NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 T 4.2766 8.1749 117.3748 63.0125 69.5341 176.7597 13 N 4.1996 9.3245 128.8360 53.5597 38.7343 173.1136 14 L 4.5303 9.1996 124.6734 54.8505 43.7130 175.9045 15 L 4.8450 8.1241 120.0984 53.0421 44.1089 176.2525 16 Y 4.3485 8.5326 122.5118 58.1948 39.8997 174.9060 17 T 3.9092 6.9566 117.0470 60.8592 70.1687 174.1803 18 R 3.8469 8.1695 126.0074 57.2540 30.0904 176.0639 19 N 4.1962 7.6661 117.5911 53.8733 38.4797 173.8350 20 D 4.2929 9.0411 125.3307 58.0585 41.6683 176.6352 21 V 3.2032 6.8573 115.7433 59.6932 32.7670 176.3153 22 S 4.2886 8.6336 122.5361 58.5101 64.9844 175.1731 23 D 4.4523 8.7148 123.6201 57.1247 40.4229 178.8600 24 S 4.0731 7.9543 113.9667 61.5791 62.5553 175.7956 25 E 4.0429 8.1644 121.0045 59.0433 29.2050 179.1977 26 K 3.9104 8.4062 119.2942 59.6806 32.0258 179.2338 27 K 4.0010 8.1005 117.6480 59.3888 31.9947 179.4366 28 A 3.9705 7.8057 120.7601 55.4440 18.4023 179.7826 29 T 3.7517 8.4798 114.4957 66.9590 68.6422 176.8189 30 V 3.6537 8.1541 120.4694 66.2622 31.2521 177.7438 31 E 3.9069 7.9962 118.8166 58.9006 29.3457 178.2276 32 L 3.9083 7.8831 120.3784 58.2133 42.1328 178.8759 33 L 3.9685 8.3308 118.9244 58.1240 41.8025 179.2892 34 N 4.4301 8.0597 116.0246 56.3194 38.4111 177.4985 35 R 3.9300 7.7327 119.9536 59.3957 30.2246 178.5789 36 Q 4.1016 7.7429 117.8212 58.8939 28.6544 178.5612 37 V 3.5488 8.1301 119.7196 66.1601 31.4848 178.0120 38 I 3.6876 7.6227 118.7822 64.4591 37.0109 177.9489 39 Q 3.9450 8.0178 120.0680 59.3854 28.7771 178.6302 40 F 3.8480 9.0551 118.7258 60.7230 39.1253 177.4777 41 I 3.7167 8.0946 119.5945 64.8225 36.9218 177.9699 42 D 4.3520 8.1641 118.5813 57.1149 41.0798 178.0420 43 L 3.8717 7.8704 121.2609 57.7109 42.0099 179.1721 44 S 4.1224 8.2261 114.8651 61.4028 63.0303 176.5151 45 L 3.9442 7.7638 122.3601 57.4094 41.3524 179.4861 46 I 3.4481 7.7892 119.7469 64.5096 36.8951 178.5627 47 T 3.7885 7.8232 116.4432 66.7167 68.3674 176.9315 48 K 3.2851 7.5303 119.5462 58.7685 31.6575 179.5529 49 Q 3.9323 7.3800 118.4293 58.8638 28.5012 178.6745 50 A 3.7487 7.4380 121.6684 55.0897 18.1521 178.7607 51 H 3.9454 7.8399 116.1068 59.6081 29.8757 177.1253 52 W 4.5877 7.6887 118.9048 59.3166 29.0738 177.4799 53 N 4.9433 7.9006 113.3032 52.4416 38.6962 175.2077 54 M 4.8147 7.2275 118.6525 55.2735 32.7200 175.6507 55 R 4.3963 9.0481 117.5295 55.9504 34.6461 173.8454 56 G 4.0233 8.7419 103.7777 43.9919 0.0000 172.7602 57 A 4.0224 8.5511 122.2842 53.6649 18.8189 177.0916 58 N 4.1651 8.9698 119.1617 54.6759 37.1445 176.0589 59 F 4.2159 7.5063 117.8398 60.3676 39.3473 175.5321 60 I 2.9867 7.8315 116.8812 64.1955 37.8017 177.8328 61 A 3.8183 7.7403 120.6176 55.1473 18.2475 179.6574 62 V 3.3194 7.3395 116.8796 65.9962 31.3548 177.5548 63 H 3.8415 8.0762 117.4941 59.4215 29.9726 176.7738 64 E 3.9087 7.9004 120.1031 59.3610 29.3726 178.6724 65 M 3.5642 7.8339 118.3357 58.6655 32.0075 178.3070 66 L 3.6231 7.5064 118.8441 57.6950 41.8251 179.1918 67 D 4.2281 7.7637 118.5448 56.9639 40.4789 179.1615 68 G 3.3963 7.4146 105.9528 47.6603 0.0000 175.8361 69 F 4.0560 7.2763 120.0145 60.1860 38.9054 177.4019 70 R 4.0006 8.2546 118.5030 59.8150 29.8963 178.5886 71 T 3.8573 7.8309 114.5943 66.7166 68.5308 176.4561 72 A 4.0979 7.9837 122.4893 54.9793 18.3730 179.0620 73 L 4.1980 8.7384 119.2979 58.9639 42.2112 179.5702 74 I 3.7816 8.2090 119.4646 64.2142 36.9649 178.3838 75 D 4.3435 8.0073 119.8723 57.5695 40.6090 178.4264 76 H 4.1196 8.2617 116.6887 58.6342 28.6327 177.2617 77 L 3.6569 8.0028 122.3569 58.4381 41.7614 178.6432 78 D 4.2712 8.1219 117.4935 57.7352 41.1504 178.3187 79 T 3.8257 7.9453 116.2005 66.6910 68.3493 176.7104 80 M 3.9201 8.2062 120.5800 58.1850 32.2070 178.4033 81 A 3.9350 8.0549 121.1323 55.5265 18.5931 179.6500 82 E 3.9974 8.4137 116.7082 