NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3568 8.2493 123.5815 50.7337 21.0808 176.3661 2 K 4.2627 7.5168 112.2306 55.0824 35.3517 174.7391 3 K 4.3807 8.1937 122.7441 55.8337 34.6956 176.1427 4 V 4.4871 7.9340 122.0690 59.4987 34.3735 174.6718 5 Q 3.6844 8.1786 119.8027 55.2944 30.0782 176.2111 6 A 3.8047 9.0655 121.7258 53.9820 19.0278 177.1064 7 Y 3.3994 8.1695 122.2809 58.3666 36.6263 169.8425 8 V 4.2362 7.8150 117.4980 59.9409 34.2144 174.8248 9 K 4.9290 8.1551 120.4168 54.9581 35.9079 175.7936 10 L 4.4871 8.7708 123.0149 54.8937 44.3584 174.6185 11 Q 4.8867 8.6967 120.0061 54.4231 29.6173 175.0408 12 V 4.5320 7.9714 123.3087 59.1049 34.5775 175.2882 13 A 3.8663 8.7786 123.8948 52.4529 18.5702 176.4750 14 A 3.8895 8.3699 119.0019 53.3471 19.1112 179.2603 15 G 3.9161 7.3460 107.6255 41.0000 0.0000 172.1426 16 M 4.1161 7.4962 114.7050 55.4561 35.4095 173.5192 17 A 4.2709 8.5411 126.7470 52.2197 21.8523 174.0770 18 N 4.6082 9.5026 117.1593 53.6172 37.6697 173.3329 19 P 4.2457 0.0000 0.0000 62.9310 31.9917 176.6944 20 S 4.0072 8.6654 117.0981 61.1896 62.7475 173.5398 21 P 4.3862 0.0000 0.0000 65.3652 31.2779 176.1700 22 P 4.4428 0.0000 0.0000 65.2698 32.9684 177.3191 23 V 4.1965 7.6354 113.4670 61.5057 32.3703 181.0920 24 G 3.8509 9.3426 108.9010 45.2837 0.0000 173.2120 25 P 4.0810 0.0000 0.0000 65.8635 30.9668 176.0194 26 A 3.8550 7.7615 118.1471 55.2372 18.5686 178.8476 27 L 4.2540 7.5390 115.6053 56.5787 41.4585 178.8203 28 G 3.6214 8.0556 107.6118 47.8831 0.0000 175.6587 29 Q 3.9699 7.5290 119.4447 59.1242 28.8482 178.6588 30 Q 4.1323 7.5462 117.2330 57.4072 28.6317 177.4963 31 G 4.1161 7.3943 107.9045 45.4803 0.0000 173.9785 32 V 3.4046 7.3142 118.0235 62.0168 32.3176 176.5327 33 N 4.6869 8.0669 122.8130 52.0395 38.2502 175.9214 34 I 3.5920 8.2363 125.6798 64.8466 37.2776 177.0460 35 M 3.9338 8.1112 117.7319 59.0933 32.0468 177.6511 36 E 3.9678 8.4067 118.3661 59.6170 29.6960 178.3600 37 F 4.3545 8.5851 120.2546 61.5357 39.3870 176.1852 38 C 3.9525 8.3923 118.4533 62.8776 31.3434 176.0486 39 K 3.9702 7.9746 118.9165 59.1324 31.6869 179.2187 40 A 4.0741 8.5254 121.4688 55.6613 18.3700 179.0046 41 F 4.3951 8.7066 120.2529 61.4824 38.8836 176.7680 42 N 4.6323 8.5030 117.0325 54.8714 38.4756 177.3896 43 A 4.0284 7.6639 122.5088 55.2537 18.5317 179.7071 44 K 4.0282 7.5927 116.0410 58.8826 32.2605 179.5160 45 T 3.7746 7.5425 110.0239 64.0739 68.2025 176.2913 46 D 4.2826 7.2511 121.1351 57.4691 40.9048 177.9040 47 S 4.1718 7.7915 113.9011 61.4396 63.1145 174.8851 48 I 3.8546 7.1237 118.1727 59.9644 38.2898 174.8378 49 E 3.8537 8.7054 122.9659 56.9211 29.4034 177.5377 50 K 4.1435 8.4965 123.5920 57.1058 32.9683 177.7486 51 G 3.9539 8.9697 110.5712 45.0645 0.0000 172.7965 52 L 4.7841 7.4237 120.3953 51.8681 44.1479 173.7027 53 P 4.5448 0.0000 0.0000 63.2998 31.7497 175.3113 54 I 4.6003 7.9564 124.8674 58.2150 39.4898 173.1470 55 P 4.7999 0.0000 0.0000 62.6678 32.5993 175.3500 56 V 4.7410 8.8123 124.8018 59.6667 34.7695 174.7774 57 V 4.5490 8.0630 122.9207 61.3896 33.6377 174.1675 58 I 4.7277 7.8907 128.9725 60.0521 39.4452 174.7664 59 T 4.3327 8.6237 121.1340 60.2364 69.6155 173.0890 60 V 4.2240 8.2214 128.4944 61.8374 33.0969 174.3705 61 Y 4.9032 7.8042 122.5421 55.8292 40.4519 176.6554 62 A 4.1550 8.6750 122.6927 55.5015 18.4941 178.3326 63 D 4.4435 8.2022 114.0762 55.2537 41.4162 177.7683 64 R 4.1267 8.3810 116.3493 57.0658 29.2201 176.2426 65 S 4.7194 7.7801 113.4438 58.4240 63.6998 