NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3626 8.2493 123.5885 52.1871 21.0383 177.4017 2 T 3.9104 7.8123 106.1540 61.9396 69.7111 171.9041 3 K 5.1665 9.1416 124.3691 54.7422 36.7670 175.8620 4 A 5.3961 9.0622 124.2407 50.6315 23.2730 174.8938 5 V 4.9491 8.5789 116.3433 61.4662 35.2252 172.6471 6 C 4.9468 8.9377 121.7597 58.1858 35.5117 172.5571 7 V 4.6510 8.4584 125.8057 61.3233 33.3576 174.1196 8 L 4.7589 9.1026 129.0180 54.0200 43.2043 176.1142 9 K 4.9336 9.2312 121.8686 55.9370 37.1545 176.0837 10 G 4.6970 7.8934 108.7548 45.7006 0.0000 172.0677 11 D 4.4941 8.8346 118.4719 57.1275 41.6700 177.6702 12 G 3.9530 7.7214 110.7011 45.0669 0.0000 171.6892 13 P 4.5613 0.0000 0.0000 62.6874 32.0663 175.9389 14 V 4.1325 7.5410 120.6796 63.2763 31.9853 175.0063 15 Q 5.1735 8.0015 124.4284 55.9388 32.4113 173.4836 16 G 4.3349 8.0346 106.6272 46.1606 0.0000 171.7919 17 I 5.0710 7.9419 120.4122 59.4052 40.4482 175.0086 18 I 4.6610 8.6373 128.1134 59.4772 39.9998 174.6709 19 N 4.9637 8.6246 124.9642 51.5282 41.1623 174.0333 20 F 5.3817 8.7891 119.4788 55.8258 43.4492 173.6994 21 E 4.9709 9.5221 123.2570 54.8721 31.6659 174.0362 22 Q 4.5939 8.7629 127.2106 52.3559 28.9372 175.1393 23 K 4.1966 8.7110 122.5573 58.1807 32.8861 177.1447 24 E 4.7233 7.3480 117.1012 54.6642 31.6311 177.8343 25 S 3.8826 8.0919 117.4109 61.2657 63.3865 175.1062 26 N 4.9494 7.7915 116.4631 53.2472 39.4059 174.5099 27 G 3.9252 8.4739 107.6839 43.8533 0.0000 172.1331 28 P 4.6221 0.0000 0.0000 62.3691 33.3306 175.7294 29 V 4.9176 8.8142 121.7263 61.2177 34.0062 174.7461 30 K 4.8368 9.3888 128.4222 56.0616 33.7684 176.2011 31 V 5.0650 9.8105 124.4760 59.8486 34.1439 174.2010 32 W 6.1537 8.4939 123.9109 53.4256 32.4658 175.4537 33 G 4.1962 7.5281 106.1356 45.3654 0.0000 170.9173 34 S 5.1338 7.7732 112.6009 56.5921 66.6775 173.5958 35 I 4.8627 8.6334 124.1613 59.6848 40.9455 175.0066 36 K 4.7303 9.0897 126.8944 55.9994 35.4312 177.5320 37 G 3.8653 8.8694 107.4253 45.5227 0.0000 173.1578 38 L 4.4544 7.4987 119.9939 52.9216 42.9229 176.4356 39 T 4.2679 8.3161 113.4732 61.0160 69.4695 173.7893 40 E 4.0568 8.8100 124.9385 57.1297 30.2881 176.1183 41 G 3.7564 7.7500 111.1134 44.0213 0.0000 171.9068 42 L 4.9836 8.0385 119.6714 54.2561 43.1929 176.4290 43 H 5.0795 8.8434 119.1085 53.6189 32.8931 173.2580 44 G 4.1283 9.1830 110.9520 47.0463 0.0000 172.2659 45 F 5.4875 8.9264 124.7162 56.8455 42.4807 173.0918 46 H 5.3567 8.9582 122.5275 54.1798 33.9251 172.9573 47 V 4.6190 8.4553 120.8830 61.8454 32.6847 175.0867 48 H 4.9675 9.5465 126.3173 55.0500 30.1096 176.2590 49 E 3.5592 8.9036 122.0896 59.1164 29.5226 177.1727 50 F 4.9921 7.9614 118.2969 55.9863 40.8030 176.5624 51 G 4.3226 8.4691 113.7620 44.5091 0.0000 174.1179 52 D 4.6639 8.0086 119.2954 52.6965 41.7597 174.3080 53 N 5.1275 8.7454 123.8401 52.6918 39.0673 175.8045 54 T 3.9309 8.5888 109.0842 63.5355 69.4102 174.2238 55 A 4.6674 7.9109 124.7858 50.9494 19.6739 175.3312 56 G 4.0410 7.6391 113.5856 46.2271 0.0000 174.3413 57 C 4.6271 8.5339 115.8556 58.4366 35.7938 175.7417 58 T 3.8124 7.7076 117.7618 66.4018 68.1104 176.0767 59 S 4.4995 7.9865 112.6782 58.9097 63.4449 174.6037 60 A 4.4442 7.4242 124.0168 52.3513 18.7748 179.1473 61 G 4.2836 7.7371 104.6411 44.1914 0.0000 171.2229 62 P 4.6032 0.0000 0.0000 62.2847 33.2262 175.4267 63 H 4.3939 8.3605 116.9639 55.4989 29.5815 175.3902 64 F 4.3103 9.2413 125.1376 59.0557 40.1335 173.3872 65 N 5.1686 8.4171 125.8483 50.9865 38.5567 172.4355 66 P 4.5859 0.0000 0.0000 62.9031 32.2468 177.4794 67 L 4.6165 7.4377 117.6222 54.0370 42.9597 176.4530 68 S 3.5545 7.7301 110.0426 59.2399 61.1374 172.4714 69 R 4.3451 7.6194 119.2484 55.7084 30.9273 176.3255 