59.0742 29.2291 179.5468 83 R 3.8875 7.5157 117.9827 58.9646 30.3934 178.1290 84 A 4.0735 7.9290 120.7268 55.2899 18.4860 179.6472 85 V 3.8200 7.5023 117.5953 65.6982 31.2136 178.1872 86 Q 4.0241 7.8262 116.9646 58.6114 28.6022 177.8030 87 L 4.3989 7.5640 117.1855 54.6213 42.0840 177.8189 88 G 3.9201 8.2405 109.2046 45.0448 0.0000 174.7198 89 G 4.1663 7.5519 108.5262 44.5517 0.0000 172.0040 90 V 4.2637 8.0184 118.3798 60.5036 33.6136 175.7822 91 A 4.1426 8.7085 130.9212 52.1422 18.7209 176.1575 92 L 4.6541 9.4941 124.2761 53.2900 42.7289 176.9679 93 G 4.2109 8.4087 111.4249 44.7210 0.0000 172.6311 94 T 4.1965 7.8227 110.5015 61.0962 71.1160 174.8090 95 T 3.8828 8.5594 116.2370 65.6882 67.2847 176.1381 96 Q 3.9692 8.0117 119.5284 58.9533 28.8553 178.3501 97 V 3.6292 7.5330 117.7993 66.2613 31.4582 178.3003 98 I 3.6861 7.7891 119.3630 64.4655 36.9147 177.9273 99 N 4.4088 8.1523 116.0838 55.8454 38.8246 175.8454 100 S 4.5521 7.8130 112.4599 59.1365 62.9652 174.1598 101 K 4.5715 7.6449 116.7888 55.6107 33.9319 176.2680 102 T 3.9725 8.0248 115.1920 61.6588 67.6120 171.9166 103 P 4.6581 0.0000 0.0000 62.6287 31.7884 175.0452 104 L 4.5538 7.5056 119.7386 52.9040 42.8264 176.5147 105 K 4.0079 8.9061 123.5962 57.0239 32.3145 176.2935 106 S 3.9013 8.2760 117.5284 57.3150 63.4958 172.8218 107 Y 4.2216 8.7134 128.9036 55.8017 39.3800 172.7076 108 P 4.2627 0.0000 0.0000 63.7032 31.3920 175.6645 109 L 4.7611 8.5666 122.4345 54.6057 41.6807 176.7270 110 D 4.8372 7.8336 116.8949 52.4324 40.8203 175.9380 111 I 3.9779 7.5282 113.1109 61.2843 38.5486 175.2008 112 H 4.9793 8.4929 115.6261 56.4282 32.3454 173.8204 113 N 4.8223 8.0710 116.3923 53.4049 40.6772 175.4870 114 V 3.6733 8.3259 126.0522 66.5515 31.8228 178.6305 115 Q 4.1525 8.1828 117.0979 58.9925 28.4944 178.6347 116 D 4.2844 7.9396 119.3937 57.7468 40.9452 178.1490 117 H 4.4655 8.0434 117.7281 58.3145 28.6967 177.5811 118 L 4.0872 8.4179 121.0855 58.0543 41.5210 179.9263 119 K 3.9727 8.0041 117.8470 59.5060 32.0701 179.2901 120 E 3.9504 8.2778 118.7964 59.3322 29.3234 179.4610 121 L 4.2234 9.0315 119.5346 57.9466 41.6900 179.0951 122 A 4.0180 8.6309 121.1945 55.6131 18.1867 179.3710 123 D 4.3191 8.1910 116.8978 57.6981 41.0725 179.1348 124 R 3.9652 7.9778 117.8466 59.6463 30.1079 178.8354 125 Y 3.7210 8.9650 116.5296 60.8191 37.8530 178.3478 126 A 3.9994 8.4215 122.0127 55.3650 18.3934 179.3947 127 I 3.5775 7.8360 118.1122 64.7571 37.1484 178.6653 128 V 3.4169 7.6341 118.1543 65.8803 31.3022 177.8210 129 A 3.8639 8.4469 120.6088 55.4218 18.1526 179.2857 130 N 4.2464 8.6711 115.0223 56.4384 38.5948 177.1443 131 D 4.3072 8.3787 119.8036 57.4243 41.2248 178.6350 132 V 4.1647 7.7804 120.0869 64.3682 30.9863 177.8767 133 R 3.9908 8.1625 119.2969 59.1713 29.6135 178.6354 134 K 4.0670 7.8768 118.2111 58.9809 31.9225 179.0934 135 A 3.8740 8.1048 120.9176 54.4908 18.1801 179.6765 136 I 3.6539 7.4409 118.1777 64.6624 37.2338 178.6317 137 G 3.7402 7.4139 106.2688 47.1759 0.0000 173.9166 138 E 4.0689 7.6494 119.3655 56.7860 30.0150 175.6924 139 A 4.4945 7.3739 121.6555 51.3123 19.8025 177.3296 140 K 4.0084 8.7618 123.4122 59.4582 32.5705 177.9394 141 D 4.3298 8.0035 119.3514 54.2626 41.8829 175.8136 142 D 4.3713 8.8236 127.4843 57.7927 40.9348 178.4785 143 D 4.3535 8.1795 118.3454 58.0068 40.9482 179.0420 144 T 3.8252 7.7861 115.2541 66.5511 68.2758 176.6112 145 A 3.9870 8.3564 123.1933 54.8861 18.3146 179.1150 146 D 4.2124 8.1848 116.5723 57.5691 41.3551 178.3149 147 I 3.6545 7.7701 120.2382 64.7008 37.1805 178.3910 148 L 3.9676 7.9304 119.3791 57.9780 41.3029 179.8514 149 T 3.7854 8.1101 115.7492 66.4373 68.2839 176.3623 150 A 3.9421 8.1276 122.5710 55.3230 18.4301 179.6036 151 A 3.3178 7.8532 119.0740 54.9559 18.3407 179.7864 152 S 3.9334 8.4957 111.9533 61.6031 62.0049 176.0446 153 R 