NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 T 4.1431 8.1749 117.3783 64.0466 69.7758 174.7742 3 T 3.2810 6.9645 118.9783 62.0750 64.6655 172.4564 4 F 4.7247 7.3834 122.5402 55.1923 41.0176 174.6065 5 R 4.3564 8.0960 115.7724 54.4380 32.3515 173.7852 6 F 5.3182 7.9774 115.9302 54.6902 42.5241 174.9779 7 C 3.8937 8.3297 115.7022 57.4054 31.1916 174.5538 8 R 3.8950 7.4785 117.8550 57.8212 29.5632 172.9760 9 D 4.4314 9.2518 117.9093 53.9808 39.4107 173.5164 10 C 4.5236 7.6443 127.0225 56.1609 30.5700 173.5981 11 N 4.9309 8.4403 124.3287 54.1297 37.5847 173.1275 12 N 4.8485 7.9940 125.5771 52.1054 43.0496 173.0542 13 M 3.7551 8.5184 119.9116 56.0363 33.5758 177.6853 14 L 5.5463 7.6327 123.7940 52.4275 42.9322 174.9015 15 Y 4.4396 8.5642 121.9383 56.7647 39.2944 173.2867 16 P 5.2958 0.0000 0.0000 63.1284 32.7019 175.4362 17 R 4.8760 9.5562 120.5739 54.5933 35.0486 173.3311 18 E 4.7823 8.6311 120.2670 54.5569 32.3589 175.9145 19 D 4.3337 9.2808 127.5135 52.8873 39.3856 176.7207 20 K 3.8872 8.1868 118.1356 59.4643 32.9846 177.4829 21 E 3.9665 7.7999 121.3451 59.9184 30.0223 178.5279 22 N 4.3794 8.3733 116.3496 54.2026 38.9412 173.6835 23 N 4.1584 8.6477 118.2532 51.9745 35.6927 173.0739 24 R 4.4264 7.1101 114.7128 55.0373 32.6228 173.9094 25 L 4.5483 7.9861 123.0769 54.9373 43.8705 175.5596 26 L 4.8516 8.8556 125.1330 52.9302 45.2813 175.9969 27 F 5.1739 8.5116 123.6624 57.3189 40.2656 174.3038 28 E 4.8399 9.3523 122.6584 55.7046 33.1728 173.9875 29 C 5.2532 8.7891 115.8416 59.1187 34.3791 173.9721 30 R 4.6485 8.8354 124.8535 56.5694 30.0771 176.4215 31 T 4.6379 9.0242 112.9427 61.2428 69.4892 174.1580 32 C 5.0280 7.4226 115.0327 58.5992 31.9129 172.5943 33 S 4.5046 8.2359 114.2110 59.7737 63.2746 173.8630 34 Y 3.9949 7.6811 120.3273 57.4228 39.2872 175.0733 35 V 4.5532 6.2083 123.6830 61.6839 35.1955 172.8766 36 E 4.8870 8.2113 116.0320 55.3032 32.5287 176.0564 37 E 4.3803 9.1017 124.0484 55.9006 30.7624 176.0671 38 A 3.1886 8.7356 127.0215 52.3035 18.0993 178.3978 39 G 3.7633 9.0453 112.2437 48.4954 0.0000 173.4320 40 S 4.6388 7.5488 111.2018 56.3341 65.0273 172.4523 41 P 4.4079 0.0000 0.0000 64.6547 31.4709 177.2267 42 L 4.3198 7.2512 121.0425 53.5315 40.1565 175.7324 43 V 3.9645 8.1606 122.6810 65.4119 31.9230 175.5356 44 Y 4.7424 7.0848 115.2769 57.1403 41.1312 172.3017 45 R 4.2141 8.6083 123.8675 54.7699 33.0214 173.4908 46 H 4.3229 8.1265 120.6224 55.5921 30.9090 171.4632 47 E 3.6427 7.9779 135.0000 55.9540 27.6244 174.0976 48 L 4.3134 8.4161 124.9389 57.1521 42.9947 178.5989 49 I 4.1607 7.3381 118.8691 59.8356 35.7903 175.8597 50 T 4.0810 7.4267 117.5596 64.5961 69.3617 174.7937 51 N 5.0629 8.4176 116.8975 53.2867 41.6240 173.9821 52 I 4.2632 7.6660 113.4306 61.6332 38.1381 175.3278 53 G 3.9162 9.5143 112.5832 44.9452 0.0000 174.8030 54 E 3.7578 7.9154 120.2538 59.4844 29.6180 178.6594 55 T 4.5133 7.5823 109.9626 62.4621 70.7270 173.2245 56 A 3.7252 7.8925 125.2377 52.1375 19.2812 175.6721 57 G 3.7952 8.9213 114.0458 45.8422 0.0000 173.8664 58 V 4.4592 7.6175 124.3795 61.3815 32.6627 173.6735 59 V 3.9153 7.7240 125.2912 61.9588 32.6859 175.8682 60 Q 4.1514 8.4139 120.4662 57.9713 28.8553 176.0170 61 D 4.5980 7.9959 116.1258 54.9756 41.0359 177.3479 62 I 3.6555 7.2323 120.6498 62.9485 38.0834 176.1082 63 G 4.1641 7.9990 106.8044 45.8553 0.0000 173.7695 64 S 4.5824 9.0947 114.3706 57.8663 64.4858 174.5783 65 D 4.6011 7.8226 121.8472 52.2410 39.3353 