70 K 4.4148 8.3537 119.4471 55.6790 33.9616 176.1777 71 H 3.9600 8.8928 122.5861 57.0623 30.4548 174.6666 72 G 4.2967 7.8934 111.4587 44.8055 0.0000 172.6508 73 G 3.9189 8.4288 108.4320 43.6579 0.0000 173.0106 74 P 4.5091 0.0000 0.0000 64.1635 31.0799 177.3043 75 K 4.4785 7.9101 115.9795 56.1150 32.6197 175.5491 76 D 4.6979 7.8536 119.7992 53.4261 42.0125 176.5846 77 E 4.0564 8.6236 120.7567 59.2018 29.8722 177.1695 78 E 4.4987 7.7737 122.3474 54.7008 28.0677 174.3879 79 R 5.0165 7.6881 119.3123 52.8487 33.8037 174.4584 80 H 4.7065 9.6365 116.7994 54.6362 29.8183 177.2857 81 V 3.4616 8.3918 121.6165 65.8935 31.5714 177.5246 82 G 3.7129 8.2959 108.1037 47.2697 0.0000 172.7069 83 D 4.7062 8.1545 120.5192 54.9017 40.0096 176.2379 84 L 4.7141 8.5804 123.5531 54.1285 43.2491 178.1841 85 G 4.1410 7.9697 109.4183 46.1801 0.0000 174.7535 86 N 5.6099 8.6481 120.1190 51.2808 42.3682 172.9807 87 V 4.4080 8.3914 113.8377 59.8407 35.7681 174.7593 88 T 4.9870 8.1866 118.3371 61.7953 71.5870 172.9168 89 A 4.8315 8.6983 129.5331 50.7102 20.0135 177.7727 90 D 4.8624 9.0095 124.2041 53.0798 39.9984 176.8013 91 K 4.2391 8.4916 116.6275 59.4573 32.5871 176.9299 92 D 4.6060 8.8351 120.1581 53.8006 40.8423 176.4019 93 A 4.3836 7.7360 119.1262 52.6865 16.8393 177.4710 94 V 4.8726 7.6123 114.9212 62.5453 35.0661 173.9634 95 A 5.5036 8.8454 129.4512 49.6367 21.2252 174.9197 96 D 4.9147 8.6535 123.3144 53.1865 42.1470 176.3826 97 V 4.0088 8.8867 125.2153 61.9590 33.2801 175.2114 98 S 4.9726 8.4306 122.5190 57.6766 64.3330 172.7580 99 I 4.8740 9.1913 127.7923 59.8474 42.1124 174.1710 100 E 5.1775 8.7448 122.7486 54.8276 32.7792 174.7618 101 D 4.9953 9.0788 123.1315 52.5898 44.9699 175.6933 102 S 4.7012 8.8993 117.4995 58.1915 64.0970 174.9493 103 V 3.8588 8.8935 122.1165 65.3937 31.5925 176.2553 104 I 4.1107 7.8261 111.0036 60.9263 38.6291 173.9140 105 S 4.5606 8.0180 112.4604 58.3346 64.5969 174.7659 106 L 4.4498 9.5295 123.2287 53.8520 41.6110 176.6408 107 S 4.4456 7.8626 110.3211 58.9220 66.1638 177.5804 108 G 3.8069 8.1659 109.4204 44.9537 0.0000 172.9640 109 D 4.4143 8.9120 118.1363 58.2131 40.7342 177.7565 110 H 4.9663 7.9840 112.3923 55.7888 28.7125 174.8325 111 C 4.2206 8.0243 121.0296 60.2080 31.6328 173.6290 112 I 4.0014 8.2578 119.4541 60.7552 38.1922 175.6035 113 I 3.6954 7.3098 123.3388 62.9274 37.1680 176.0338 114 G 3.8814 9.3697 114.3850 44.9194 0.0000 172.5277 115 R 4.7803 7.5937 118.9487 54.5811 33.9141 174.4424 116 T 5.0564 7.9799 115.5205 62.0963 71.6598 173.4214 117 L 4.9112 8.6194 127.7924 53.6184 44.1053 175.2509 118 V 4.9206 8.9764 126.2070 60.9045 35.2596 174.4654 119 V 4.9022 8.4769 126.4284 60.4167 33.3329 175.1082 120 H 4.9959 9.2398 123.5309 55.0458 29.6025 175.8897 121 E 4.1591 9.4841 121.4316 59.5166 29.7863 177.3599 122 K 4.5676 8.3243 118.1360 54.7604 34.7184 175.5237 123 A 4.6608 8.3140 122.7562 51.9020 19.3987 176.6065 124 D 4.8070 10.4456 121.8710 53.1196 42.4925 175.7907 125 D 4.7351 8.9215 125.8946 53.8267 40.1314 176.5896 126 L 3.4854 9.0683 116.1247 55.9991 40.4734 173.9896 127 G 4.5352 8.8626 105.9980 45.9413 0.0000 174.4553 128 K 4.5623 8.4147 114.5831 56.1007 36.3821 178.8879 129 G 3.7199 7.6083 107.5712 46.4732 0.0000 173.7138 130 G 4.3104 8.7964 113.0754 45.6530 0.0000 174.4637 131 N 4.6416 7.6575 115.1657 51.6859 38.4391 175.1291 132 E 4.0458 8.6500 118.5847 59.3506 29.6915 178.2403 133 E 3.9753 8.1529 118.9302 59.0809 29.2951 178.5338 134 S 4.1787 8.8699 114.1121 61.1736 62.4092 175.7509 135 T 4.1631 7.9111 111.5375 63.5013 68.4384 175.0905 136 K 4.3643 7.8249 118.8841 57.7385 34.4178 177.4694 137 T 4.0375 8.1135 109.1867 61.3896 69.4658 176.4814 138 G 3.7625 7.8875 109.1607 45.0443 