3.7827 8.4997 121.7791 59.8844 29.5977 178.1147 154 D 4.0152 7.6590 118.3844 57.1043 40.8014 178.7426 155 L 3.6311 7.5567 119.4328 57.7619 41.5606 179.3417 156 D 4.4552 8.1520 118.9777 56.9909 40.6589 178.8286 157 K 4.0534 7.4800 119.4064 59.4560 32.2475 179.0108 158 F 3.9824 8.2413 118.4957 60.3338 38.7213 177.0866 159 L 3.8630 8.3081 120.4372 58.1612 41.7120 178.7856 160 W 4.4082 8.2242 127.9160 60.7009 30.3749 177.9109 161 F 4.0608 7.8036 116.4218 60.4958 38.7157 177.3967 162 I 3.8640 8.2731 119.7412 64.6090 36.9570 178.2134 163 E 4.0190 8.6010 119.6226 59.7254 29.1629 179.5645 164 S 4.3470 8.2976 113.4666 60.4443 62.9296 175.2398 165 N 4.7876 7.7265 117.5240 52.1695 38.9939 174.9297 166 I 4.1212 7.1061 122.8195 60.5041 37.5863 175.8871 167 E 4.1398 9.6387 125.0019 56.8776 29.2401 176.9568 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 12 T 8.17 4.28 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 13 N 9.32 4.20 0.00 2.80 2.79 0.00 0.00 6.83 6.97 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 14 L 9.20 4.53 0.00 1.55 1.62 0.96 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 15 L 8.12 4.84 0.00 1.50 1.59 0.98 0.72 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 16 Y 8.53 4.35 0.00 2.97 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 17 T 6.96 3.91 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 1.05 0.00 0.00 18 R 8.17 3.85 0.00 1.76 1.92 0.00 3.26 0.00 0.00 3.16 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.53 0.00 19 N 7.67 4.20 0.00 2.62 2.67 0.00 0.00 7.01 8.23 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 20 D 9.04 4.29 0.00 2.65 2.65 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 0.00 0.00 0.00 0.00 21 V 6.86 3.20 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.95 0.00 0.00 22 S 8.63 4.29 0.00 4.08 3.98 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 23 D 8.71 4.45 0.00 2.79 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 24 S 7.95 4.07 0.00 3.88 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 25 E 8.16 4.04 0.00 2.00 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 2.32 2.34 0.00 26 K 8.41 3.91 0.00 1.91 1.83 0.00 1.66 0.00 0.00 1.85 0.00 0.00 2.89 0.00 0.00 3.27 0.00 0.00 0.00 0.00 1.44 1.78 7.81 27 K 8.10 4.00 0.00 1.82 1.86 0.00 1.67 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.65 7.81 28 A 7.81 3.97 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 29 T 8.48 3.75 4.37 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 1.19 0.00 0.00 30 V 8.15 3.65 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 0.98 0.00 0.00 0.97 0.00 0.00 31 E 8.00 3.91 0.00 2.20 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 2.45 0.00 32 L 7.88 3.91 0.00 1.79 1.80 0.96 0.54 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 33 L 8.33 3.97 0.00 1.64 1.65 0.90 0.64 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 34 N 8.06 4.43 0.00 2.93 2.89 0.00 0.00 6.76 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 35 R 7.73 3.93 0.00 2.01 2.07 0.00 3.11 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 36 Q 7.74 4.10 0.00 2.18 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.53 0.00 0.00 0.00 0.00 0.00 2.57 2.50 0.00 37 V 8.13 3.55 2.21 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 1.10 0.00 0.00 0.86 0.00 0.00 38 I 7.62 3.69 2.06 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.77 0.93 0.00 0.00 39 Q 8.02 3.95 0.00 2.30 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.81 0.00 0.00 0.00 0.00 0.00 2.24 2.37 0.00 40 F 9.06 3.85 0.00 3.10 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 I 8.09 3.72 2.11 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 1.45 1.24 0.94 0.00 0.00 42 D 8.16 4.35 0.00 2.93 2.75 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 43 L 7.87 3.87 0.00 