171.7883 66 F 5.0524 7.7326 113.8160 56.5190 39.7991 173.2191 67 T 5.0730 8.3856 109.0212 60.2040 72.4194 172.6415 68 F 5.7992 8.2469 116.1420 55.0663 41.1705 173.9569 69 V 4.2911 8.4815 114.2749 59.8823 33.8595 174.7363 70 T 4.5045 8.6457 121.7025 61.6118 67.3991 173.9587 71 K 4.5639 8.1032 134.3610 56.4440 32.8321 175.7772 72 T 4.6239 8.0367 117.8063 60.1263 69.2325 173.4245 73 P 4.4999 0.0000 0.0000 62.2409 31.9529 174.8286 74 P 4.3133 0.0000 0.0000 63.1249 33.1535 177.5177 75 A 4.0002 8.6091 122.0627 55.1184 18.3913 180.0401 76 A 3.9168 7.9678 118.8488 55.3648 18.6128 179.8337 77 V 3.5097 7.7323 116.0660 66.2701 31.7317 177.9244 78 L 4.0265 8.0459 118.6518 57.9580 41.4057 179.6529 79 L 4.0569 8.2490 119.0592 57.5702 41.4571 179.5837 80 K 4.0103 7.9794 118.5692 59.2878 31.9575 179.5647 81 K 3.9267 8.0390 118.2071 59.4652 31.8546 179.0980 82 A 3.9808 7.7798 119.3053 55.3759 18.4008 179.2670 83 A 4.3150 8.3995 117.7324 52.8604 18.5179 178.5576 84 G 3.7840 7.8409 105.0366 46.0651 0.0000 173.5728 85 I 4.3357 7.6872 113.3520 59.2856 39.6210 175.2823 86 K 4.3144 8.4935 118.3944 57.2523 33.3744 176.0661 87 S 4.8156 7.6043 110.1691 55.8870 66.5514 175.1400 88 G 4.1258 8.3760 114.7572 45.5792 0.0000 174.6059 89 S 4.5131 8.2216 113.7507 57.0728 64.0488 175.3871 90 G 4.0527 8.3341 113.7380 45.9326 0.0000 174.8371 91 K 4.5178 7.2291 120.1813 52.2210 31.9937 173.8476 92 P 4.3551 0.0000 0.0000 63.9276 32.4945 176.1101 93 N 4.8153 8.9201 121.3395 54.2039 37.5054 176.2258 94 K 4.0381 8.0122 117.2320 58.6415 32.5426 176.1826 95 D 4.7856 7.7385 116.9188 51.9174 43.3910 174.6218 96 K 5.1021 8.5566 125.4400 55.7455 33.7854 176.8057 97 V 4.1698 8.2800 115.2558 62.1897 33.4010 175.2995 98 G 4.3083 7.6351 106.3793 45.3397 0.0000 171.8425 99 K 5.3222 8.4005 117.7533 55.2997 36.0007 175.9214 100 I 4.9350 8.9437 122.1569 59.4607 41.5989 175.3943 101 S 5.0449 9.0739 120.9399 57.4736 63.3483 175.5823 102 R 3.9552 8.3780 121.2627 59.3744 29.7333 179.4685 103 A 4.3100 7.8091 121.6638 54.6077 18.4960 179.4315 104 Q 4.1935 7.8924 117.6903 58.6458 28.8347 178.9435 105 L 4.0474 7.9711 119.4072 58.1244 41.6088 179.5466 106 Q 4.1379 7.8192 116.7116 58.8881 28.0601 178.7068 107 E 4.0888 7.9823 119.2727 59.5007 29.4587 179.4580 108 I 3.7930 8.3216 120.1198 64.1995 37.1649 178.3758 109 A 3.9933 8.5372 122.1046 54.9188 17.9370 179.3783 110 Q 4.0010 7.8351 117.5788 59.2163 29.1576 178.0099 111 T 4.1215 7.4939 115.9740 66.2290 68.9047 176.6012 112 K 4.1928 8.4849 119.1805 57.6343 32.1062 178.8496 113 A 3.9481 7.7778 121.8655 55.4654 17.9831 179.3592 114 A 3.9694 8.0275 117.3219 54.9427 18.6028 178.5035 115 D 4.6605 8.1884 114.4924 53.8891 41.9214 176.5647 116 M 4.4791 6.9603 119.6488 54.3724 33.3274 176.1842 117 T 4.1720 8.4002 115.1918 62.0821 68.0588 175.0125 118 G 3.8180 8.1501 108.8978 46.9226 0.0000 173.3123 119 A 4.0964 8.8530 128.1610 54.3855 19.0516 177.1513 120 D 5.0772 7.6336 114.0345 50.7727 43.8400 176.6456 121 I 3.7273 8.2111 113.3666 64.1519 37.2859 177.9939 122 E 3.9157 8.2577 119.5342 59.1595 29.2946 178.8703 123 A 3.9822 8.9409 120.8401 55.6096 18.3820 179.5083 124 M 4.0041 7.8754 116.5932 58.8861 32.1110 179.1795 125 T 3.8831 8.2565 116.1481 66.7372 68.6504 176.7295 126 R 4.2379 8.0815 121.9119 58.9371 29.1460 178.4318 127 S 4.1382 8.4359 115.4636 61.9065 62.7323 176.7883 128 I 4.1604 7.6171 122.1802 63.9439 36.8441 178.1006 129 E 4.0532 8.1369 119.6284 59.4156 29.0325 179.6260 130 G 3.6376 8.1289 105.0928 47.5350 