173.9032 66 P 4.2337 0.0000 0.0000 65.4451 31.5134 178.2646 67 T 3.9997 8.2085 108.2398 64.5527 68.3713 174.6400 68 L 4.0724 7.7863 121.2651 53.4771 42.1315 175.1087 69 P 4.7549 0.0000 0.0000 62.6993 33.4321 174.7168 70 R 5.0967 8.7153 117.9882 54.4034 33.3131 175.4091 71 S 4.7451 8.7614 118.4396 56.5092 65.9504 174.4139 72 D 4.9083 8.5405 119.2940 52.1615 40.2714 176.0418 73 R 4.1401 8.1312 119.2319 56.9168 30.5923 175.8239 74 E 4.8677 9.1169 121.9155 56.0138 29.5752 176.2535 75 C 2.4892 8.4967 120.1850 57.2069 29.7668 172.3824 76 P 4.0722 0.0000 0.0000 65.0707 30.3928 176.8103 77 K 4.0940 6.8263 114.9234 57.7140 33.9314 176.0638 78 C 4.2052 7.9641 113.3427 64.0931 30.4824 175.5247 79 H 4.2697 7.0117 113.7285 56.8684 25.5112 174.9780 80 S 4.5352 7.7542 117.5450 57.9367 64.6771 175.2084 81 R 5.4400 8.1977 117.4878 55.2897 31.5542 175.5089 82 E 4.5137 8.3481 118.8116 54.8302 32.6662 174.7643 83 N 5.6548 9.2566 120.9549 50.6128 43.8429 174.5203 84 V 4.9832 8.3081 118.9967 59.3522 34.1345 174.9659 85 F 5.1478 9.6345 121.3764 55.2319 40.3627 173.6660 86 F 4.5280 7.6463 111.5171 57.2169 40.6650 172.3993 87 Q 4.8685 8.5300 117.7717 53.7102 30.1873 175.7880 88 S 3.5612 8.2781 114.0840 59.0026 62.4497 174.9384 89 Q 3.5377 7.5968 125.9511 57.5543 28.6744 176.0631 90 Q 3.9586 7.0375 118.4842 55.9583 28.5594 177.2854 91 R 4.2119 8.2033 130.2955 55.9121 29.2569 177.7312 92 R 4.5344 7.4590 117.0166 54.3894 32.0029 178.2166 93 K 3.9909 8.8947 123.4490 59.7007 32.2960 177.7298 94 D 4.4535 8.3369 116.7984 56.5121 39.6108 176.2299 95 T 3.7797 7.6296 116.2583 61.5589 69.7011 172.8413 96 S 4.7452 8.2920 118.6008 57.5100 65.4494 173.5829 97 M 4.7665 8.2249 117.8326 54.7190 32.2433 176.3424 98 V 4.3042 7.7655 117.1330 61.8353 33.6437 174.6741 99 L 5.1676 8.1719 123.9007 54.0072 44.1731 175.6631 100 F 5.0995 9.1322 119.8024 56.0465 42.0693 174.2270 101 F 4.6970 9.0953 123.5550 55.5865 40.7568 175.2462 102 V 5.2215 7.5723 122.9098 60.1148 33.7024 174.2576 103 C 5.2684 8.9306 128.5438 59.9202 31.9274 174.0714 104 L 4.3797 9.5028 125.7832 55.3406 42.1091 177.5717 105 S 4.8649 8.4168 115.1806 56.5206 63.5637 175.3891 106 C 5.9399 8.7898 129.3190 58.4652 28.4013 172.6795 107 S 3.9003 7.8068 114.5286 58.9838 59.0946 168.2547 108 H 5.0170 7.8048 120.8434 54.6325 33.1373 173.9827 109 I 4.9806 8.3610 126.1083 59.4489 36.8248 173.8325 110 F 4.8947 8.7215 121.0593 55.2393 40.6138 175.8142 111 T 5.2255 8.6053 117.8351 61.4367 70.8974 174.2423 112 S 4.7288 8.3471 113.9561 58.2282 63.8990 173.8995 113 D 4.4832 8.0922 120.1897 55.1029 41.5282 176.2458 114 Q 4.8128 8.3933 125.8748 54.8904 29.7009 175.9247 115 K 4.6669 8.0781 114.3686 56.9935 38.6955 175.4655 116 N 5.1123 8.0638 113.9539 52.2609 42.6482 174.5133 117 K 4.0739 8.3230 117.2465 57.5095 33.1038 175.8439 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 T 8.17 4.14 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 1.19 0.00 0.00 3 T 6.96 3.28 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 1.18 0.00 0.00 4 F 7.38 4.72 0.00 2.82 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 5 R 8.10 4.36 0.00 1.75 1.81 0.00 3.05 0.00 0.00 3.48 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.66 0.00 6 F 7.98 5.32 0.00 2.76 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 7 C 8.33 3.89 0.00 1.67 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 8 R 7.48 3.89 0.00 1.84 2.02 0.00 3.29 0.00 0.00 3.60 