1.61 1.49 0.44 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 44 S 8.23 4.12 0.00 4.09 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 45 L 7.76 3.94 0.00 1.88 1.76 0.95 0.77 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 46 I 7.79 3.45 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 1.51 0.89 0.73 0.00 0.00 47 T 7.82 3.79 4.36 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 1.25 0.00 0.00 48 K 7.53 3.29 0.00 1.32 0.74 0.00 1.18 0.00 0.00 1.05 0.00 0.00 2.73 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.15 1.40 7.81 49 Q 7.38 3.93 0.00 1.90 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.46 2.54 0.00 50 A 7.44 3.75 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 H 7.84 3.95 0.00 2.86 2.90 0.00 5.95 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 52 W 7.69 4.59 0.00 3.56 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 53 N 7.90 4.94 0.00 2.90 3.02 0.00 0.00 7.09 8.75 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 54 M 7.23 4.81 0.00 2.12 2.24 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 2.98 2.81 0.00 55 R 9.05 4.40 0.00 1.84 1.69 0.00 3.02 0.00 0.00 3.06 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.58 0.00 56 G 8.74 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 57 A 8.55 4.02 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 58 N 8.97 4.17 0.00 2.92 2.85 0.00 0.00 6.84 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 59 F 7.51 4.22 0.00 3.22 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 60 I 7.83 2.99 1.91 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 1.54 0.94 0.87 0.00 0.00 61 A 7.74 3.82 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 V 7.34 3.32 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 0.90 0.00 0.00 0.86 0.00 0.00 63 H 8.08 3.84 0.00 2.07 2.80 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 64 E 7.90 3.91 0.00 1.88 1.82 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 2.25 2.36 0.00 65 M 7.83 3.56 0.00 1.81 1.79 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.42 0.00 66 L 7.51 3.62 0.00 1.68 1.54 0.88 1.09 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 67 D 7.76 4.23 0.00 2.70 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 68 G 7.41 3.40 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 69 F 7.28 4.06 0.00 3.11 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 70 R 8.25 4.00 0.00 1.82 2.02 0.00 3.00 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 1.64 1.66 0.00 71 T 7.83 3.86 4.42 0.00 0.00 0.00 0.00 0.00 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 72 A 7.98 4.10 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 L 8.74 4.20 0.00 2.15 1.87 1.03 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 74 I 8.21 3.78 1.91 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.97 0.93 0.00 0.00 75 D 8.01 4.34 0.00 2.81 2.65 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 0.00 0.00 0.00 0.00 76 H 8.26 4.12 0.00 3.33 3.10 0.00 5.64 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 L 8.00 3.66 0.00 1.89 1.84 0.98 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 78 D 8.12 4.27 0.00 2.84 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 79 T 7.95 3.83 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 1.18 0.00 0.00 80 M 8.21 3.92 0.00 1.90 2.01 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.38 0.00 81 A 8.05 3.94 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 82 E 8.41 4.00 0.00 2.05 1.99 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 2.31 2.38 0.00 83 R 7.52 3.89 0.00 1.87 2.10 0.00 3.28 0.00 0.00 3.20 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 84 A 7.93 4.07 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 85 V 7.50 3.82 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 