0.0000 175.5350 131 T 4.1257 7.3740 112.4270 64.3707 68.9133 176.9778 132 A 3.9917 8.1972 123.8708 55.1504 18.2833 179.8970 133 R 3.8756 8.0205 115.1184 59.0044 30.1555 178.7411 134 S 4.4324 7.5579 113.0089 59.8369 63.1175 175.0851 135 M 4.4974 8.2600 120.9899 54.2334 32.3356 176.8555 136 G 4.0338 7.8486 106.8432 46.7440 0.0000 172.5034 137 L 4.8550 7.7198 119.5392 52.6526 42.8366 176.8407 138 V 3.9261 8.3230 124.3984 62.6443 33.2205 175.0353 139 V 5.5393 8.4437 123.9810 60.1611 33.9819 174.1655 140 E 4.5789 8.6654 126.5265 54.5090 31.7055 175.7476 141 D 4.4586 8.6561 122.8784 54.3727 41.3820 175.5473 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 1.27 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 2 K 7.52 4.26 0.00 1.90 1.75 0.00 1.62 0.00 0.00 1.69 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.30 1.45 7.81 3 K 8.19 4.38 0.00 1.70 1.76 0.00 1.60 0.00 0.00 1.75 0.00 0.00 3.00 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.35 1.47 7.81 4 V 7.93 4.49 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 0.74 0.00 0.00 0.93 0.00 0.00 5 Q 8.18 3.68 0.00 2.44 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.52 0.00 0.00 0.00 0.00 0.00 2.33 2.41 0.00 6 A 9.07 3.80 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 7 Y 8.17 3.40 0.00 3.08 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 8 V 7.81 4.24 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 0.69 0.00 0.00 0.68 0.00 0.00 9 K 8.16 4.93 0.00 1.57 1.64 0.00 2.00 0.00 0.00 1.84 0.00 0.00 3.05 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.32 1.47 7.81 10 L 8.77 4.49 0.00 1.66 1.61 0.78 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 11 Q 8.70 4.89 0.00 1.93 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.81 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 12 V 7.97 4.53 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 0.32 0.00 0.00 0.95 0.00 0.00 13 A 8.78 3.87 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 14 A 8.37 3.89 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 15 G 7.35 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 16 M 7.50 4.12 0.00 1.94 1.91 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 17 A 8.54 4.27 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 18 N 9.50 4.61 0.00 2.75 3.25 0.00 0.00 6.97 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 P 0.00 4.25 0.00 2.20 1.98 0.00 3.65 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.10 0.00 20 S 8.67 4.01 0.00 3.81 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 21 P 0.00 4.39 0.00 2.07 2.09 0.00 3.73 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.11 0.00 22 P 0.00 4.44 0.00 2.03 2.09 0.00 3.66 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 2.02 2.06 0.00 23 V 7.64 4.20 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 0.97 0.00 0.00 0.92 0.00 0.00 24 G 9.34 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 0.00 0.00 0.00 25 P 0.00 4.08 0.00 2.13 2.12 0.00 3.96 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 2.10 2.16 0.00 26 A 7.76 3.85 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 27 L 7.54 4.25 0.00 1.54 1.63 0.27 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 28 G 8.06 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 Q 7.53 3.97 0.00 1.92 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.94 0.00 0.00 0.00 0.00 0.00 2.35 2.68 0.00 30 Q 7.55 4.13 0.00 1.96 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.37 