NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.7544 8.3501 109.7348 44.1853 0.0000 174.1670 2 A 3.9688 7.8569 126.3017 52.6325 16.7887 177.1269 3 L 4.4021 7.6725 115.2848 56.1326 39.1876 172.8118 4 T 4.2321 8.9109 113.1269 60.8459 71.4487 175.4213 5 E 3.9457 8.6435 121.9069 59.2918 29.4377 179.0968 6 S 4.1619 7.9762 114.1533 61.4021 63.3529 176.3144 7 Q 3.9656 8.2030 121.5231 58.6362 28.4297 178.6251 8 A 3.9629 8.2405 121.6788 54.9301 18.3968 179.5470 9 A 4.0267 7.8060 119.5851 55.2452 18.4027 179.8922 10 L 4.0244 7.6940 117.5886 57.9854 41.6291 179.9101 11 V 3.8063 7.7822 119.6159 65.1339 31.3739 178.1008 12 K 4.2393 8.3078 119.6538 59.4834 32.2402 178.7384 13 S 4.1786 8.0888 113.2695 61.6090 62.1679 176.4266 14 S 4.3779 8.3856 116.8056 61.1053 62.7330 176.1097 15 W 4.4890 9.0830 132.6061 60.1962 30.1308 177.9736 16 E 3.4262 8.2054 118.2233 59.0883 28.6954 178.5682 17 E 4.0269 8.1021 118.3507 59.3389 29.4811 179.2196 18 F 3.8685 8.0246 120.5279 61.2603 39.2264 176.6165 19 N 4.0297 7.5540 114.3472 55.4480 38.6963 176.1719 20 A 3.9921 7.0165 120.4763 54.0396 19.8194 177.2763 21 N 4.6718 7.7845 115.9577 50.8547 39.7454 174.3747 22 I 3.2775 7.4293 125.2926 64.5368 37.6236 176.1851 23 P 4.2092 0.0000 0.0000 65.2648 31.1399 178.7504 24 K 3.8917 7.6272 117.9658 59.9611 32.2887 178.6311 25 H 4.2801 7.9723 116.9240 58.8602 28.6075 178.0163 26 T 4.1311 8.2076 112.2757 65.0280 68.7359 176.3842 27 H 4.3971 8.1819 121.3471 58.8761 29.8778 177.3037 28 R 3.8803 8.2323 120.7829 59.1810 29.9552 178.0544 29 F 4.2075 8.5648 120.6678 61.7044 39.4784 177.2548 30 F 3.7989 8.0287 116.6093 60.3082 38.5616 177.8467 31 I 3.7233 7.7833 119.7579 64.2486 37.0035 178.4282 32 L 3.9333 7.9199 119.9358 57.3995 41.3139 179.7088 33 V 3.3888 7.4472 118.2764 66.0791 31.3128 178.2379 34 L 4.3208 7.6118 116.7271 57.3623 41.4540 178.9909 35 E 4.1279 8.0705 118.4462 59.1479 29.4841 178.8122 36 I 4.1747 7.4871 118.4363 62.8408 38.3750 176.3920 37 A 4.5707 8.4087 123.9864 48.6517 20.0535 174.0768 38 P 4.2579 0.0000 0.0000 66.1239 31.7086 177.8717 39 A 4.0915 8.0826 118.3125 54.6408 18.4385 179.0499 40 A 4.1507 8.1079 119.4077 54.6093 18.3748 179.5116 41 K 3.9780 8.0071 118.5776 59.8562 32.0576 178.4854 42 D 4.4625 7.5602 116.5811 56.9623 40.6992 178.4467 43 L 4.0519 7.6235 118.8082 55.6302 41.8005 177.0031 44 F 4.2812 7.5538 118.8834 55.2903 38.3516 176.6242 45 S 4.0814 8.4872 121.6132 61.2140 62.6421 175.8913 46 F 4.5760 7.4895 112.6673 57.1741 38.4597 175.6831 47 L 4.4658 8.0782 121.9995 55.7088 43.0049 177.0016 48 K 4.0767 7.1371 116.5256 58.0519 32.1036 177.1033 49 G 3.9584 9.0316 113.1837 45.4094 0.0000 173.3426 50 T 4.2954 7.1588 108.9903 61.2895 70.1436 173.8268 51 S 4.5105 8.6299 113.5364 59.4048 63.9722 173.6366 52 E 4.6070 7.7112 117.0265 53.9869 31.4428 175.8424 53 V 3.6542 8.2159 121.2786 62.0491 31.5746 174.2054 54 P 4.3460 0.0000 0.0000 63.6401 31.3534 176.0451 55 Q 4.3734 8.5531 118.3708 56.6787 30.2610 175.5691 56 N 5.1253 7.7859 114.0981 52.0781 39.6268 174.5765 57 N 4.7843 7.7385 116.8084 51.4352 41.1883 172.2169 58 P 4.2872 0.0000 0.0000 65.5952 31.5793 178.5109 59 E 3.8259 8.0456 118.2347 59.1991 29.4485 178.4865 60 L 2.6522 7.3188 120.2068 58.0827 41.9741 179.1848 61 Q 4.0168 7.9902 117.5327 58.7793 28.4978 178.5371 62 A 4.0488 7.9929 121.9158 55.4649 18.3071 178.6683 63 H 4.1431 8.4494 116.4851 59.9244 29.9265 177.2534 64 A 4.3029 8.9281 122.5456 55.0511 18.3893 179.8400 65 G 3.8507 8.4634 104.5461 48.0885 0.0000 176.1215 66 K 4.1636 8.0836 121.1521 59.0336 31.9610 179.4207 67 V 3.5962 7.6443 