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.46 0.00 9 D 9.25 4.43 0.00 2.87 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 10 C 7.64 4.52 0.00 3.02 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 11 N 8.44 4.93 0.00 2.78 2.83 0.00 0.00 7.12 7.79 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 12 N 7.99 4.85 0.00 2.62 2.60 0.00 0.00 6.66 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 13 M 8.52 3.76 0.00 1.38 1.51 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.80 0.00 14 L 7.63 5.55 0.00 1.37 1.65 0.97 1.02 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 15 Y 8.56 4.44 0.00 2.96 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 16 P 0.00 5.30 0.00 2.31 2.66 0.00 3.88 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 2.17 2.22 0.00 17 R 9.56 4.88 0.00 1.82 1.86 0.00 3.25 0.00 0.00 3.14 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 2.07 0.00 18 E 8.63 4.78 0.00 1.95 1.79 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 2.25 2.26 0.00 19 D 9.28 4.33 0.00 2.74 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 20 K 8.19 3.89 0.00 1.79 1.76 0.00 1.82 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.60 7.81 21 E 7.80 3.97 0.00 1.92 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 2.29 2.34 0.00 22 N 8.37 4.38 0.00 3.02 2.85 0.00 0.00 7.24 7.48 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 23 N 8.65 4.16 0.00 2.80 2.88 0.00 0.00 6.83 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 24 R 7.11 4.43 0.00 1.77 1.93 0.00 2.92 0.00 0.00 3.24 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.46 0.00 25 L 7.99 4.55 0.00 1.71 1.40 0.93 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 26 L 8.86 4.85 0.00 1.54 1.51 0.90 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 27 F 8.51 5.17 0.00 3.18 2.93 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 28 E 9.35 4.84 0.00 2.08 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 2.46 2.41 0.00 29 C 8.79 5.25 0.00 3.01 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 30 R 8.84 4.65 0.00 1.52 1.74 0.00 2.21 0.00 0.00 2.68 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.53 0.00 31 T 9.02 4.64 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 1.28 0.00 0.00 32 C 7.42 5.03 0.00 3.25 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 33 S 8.24 4.50 0.00 3.91 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 34 Y 7.68 3.99 0.00 2.99 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 35 V 6.21 4.55 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 0.84 0.00 0.00 0.98 0.00 0.00 36 E 8.21 4.89 0.00 2.10 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 2.49 2.34 0.00 37 E 9.10 4.38 0.00 1.95 1.86 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 2.26 2.27 0.00 38 A 8.74 3.19 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 G 9.05 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 40 S 7.55 4.64 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 41 P 0.00 4.41 0.00 2.23 2.17 0.00 3.84 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.96 0.00 42 L 7.25 4.32 0.00 1.69 1.71 0.94 0.94 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 43 V 8.16 3.96 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 1.03 0.00 0.00 1.12 0.00 0.00 44 Y 7.08 4.74 0.00 2.86 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 45 R 8.61 4.21 0.00 1.66 1.70 0.00 3.24 0.00 0.00 3.13 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.49 