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 31 G 7.39 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 32 V 7.31 3.40 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 -0.68 0.00 0.00 0.57 0.00 0.00 33 N 8.07 4.69 0.00 3.16 2.91 0.00 0.00 6.90 7.35 0.00 0.00 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 I 8.24 3.59 1.88 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.94 0.93 0.00 0.00 35 M 8.11 3.93 0.00 2.17 2.13 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.73 0.00 36 E 8.41 3.97 0.00 2.22 2.42 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 2.46 2.45 0.00 37 F 8.59 4.35 0.00 3.41 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 38 C 8.39 3.95 0.00 3.11 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 K 7.97 3.97 0.00 1.82 1.85 0.00 1.74 0.00 0.00 1.64 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.61 7.81 40 A 8.53 4.07 1.59 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 0.00 0.00 0.00 0.00 0.00 0.00 41 F 8.71 4.40 0.00 1.52 2.38 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 42 N 8.50 4.63 0.00 2.77 2.80 0.00 0.00 6.56 8.70 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 43 A 7.66 4.03 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 K 7.59 4.03 0.00 1.89 1.80 0.00 1.56 0.00 0.00 1.62 0.00 0.00 2.85 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.42 7.81 45 T 7.54 3.77 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 -0.07 0.00 0.00 46 D 7.25 4.28 0.00 2.84 2.73 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 0.00 0.00 0.00 47 S 7.79 4.17 0.00 3.94 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 48 I 7.12 3.85 1.83 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 1.29 0.74 0.90 0.00 0.00 49 E 8.71 3.85 0.00 1.99 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 2.33 2.32 0.00 50 K 8.50 4.14 0.00 1.73 1.71 0.00 1.75 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.39 1.40 7.81 51 G 8.97 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 52 L 7.42 4.78 0.00 1.61 1.60 0.93 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 53 P 0.00 4.54 0.00 2.11 2.13 0.00 3.75 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 54 I 7.96 4.60 1.96 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.31 1.18 0.00 0.00 55 P 0.00 4.80 0.00 2.19 2.22 0.00 3.84 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.00 0.00 56 V 8.81 4.74 2.41 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 0.55 0.00 0.00 1.36 0.00 0.00 57 V 8.06 4.55 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 0.61 0.00 0.00 0.96 0.00 0.00 58 I 7.89 4.73 1.44 0.00 0.00 -1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.30 0.66 0.00 0.00 59 T 8.62 4.33 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 1.23 0.00 0.00 60 V 8.22 4.22 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 0.92 0.00 0.00 0.69 0.00 0.00 61 Y 7.80 4.90 0.00 3.15 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 62 A 8.68 4.16 1.34 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 0.00 0.00 63 D 8.20 4.44 0.00 2.77 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 64 R 8.38 4.13 0.00 2.06 2.16 0.00 3.25 0.00 0.00 3.17 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.80 0.00 65 S 7.78 4.72 0.00 4.16 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 66 F 7.73 5.05 0.00 2.98 2.73 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 0.00 0.00 0.00 67 T 8.39 5.07 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 