1.15 0.00 0.00 0.98 0.00 0.00 86 Q 7.83 4.02 0.00 2.20 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.92 0.00 0.00 0.00 0.00 0.00 2.37 2.48 0.00 87 L 7.56 4.40 0.00 1.72 1.66 0.90 0.82 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 88 G 8.24 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 89 G 7.55 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 0.00 0.00 0.00 90 V 8.02 4.26 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.93 0.00 0.00 91 A 8.71 4.14 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 92 L 9.49 4.65 0.00 1.68 1.61 0.92 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 93 G 8.41 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 94 T 7.82 4.20 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 95 T 8.56 3.88 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 1.23 0.00 0.00 96 Q 8.01 3.97 0.00 2.11 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.62 0.00 0.00 0.00 0.00 0.00 2.46 2.37 0.00 97 V 7.53 3.63 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 1.04 0.00 0.00 0.94 0.00 0.00 98 I 7.79 3.69 2.03 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 1.71 0.84 0.93 0.00 0.00 99 N 8.15 4.41 0.00 2.75 3.04 0.00 0.00 7.24 7.06 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 0.00 100 S 7.81 4.55 0.00 3.95 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 0.00 101 K 7.64 4.57 0.00 1.86 1.76 0.00 1.77 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.36 1.34 7.81 102 T 8.02 3.97 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 1.26 0.00 0.00 103 P 0.00 4.66 0.00 2.21 2.12 0.00 3.80 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 1.93 1.97 0.00 104 L 7.51 4.55 0.00 1.87 1.66 0.85 0.91 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 0.00 105 K 8.91 4.01 0.00 1.76 1.78 0.00 1.78 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.45 1.44 7.81 106 S 8.28 3.90 0.00 3.87 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 0.00 107 Y 8.71 4.22 0.00 3.04 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 0.00 108 P 0.00 4.26 0.00 2.06 1.93 0.00 2.91 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.62 0.00 109 L 8.57 4.76 0.00 1.71 1.80 0.98 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 110 D 7.83 4.84 0.00 2.73 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 0.00 111 I 7.53 3.98 1.71 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.26 0.79 0.00 0.00 112 H 8.49 4.98 0.00 3.19 3.33 0.00 5.63 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 N 8.07 4.82 0.00 2.86 2.90 0.00 0.00 6.84 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 0.00 114 V 8.33 3.67 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 1.02 0.00 0.00 1.19 0.00 0.00 115 Q 8.18 4.15 0.00 2.12 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.69 0.00 0.00 0.00 0.00 0.00 2.47 2.42 0.00 116 D 7.94 4.28 0.00 2.91 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 0.00 117 H 8.04 4.47 0.00 3.46 3.50 0.00 5.65 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 0.00 118 L 8.42 4.09 0.00 2.01 1.76 0.93 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 119 K 8.00 3.97 0.00 1.98 1.86 0.00 1.73 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.63 7.81 120 E 8.28 3.95 0.00 2.16 1.75 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 2.39 2.09 0.00 121 L 9.03 4.22 0.00 1.94 1.72 0.96 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 122 A 8.63 4.02 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.19 4.32 0.00 2.99 2.75 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 0.00 124 R 7.98 3.97 0.00 1.98 2.02 0.00 3.37 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.05 0.00 125 Y 8.96 3.72 0.00 3.11 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 0.00 126 A 8.42 4.