0.00 46 H 8.13 4.32 0.00 3.02 3.19 0.00 6.07 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 E 7.98 3.64 0.00 2.15 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 2.18 2.32 0.00 48 L 8.42 4.31 0.00 1.69 1.71 0.90 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 49 I 7.34 4.16 1.88 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 0.49 0.92 0.00 0.00 50 T 7.43 4.08 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 1.30 0.00 0.00 51 N 8.42 5.06 0.00 2.79 2.78 0.00 0.00 6.60 7.32 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 52 I 7.67 4.26 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.53 0.92 0.00 0.00 53 G 9.51 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 54 E 7.92 3.76 0.00 2.36 2.47 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 2.45 2.60 0.00 55 T 7.58 4.51 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 1.61 0.00 0.00 56 A 7.89 3.73 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 G 8.92 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 V 7.62 4.46 2.16 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 0.81 0.00 0.00 1.16 0.00 0.00 59 V 7.72 3.92 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 0.96 0.00 0.00 0.95 0.00 0.00 60 Q 8.41 4.15 0.00 2.05 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 6.87 0.00 0.00 0.00 0.00 0.00 2.34 2.45 0.00 61 D 8.00 4.60 0.00 2.77 2.69 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 0.00 0.00 0.00 0.00 62 I 7.23 3.66 2.10 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.81 0.98 0.00 0.00 63 G 8.00 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 0.00 0.00 0.00 64 S 9.09 4.58 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 65 D 7.82 4.60 0.00 2.72 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 66 P 0.00 4.23 0.00 2.22 2.20 0.00 3.79 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.99 0.00 67 T 8.21 4.00 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 68 L 7.79 4.07 0.00 1.83 1.66 0.98 1.32 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 69 P 0.00 4.75 0.00 2.18 2.04 0.00 3.57 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.34 0.00 70 R 8.72 5.10 0.00 1.72 1.86 0.00 3.34 0.00 0.00 3.43 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.57 0.00 71 S 8.76 4.75 0.00 3.75 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 72 D 8.54 4.91 0.00 2.84 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 73 R 8.13 4.14 0.00 1.78 1.91 0.00 2.35 0.00 0.00 3.05 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 74 E 9.12 4.87 0.00 1.95 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 2.20 2.08 0.00 75 C 8.50 2.49 0.00 2.61 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 76 P 0.00 4.07 0.00 1.99 2.07 0.00 3.27 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 1.98 1.77 0.00 77 K 6.83 4.09 0.00 1.53 1.54 0.00 1.49 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.21 1.15 7.81 78 C 7.96 4.21 0.00 3.06 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 79 H 7.01 4.27 0.00 3.20 3.58 0.00 5.70 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 S 7.75 4.54 0.00 3.81 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 81 R 8.20 5.44 0.00 1.71 1.89 0.00 3.34 0.00 0.00 3.29 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.45 0.00 82 E 8.35 4.51 0.00 1.89 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 2.29 2.32 0.00 83 N 9.26 5.65 0.00 2.76 