.23 4.05 0.00 2.08 1.93 0.00 1.59 0.00 0.00 1.64 0.00 0.00 2.83 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.52 7.81 153 A 8.00 3.98 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 0.00 154 S 7.94 4.06 0.00 3.98 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 0.00 155 I 8.04 3.65 2.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.86 0.97 0.00 0.00 156 E 8.46 4.03 0.00 2.14 2.03 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 2.34 2.48 0.00 157 K 8.16 4.30 0.00 2.09 2.01 0.00 1.75 0.00 0.00 1.88 0.00 0.00 3.02 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.73 1.98 7.81 158 H 8.32 4.40 0.00 3.42 3.41 0.00 5.68 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 I 8.26 3.83 2.16 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.09 1.00 0.00 0.00 160 W 8.45 4.35 0.00 3.42 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 0.00 161 M 7.84 3.37 0.00 1.96 2.15 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 1.13 0.00 162 L 8.31 3.99 0.00 1.67 1.59 0.79 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 163 Q 8.42 3.99 0.00 2.37 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.50 2.74 0.00 164 A 8.40 4.14 1.37 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 0.00 0.00 165 E 8.15 3.97 0.00 2.21 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 0.00 2.31 2.43 0.00 166 L 7.59 4.37 0.00 1.76 1.63 0.83 0.90 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 0.00 167 G 8.18 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 0.00 0.00 0.00 168 Q 8.21 4.61 0.00 2.11 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.90 0.00 0.00 0.00 0.00 0.00 2.29 2.47 0.00 169 A 8.32 4.40 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 0.00 170 P 0.00 4.41 0.00 2.12 2.28 0.00 3.89 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.40 0.00 171 K 8.12 3.86 0.00 1.91 1.89 0.00 1.77 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.37 1.66 7.81 172 L 8.06 4.17 0.00 1.63 1.59 0.93 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00