0.0000 173.0561 139 N 4.0524 8.1836 114.6342 53.9007 36.7760 176.0222 140 A 4.1157 7.5450 120.1489 52.9988 19.1356 179.9746 141 G 4.1156 7.4039 103.8443 44.7130 0.0000 173.2597 142 S 4.5254 7.9263 113.7747 58.2203 65.1336 173.6611 143 R 4.5489 8.2944 119.3087 55.1053 30.3298 176.7109 144 L 4.3308 8.8015 125.4799 57.3344 43.1002 177.1256 145 A 5.1442 7.7215 118.0471 51.1029 22.8189 174.0513 146 C 5.6453 8.5032 114.0957 54.7432 47.2528 172.7007 147 G 4.5765 8.1210 102.7837 46.2630 0.0000 172.5425 148 V 4.5158 8.3176 121.8235 61.7607 32.8878 175.4911 149 I 4.1129 8.7972 129.7793 61.0949 38.0854 175.4536 150 G 4.4373 9.0108 114.3434 43.8797 0.0000 171.9381 151 I 4.3882 8.2605 120.8078 61.0369 37.6329 175.7218 152 A 4.8086 8.7292 128.4266 49.6880 22.0241 176.3290 153 Q 4.0700 8.4956 118.7697 56.4466 29.2140 175.9915 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 A 8.25 4.36 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 2 T 7.81 3.91 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 3 K 9.14 5.17 0.00 1.75 1.86 0.00 1.88 0.00 0.00 1.97 0.00 0.00 3.18 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.55 1.64 7.81 4 A 9.06 5.40 1.12 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 0.00 0.00 5 V 8.58 4.95 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 0.75 0.00 0.00 0.94 0.00 0.00 6 C 8.94 4.95 0.00 3.10 2.94 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 7 V 8.46 4.65 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 0.94 0.00 0.00 0.92 0.00 0.00 8 L 9.10 4.76 0.00 1.69 1.59 1.04 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 9 K 9.23 4.93 0.00 1.64 1.63 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.36 1.40 7.81 10 G 7.89 4.70 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 0.00 11 D 8.83 4.49 0.00 2.68 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 12 G 7.72 3.95 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 0.00 0.00 0.00 13 P 0.00 4.56 0.00 2.18 2.16 0.00 3.77 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.93 0.00 14 V 7.54 4.13 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 0.80 0.00 0.00 0.96 0.00 0.00 15 Q 8.00 5.17 0.00 2.16 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.45 0.00 0.00 0.00 0.00 0.00 2.47 2.15 0.00 16 G 8.03 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 0.00 0.00 0.00 0.00 17 I 7.94 5.07 1.82 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 1.20 1.17 0.83 0.00 0.00 18 I 8.64 4.66 1.83 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.21 0.42 0.00 0.00 19 N 8.62 4.96 0.00 1.44 1.48 0.00 0.00 6.36 5.76 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 20 F 8.79 5.38 0.00 2.89 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 21 E 9.52 4.97 0.00 2.51 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 0.00 2.32 2.41 0.00 22 Q 8.76 4.59 0.00 2.22 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.50 0.00 0.00 0.00 0.00 0.00 2.43 2.47 0.00 23 K 8.71 4.20 0.00 1.81 1.91 0.00 1.78 0.00 0.00 1.72 0.00 0.00 2.85 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.53 7.81 24 E 7.35 4.72 0.00 2.19 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 2.25 2.23 0.00 25 S 8.09 3.88 0.00 3.85 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 26 N 7.79 4.95 0.00 2.65 2.70 0.00 0.00 6.93 7.98 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 27 G 8.47 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 28 P 0.00 4.62 0.00 2.13 2.02 0.00 3.58 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 2.13 2.11 0.00 29 V 8.81 4.92 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 1.30 0.00 0.00 1.03 0.00 0.00 30 K 9.39 4.84 0.00 1.97 1.87 0.00 1.76 0.00 0.00 1.41 0.00 0.00 