118.4627 66.3997 31.4644 178.2726 68 F 4.0755 8.3422 116.8247 60.1997 38.6341 177.7099 69 K 4.0042 8.4530 119.3521 59.3761 32.0847 178.9352 70 L 3.9403 7.8882 119.1062 57.7889 41.5889 179.6273 71 V 3.5754 7.6788 117.9312 66.0351 31.3860 177.5199 72 Y 3.7127 8.0480 119.4349 60.5104 38.5628 177.6281 73 E 3.0707 7.8004 119.2931 58.7692 29.3547 179.0604 74 A 3.7861 7.6065 120.5455 55.1450 18.4227 179.5782 75 A 3.7313 7.3465 118.6265 55.1444 18.2733 179.9969 76 I 3.5555 7.0943 118.0719 64.2813 37.0843 178.2988 77 Q 3.8127 7.7806 120.4621 59.0509 28.8470 178.2268 78 L 3.9501 7.9487 120.1790 57.9259 41.4341 179.2371 79 E 4.0512 7.8056 118.0227 58.9660 29.6199 178.8057 80 V 3.6911 7.7975 117.8851 65.8387 31.8139 176.7819 81 T 4.1939 8.0235 106.7538 61.3523 69.9065 175.6968 82 G 3.9579 8.6236 109.3522 44.8792 0.0000 172.8184 83 V 4.3594 7.2463 111.0409 59.5414 35.6148 174.8422 84 V 3.9701 7.9698 120.3645 61.0702 31.5834 175.3540 85 V 3.6631 8.1100 128.2870 62.4757 31.4773 175.6338 86 T 4.0253 8.4608 125.3790 63.4624 68.5389 173.3119 87 D 5.0893 8.1913 127.5456 51.0894 42.4807 176.0982 88 A 4.0073 8.5657 119.1038 56.0428 18.0588 180.0332 89 T 3.8308 7.7888 113.6907 66.8862 68.7293 176.8582 90 L 4.0255 7.9760 120.7126 57.4838 41.3926 179.7551 91 K 4.1308 8.0474 118.8259 59.4649 32.0047 178.9180 92 N 4.3686 8.4750 117.3869 56.3060 38.7998 177.0035 93 L 4.1676 8.3066 121.1375 57.7052 41.6603 179.5001 94 G 3.7476 8.0168 105.5305 47.8268 0.0000 175.5932 95 S 4.1183 7.7927 115.6559 61.2590 62.5674 176.7597 96 V 3.6831 7.8710 121.7923 65.0172 31.0252 178.0406 97 H 4.1218 8.0916 116.5472 58.6883 28.5306 177.8721 98 V 3.6247 7.7219 119.7307 66.1732 31.1342 178.2032 99 S 4.1483 7.9521 113.9197 61.1098 62.7202 175.8729 100 K 4.3410 7.6913 117.9873 55.6933 32.0297 177.1403 101 G 3.7987 7.9494 107.4193 46.1393 0.0000 173.7991 102 V 3.7924 7.8390 119.3243 61.7523 32.3105 175.2884 103 A 4.9322 8.6879 128.7356 49.9198 22.1315 176.5135 104 D 4.6407 8.8748 118.5767 57.7872 40.8601 179.0393 105 A 4.3945 7.9273 119.0535 53.8541 19.2004 178.5277 106 H 4.4467 8.3833 114.0402 58.4811 28.5475 177.5141 107 F 4.2671 8.3720 119.6323 60.4305 38.7920 175.9967 108 P 4.3478 0.0000 0.0000 64.9801 31.0425 178.8663 109 V 3.5162 7.6854 117.2438 66.1663 31.4811 178.3349 110 V 3.6590 7.7289 117.3846 65.3811 31.3333 177.7675 111 K 2.7011 8.0396 119.8181 59.2496 31.9983 178.7063 112 E 3.8727 8.0628 118.5724 59.2334 29.3526 179.2201 113 A 4.0069 7.7633 120.5379 55.1935 18.3940 179.8213 114 I 3.8590 7.9912 118.7118 64.4150 37.0919 178.6824 115 L 3.9895 8.1252 120.2524 57.6549 41.4434 179.7468 116 K 3.9262 8.4722 118.9535 59.5369 31.9231 179.5656 117 T 3.8948 7.9198 116.0202 66.9331 68.3953 176.8629 118 I 3.6366 8.2191 121.8479 63.9311 36.8155 178.4767 119 K 3.9613 8.2531 120.9688 59.3712 31.7166 178.8376 120 E 3.9326 7.9458 118.2982 59.1148 29.4728 179.0707 121 V 3.6412 7.8413 117.8283 65.8768 31.5977 177.9232 122 V 4.2966 7.8571 112.3727 58.9595 32.1832 178.3056 123 G 3.8631 8.4094 107.4294 46.4140 0.0000 176.8186 124 A 4.2490 8.9059 127.8903 53.7151 18.1775 178.7560 125 K 4.3671 7.6447 113.8204 56.0876 32.4758 177.1425 126 W 4.2713 8.0608 130.6437 57.3799 31.3386 175.6143 127 S 4.5134 7.3259 118.5731 55.6450 67.0545 174.9804 128 E 3.5143 8.2513 121.4005 59.2926 29.1789 178.9791 129 E 3.8926 7.9578 120.2346 58.5670 29.5450 178.6427 130 L 3.9723 7.5806 120.2148 57.9952 42.2149 178.3874 131 N 4.4733 7.7049 117.3474 56.5734 38.8589 177.0153 132 S 4.1155 8.2571 115.7051 61.4087 63.1069 176.3083 133 A 4.0509 7.8850 124.6597 54.7408 18.1543 