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 I 7.84 3.58 2.02 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 1.40 0.87 0.89 0.00 0.00 128 V 7.63 3.42 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 0.53 0.00 0.00 0.71 0.00 0.00 129 A 8.45 3.86 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 0.00 130 N 8.67 4.25 0.00 2.76 2.87 0.00 0.00 6.76 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 0.00 131 D 8.38 4.31 0.00 2.77 2.80 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 0.00 132 V 7.78 4.16 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 1.24 0.00 0.00 1.05 0.00 0.00 133 R 8.16 3.99 0.00 1.99 2.09 0.00 3.05 0.00 0.00 3.27 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 134 K 7.88 4.07 0.00 1.93 1.83 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.66 7.81 135 A 8.10 3.87 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 0.00 136 I 7.44 3.65 1.95 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 1.21 1.22 0.89 0.00 0.00 137 G 7.41 3.74 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 0.00 0.00 0.00 138 E 7.65 4.07 0.00 2.01 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.24 0.00 139 A 7.37 4.49 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 0.00 140 K 8.76 4.01 0.00 1.79 1.95 0.00 1.75 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.41 7.81 141 D 8.00 4.33 0.00 2.72 2.54 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 0.00 142 D 8.82 4.37 0.00 2.71 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 0.00 143 D 8.18 4.35 0.00 2.85 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 0.00 144 T 7.79 3.83 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 1.18 0.00 0.00 145 A 8.36 3.99 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 0.00 146 D 8.18 4.21 0.00 2.89 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 I 7.77 3.65 1.99 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.70 0.84 0.00 0.00 148 L 7.93 3.97 0.00 1.83 1.69 0.95 0.45 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 0.00 149 T 8.11 3.79 4.34 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 1.18 0.00 0.00 150 A 8.13 3.94 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.85 3.32 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 S 8.50 3.93 0.00 3.87 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 0.00 153 R 8.50 3.78 0.00 2.00 2.02 0.00 3.11 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 154 D 7.66 4.02 0.00 2.59 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 0.00 0.00 0.00 155 L 7.56 3.63 0.00 1.65 1.55 0.48 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 156 D 8.15 4.46 0.00 2.63 2.66 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 0.00 0.00 0.00 0.00 157 K 7.48 4.05 0.00 1.91 1.88 0.00 1.69 0.00 0.00 1.80 0.00 0.00 3.05 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.09 1.49 7.81 158 F 8.24 3.98 0.00 2.82 1.71 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 0.00 159 L 8.31 3.86 0.00 1.85 1.96 1.01 1.02 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 0.00 160 W 8.22 4.41 0.00 3.43 3.46 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 0.00 161 F 7.80 4.06 0.00 3.29 3.02 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 0.00 162 I 8.27 3.86 1.93 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.02 0.90 0.00 0.00 163 E 8.60 4.02 0.00 2.29 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 0.00 2.38 2.53 0.00 164 S 8.30 4.35 0.00 3.76 3.85 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 0.00 165 N 7.73 4.79 0.00 2.79 2.80 0.00 0.00 7.00 7.38 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 0.00 166 I 7.11 4.12 2.05 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 1.31 0.67 0.97 0.00 0.00 167 E 9.64 4.14 0.00 1.92 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 2.35 2.41 0.00