2.93 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.59 1.44 7.81 31 V 9.81 5.07 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 1.01 0.00 0.00 1.11 0.00 0.00 32 W 8.49 6.15 0.00 3.47 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 33 G 7.53 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 S 7.77 5.13 0.00 3.86 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 I 8.63 4.86 1.82 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.61 0.91 0.00 0.00 36 K 9.09 4.73 0.00 1.81 1.91 0.00 1.34 0.00 0.00 1.65 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.36 7.81 37 G 8.87 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 38 L 7.50 4.45 0.00 1.69 1.44 0.83 0.36 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 39 T 8.32 4.27 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 1.24 0.00 0.00 40 E 8.81 4.06 0.00 2.03 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 2.30 2.63 0.00 41 G 7.75 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 L 8.04 4.98 0.00 1.51 1.58 0.91 0.97 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 43 H 8.84 5.08 0.00 3.06 3.32 0.00 5.64 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 9.18 4.13 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 0.00 45 F 8.93 5.49 0.00 2.98 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 46 H 8.96 5.36 0.00 3.12 2.89 0.00 5.83 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 V 8.46 4.62 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 0.96 0.00 0.00 0.90 0.00 0.00 48 H 9.55 4.97 0.00 3.07 3.44 0.00 5.71 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.90 3.56 0.00 1.65 1.12 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 1.47 1.99 0.00 50 F 7.96 4.99 0.00 3.29 2.83 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 51 G 8.47 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 0.00 0.00 0.00 0.00 52 D 8.01 4.66 0.00 2.58 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 N 8.75 5.13 0.00 2.70 2.75 0.00 0.00 7.37 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 54 T 8.59 3.93 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 1.20 0.00 0.00 55 A 7.91 4.67 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 56 G 7.64 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 57 C 8.53 4.63 0.00 2.97 3.06 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 58 T 7.71 3.81 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 1.23 0.00 0.00 59 S 7.99 4.50 0.00 3.97 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 60 A 7.42 4.44 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 61 G 7.74 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 62 P 0.00 4.60 0.00 2.04 2.18 0.00 3.64 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.96 0.00 63 H 8.36 4.39 0.00 2.90 3.19 0.00 5.73 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 F 9.24 4.31 0.00 3.02 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 65 N 8.42 5.17 0.00 2.61 2.45 0.00 0.00 6.91 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 66 P 0.00 4.59 0.00 2.05 1.76 0.00 3.08 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.09 0.00 67 L 7.44 4.62 0.00 1.59 1.58 0.87 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 68 S 7.73 3.55 0.00 3.96 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 69 R 7.62 4.35 0.00 1.83 1.92 0.00 3.11 0.00 0.00 3.43 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.85 0.00 70 K 8.35 4.41 0.00 1.68 1.81 0.00 1.67 0.00 0.00 1.74 0.00 0.00 2.75 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.51 1.43 7.81 71 H 8.89 3.96 0.00 3.15 3.28 0.00 5.99 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 72 G 7.89 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 