1.39 0.00 0.00 68 F 8.25 5.80 0.00 3.17 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 69 V 8.48 4.29 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 0.82 0.00 0.00 1.00 0.00 0.00 70 T 8.65 4.50 4.49 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 0.00 0.00 0.00 1.24 0.00 0.00 71 K 8.10 4.56 0.00 1.79 2.10 0.00 1.95 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.53 1.59 7.81 72 T 8.04 4.62 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 1.30 0.00 0.00 73 P 0.00 4.50 0.00 2.24 2.17 0.00 3.88 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.03 0.00 74 P 0.00 4.31 0.00 2.19 2.06 0.00 3.69 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.21 0.00 75 A 8.61 4.00 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 76 A 7.97 3.92 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 77 V 7.73 3.51 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 1.08 0.00 0.00 0.95 0.00 0.00 78 L 8.05 4.03 0.00 1.91 1.72 0.98 0.54 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 79 L 8.25 4.06 0.00 1.87 1.72 0.93 1.05 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 80 K 7.98 4.01 0.00 2.02 2.03 0.00 1.67 0.00 0.00 1.83 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.73 7.81 81 K 8.04 3.93 0.00 1.98 1.86 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.69 7.81 82 A 7.78 3.98 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.40 4.32 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 84 G 7.84 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 0.00 0.00 0.00 85 I 7.69 4.34 1.87 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 1.43 0.70 0.95 0.00 0.00 86 K 8.49 4.31 0.00 1.75 1.88 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.35 1.39 7.81 87 S 7.60 4.82 0.00 3.77 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 88 G 8.38 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 89 S 8.22 4.51 0.00 4.19 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 90 G 8.33 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 0.00 0.00 0.00 91 K 7.23 4.52 0.00 1.83 1.72 0.00 1.59 0.00 0.00 1.82 0.00 0.00 3.02 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.47 7.81 92 P 0.00 4.36 0.00 2.03 2.08 0.00 3.76 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.14 0.00 93 N 8.92 4.82 0.00 2.89 3.01 0.00 0.00 6.91 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 K 8.01 4.04 0.00 1.71 2.04 0.00 1.72 0.00 0.00 1.63 0.00 0.00 2.83 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.42 7.81 95 D 7.74 4.79 0.00 2.57 2.49 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 0.00 0.00 0.00 0.00 96 K 8.56 5.10 0.00 1.97 1.80 0.00 1.22 0.00 0.00 2.36 0.00 0.00 2.87 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.41 7.81 97 V 8.28 4.17 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 0.73 0.00 0.00 0.96 0.00 0.00 98 G 7.64 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 99 K 8.40 5.32 0.00 1.90 1.73 0.00 1.54 0.00 0.00 1.71 0.00 0.00 2.72 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.29 1.44 7.81 100 I 8.94 4.94 1.87 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 1.29 0.76 0.95 0.00 0.00 101 S 9.07 5.04 0.00 4.01 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 0.00 102 R 8.38 3.96 0.00 1.85 2.04 0.00 3.29 0.00 0.00 3.17 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.95 0.00 103 A 7.81 4.31 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 0.00 104 Q 7.89 4.19 0.00 2.30 