2.71 0.00 0.00 6.33 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 84 V 8.31 4.98 2.09 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 1.06 0.00 0.00 0.97 0.00 0.00 85 F 9.63 5.15 0.00 2.45 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 0.00 0.00 0.00 86 F 7.65 4.53 0.00 2.81 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 87 Q 8.53 4.87 0.00 1.80 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.21 6.89 0.00 0.00 0.00 0.00 0.00 2.24 2.26 0.00 88 S 8.28 3.56 0.00 3.79 3.65 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 89 Q 7.60 3.54 0.00 2.06 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.81 0.00 0.00 0.00 0.00 0.00 1.70 2.18 0.00 90 Q 7.04 3.96 0.00 2.04 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.62 0.00 0.00 0.00 0.00 0.00 2.34 2.30 0.00 91 R 8.20 4.21 0.00 1.79 1.86 0.00 3.33 0.00 0.00 3.13 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.53 0.00 92 R 7.46 4.53 0.00 1.95 2.15 0.00 3.16 0.00 0.00 3.30 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.55 0.00 93 K 8.89 3.99 0.00 1.71 1.90 0.00 1.63 0.00 0.00 1.75 0.00 0.00 3.15 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.53 7.81 94 D 8.34 4.45 0.00 2.79 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 95 T 7.63 3.78 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 96 S 8.29 4.75 0.00 4.01 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 97 M 8.22 4.77 0.00 2.01 2.09 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 2.50 2.48 0.00 98 V 7.77 4.30 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 0.91 0.00 0.00 1.01 0.00 0.00 99 L 8.17 5.17 0.00 1.92 1.56 1.11 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 100 F 9.13 5.10 0.00 3.15 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 0.00 101 F 9.10 4.70 0.00 1.51 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 0.00 0.00 0.00 0.00 102 V 7.57 5.22 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 1.10 0.00 0.00 0.88 0.00 0.00 103 C 8.93 5.27 0.00 3.24 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 0.00 104 L 9.50 4.38 0.00 1.66 1.72 0.99 0.10 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 0.00 105 S 8.42 4.86 0.00 3.84 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 0.00 106 C 8.79 5.94 0.00 3.17 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 0.00 107 S 7.81 3.90 0.00 4.15 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 0.00 108 H 7.80 5.02 0.00 3.25 3.25 0.00 5.83 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 0.00 109 I 8.36 4.98 1.92 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.83 1.03 0.00 0.00 110 F 8.72 4.89 0.00 3.09 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 T 8.61 5.23 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 1.07 0.00 0.00 112 S 8.35 4.73 0.00 3.95 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 D 8.09 4.48 0.00 2.60 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 0.00 114 Q 8.39 4.81 0.00 2.05 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.60 0.00 0.00 0.00 0.00 0.00 2.25 2.53 0.00 115 K 8.08 4.67 0.00 1.85 1.79 0.00 1.71 0.00 0.00 1.72 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.35 1.47 7.81 116 N 8.06 5.11 0.00 2.67 2.70 0.00 0.00 6.82 7.49 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 0.00 117 K 8.32 4.07 0.00 1.69 1.63 0.00 1.77 0.00 0.00 1.74 0.00 0.00 2.84 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.34 1.41 7.81