0.00 0.00 0.00 0.00 73 G 8.43 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 0.00 0.00 0.00 74 P 0.00 4.51 0.00 2.23 2.18 0.00 3.34 0.00 0.00 4.45 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 75 K 7.91 4.48 0.00 1.73 1.83 0.00 1.77 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.35 1.37 7.81 76 D 7.85 4.70 0.00 2.74 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 77 E 8.62 4.06 0.00 1.89 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 2.26 2.34 0.00 78 E 7.77 4.50 0.00 1.97 1.83 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 2.23 2.40 0.00 79 R 7.69 5.02 0.00 1.73 1.79 0.00 2.88 0.00 0.00 2.25 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.42 0.00 80 H 9.64 4.71 0.00 3.45 3.36 0.00 5.65 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.39 3.46 1.49 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 0.71 0.00 0.00 0.46 0.00 0.00 82 G 8.30 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 D 8.15 4.71 0.00 2.81 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 84 L 8.58 4.71 0.00 2.01 1.94 0.96 0.98 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 85 G 7.97 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 0.00 0.00 0.00 0.00 86 N 8.65 5.61 0.00 2.57 2.68 0.00 0.00 6.57 7.68 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 87 V 8.39 4.41 1.77 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 -0.15 0.00 0.00 0.76 0.00 0.00 88 T 8.19 4.99 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 1.20 0.00 0.00 89 A 8.70 4.83 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 90 D 9.01 4.86 0.00 2.81 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 K 8.49 4.24 0.00 1.89 2.11 0.00 1.56 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.40 1.45 7.81 92 D 8.84 4.61 0.00 2.97 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 93 A 7.74 4.38 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 94 V 7.61 4.87 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 0.94 0.00 0.00 0.99 0.00 0.00 95 A 8.85 5.50 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 96 D 8.65 4.91 0.00 2.56 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 V 8.89 4.01 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 0.80 0.00 0.00 0.56 0.00 0.00 98 S 8.43 4.97 0.00 3.89 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 I 9.19 4.87 1.96 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 1.26 0.70 1.01 0.00 0.00 100 E 8.74 5.18 0.00 1.82 1.85 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 2.25 2.30 0.00 101 D 9.08 5.00 0.00 2.79 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.90 4.70 0.00 4.02 3.95 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 0.00 103 V 8.89 3.86 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 0.73 0.00 0.00 0.94 0.00 0.00 104 I 7.83 4.11 1.94 0.00 0.00 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 1.59 0.81 1.05 0.00 0.00 105 S 8.02 4.56 0.00 3.87 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 0.00 106 L 9.53 4.45 0.00 1.67 1.62 1.04 0.68 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 0.00 107 S 7.86 4.45 0.00 3.93 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 0.00 108 G 8.17 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 0.00 109 D 8.91 4.41 0.00 2.52 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 0.00 110 H 7.98 4.97 0.00 3.17 3.34 0.00 5.74 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 C 8.02 4.22 0.00 3.15 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 0.00 112 I 8.26 4.00 1.67 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.14 1.03 0.00 0.00 113 I 7.31 3.70 1.78 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 