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.71 0.00 0.00 0.00 0.00 0.00 2.38 2.27 0.00 105 L 7.97 4.05 0.00 1.83 1.73 0.92 0.99 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 0.00 106 Q 7.82 4.14 0.00 2.32 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.82 0.00 0.00 0.00 0.00 0.00 2.38 2.67 0.00 107 E 7.98 4.09 0.00 2.21 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 2.33 2.62 0.00 108 I 8.32 3.79 2.00 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 1.46 0.88 0.92 0.00 0.00 109 A 8.54 3.99 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 0.00 110 Q 7.84 4.00 0.00 2.18 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.93 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 111 T 7.49 4.12 4.39 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 1.22 0.00 0.00 112 K 8.48 4.19 0.00 1.77 1.86 0.00 1.74 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.64 1.61 7.81 113 A 7.78 3.95 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 0.00 114 A 8.03 3.97 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 0.00 115 D 8.19 4.66 0.00 2.66 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 0.00 116 M 6.96 4.48 0.00 1.96 1.99 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.47 0.00 117 T 8.40 4.17 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 0.00 118 G 8.15 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 A 8.85 4.10 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 0.00 120 D 7.63 5.08 0.00 3.01 2.76 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 0.00 121 I 8.21 3.73 1.87 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 1.64 1.43 0.91 0.00 0.00 122 E 8.26 3.92 0.00 2.33 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 2.40 2.45 0.00 123 A 8.94 3.98 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 0.00 124 M 7.88 4.00 0.00 2.12 2.14 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.60 0.00 125 T 8.26 3.88 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 1.28 0.00 0.00 126 R 8.08 4.24 0.00 2.01 2.04 0.00 3.16 0.00 0.00 3.27 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.53 0.00 127 S 8.44 4.14 0.00 4.08 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 0.00 128 I 7.62 4.16 2.01 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 1.53 0.86 0.92 0.00 0.00 129 E 8.14 4.05 0.00 2.23 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 2.33 2.57 0.00 130 G 8.13 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 0.00 0.00 0.00 131 T 7.37 4.13 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 0.00 132 A 8.20 3.99 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 0.00 133 R 8.02 3.88 0.00 1.79 2.02 0.00 3.16 0.00 0.00 3.23 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.96 0.00 134 S 7.56 4.43 0.00 4.01 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 0.00 135 M 8.26 4.50 0.00 2.03 2.18 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.53 0.00 136 G 7.85 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 0.00 0.00 0.00 137 L 7.72 4.85 0.00 1.63 1.63 0.93 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 138 V 8.32 3.93 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 0.84 0.00 0.00 0.93 0.00 0.00 139 V 8.44 5.54 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 1.00 0.00 0.00 0.97 0.00 0.00 140 E 8.67 4.58 0.00 2.04 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 0.00 2.28 2.23 0.00 141 D 8.66 4.46 0.00 2.64 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