1.19 0.39 0.84 0.00 0.00 114 G 9.37 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 0.00 115 R 7.59 4.78 0.00 1.69 1.83 0.00 2.23 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.25 0.00 116 T 7.98 5.06 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 1.25 0.00 0.00 117 L 8.62 4.91 0.00 1.75 1.51 0.44 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.98 4.92 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 0.73 0.00 0.00 0.73 0.00 0.00 119 V 8.48 4.90 2.29 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 0.83 0.00 0.00 1.00 0.00 0.00 120 H 9.24 5.00 0.00 3.13 3.64 0.00 5.66 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.48 4.16 0.00 1.98 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 2.37 2.34 0.00 122 K 8.32 4.57 0.00 1.81 1.74 0.00 1.92 0.00 0.00 1.67 0.00 0.00 2.85 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.42 1.42 7.81 123 A 8.31 4.66 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 0.00 124 D 10.45 4.81 0.00 2.82 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 D 8.92 4.74 0.00 2.93 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 L 9.07 3.49 0.00 1.81 1.75 0.92 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.86 4.54 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 0.00 0.00 0.00 128 K 8.41 4.56 0.00 1.86 1.76 0.00 1.70 0.00 0.00 1.64 0.00 0.00 3.11 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.55 1.52 7.81 129 G 7.61 3.72 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 0.00 0.00 0.00 130 G 8.80 4.31 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 0.00 131 N 7.66 4.64 0.00 2.83 2.86 0.00 0.00 5.95 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 0.00 132 E 8.65 4.05 0.00 2.05 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 2.37 2.36 0.00 133 E 8.15 3.98 0.00 2.11 2.17 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 2.41 2.44 0.00 134 S 8.87 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 0.00 135 T 7.91 4.16 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 1.21 0.00 0.00 136 K 7.82 4.36 0.00 1.68 1.77 0.00 1.72 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.34 1.45 7.81 137 T 8.11 4.04 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 1.26 0.00 0.00 138 G 7.89 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 N 8.18 4.05 0.00 2.93 2.89 0.00 0.00 6.92 7.20 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 0.00 140 A 7.54 4.12 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 0.00 141 G 7.40 4.12 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 0.00 0.00 0.00 142 S 7.93 4.53 0.00 4.05 4.05 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 0.00 143 R 8.29 4.55 0.00 1.67 1.82 0.00 3.22 0.00 0.00 3.09 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.63 0.00 144 L 8.80 4.33 0.00 1.71 1.70 0.96 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 145 A 7.72 5.14 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 0.00 146 C 8.50 5.65 0.00 2.97 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 0.00 147 G 8.12 4.58 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 0.00 148 V 8.32 4.52 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.93 0.00 0.00 149 I 8.80 4.11 1.80 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.43 0.42 0.00 0.00 150 G 9.01 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 0.00 0.00 0.00 0.00 151 I 8.26 4.39 1.86 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 1.25 0.54 0.91 0.00 0.00 152 A 8.73 4.81 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 0.00 153 Q 8.50 4.07 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.78 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00