179.7526 134 W 4.0958 8.5511 117.2863 59.8192 29.0953 179.1669 135 T 4.0701 8.1370 116.0538 66.5872 67.9380 176.7890 136 I 3.6994 7.8983 121.4655 64.5257 37.2137 178.3771 137 A 3.9187 8.0163 121.4518 55.1195 18.1185 179.1769 138 Y 3.9292 8.3410 118.0685 60.9292 39.0329 177.4034 139 D 4.4878 8.3094 119.8373 57.7950 41.1369 178.9519 140 E 3.9317 8.2898 118.7675 59.3146 29.4295 179.2716 141 L 3.9415 8.0043 120.2127 57.8835 42.0698 178.8728 142 A 3.7047 8.1837 121.2485 54.7471 18.0340 179.5537 143 I 3.4699 7.4377 118.2846 64.5241 37.2649 178.8086 144 V 3.5203 7.1313 117.5476 66.0867 31.3781 178.2390 145 I 3.7378 7.6222 119.5791 64.2361 36.8093 178.6206 146 K 3.7678 7.8621 119.4529 58.8313 31.7608 179.3893 147 K 3.8395 7.4997 120.1208 59.6654 32.2995 178.8686 148 E 4.0625 7.9664 118.2035 59.2308 29.1209 179.3504 149 M 4.2596 8.1763 119.3195 58.3742 31.8710 178.3093 150 D 4.3789 7.6583 117.8397 57.5803 41.1006 178.4555 151 D 4.4634 7.8902 117.2469 56.5213 40.8798 177.7635 152 A 4.3213 7.6351 119.1942 52.8015 19.1068 176.9800 153 A 4.1582 7.5752 125.1931 52.2870 18.6982 177.2188 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 G 8.35 3.75 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 0.00 0.00 0.00 2 A 7.86 3.97 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 3 L 7.67 4.40 0.00 1.65 2.00 0.83 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.91 4.23 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 1.29 0.00 0.00 5 E 8.64 3.95 0.00 2.04 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 6 S 7.98 4.16 0.00 4.08 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 7 Q 8.20 3.97 0.00 2.31 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.84 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00 8 A 8.24 3.96 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 9 A 7.81 4.03 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 10 L 7.69 4.02 0.00 1.89 1.78 0.90 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 11 V 7.78 3.81 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 0.77 0.00 0.00 0.56 0.00 0.00 12 K 8.31 4.24 0.00 2.12 1.93 0.00 1.88 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.61 1.77 7.81 13 S 8.09 4.18 0.00 4.08 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.39 4.38 0.00 4.46 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 W 9.08 4.49 0.00 3.62 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 16 E 8.21 3.43 0.00 2.18 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 2.39 2.70 0.00 17 E 8.10 4.03 0.00 2.30 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 2.34 2.56 0.00 18 F 8.02 3.87 0.00 2.92 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 19 N 7.55 4.03 0.00 1.44 2.18 0.00 0.00 7.26 7.91 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 20 A 7.02 3.99 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 21 N 7.78 4.67 0.00 2.44 2.02 0.00 0.00 6.98 7.27 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 22 I 7.43 3.28 1.73 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.71 0.86 0.00 0.00 23 P 0.00 4.21 0.00 2.06 2.19 0.00 3.43 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 2.02 2.07 0.00 24 K 7.63 3.89 0.00 1.64 1.64 0.00 1.66 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.40 1.45 7.81 25 H 7.97 4.28 0.00 2.10 2.87 0.00 5.67 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 26 T 8.21 4.13 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 1.28 0.00 0.00 27 H 8.18 4.40 0.00 3.31 3.48 0.00 5.78 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 R 8.23 3.88 0.00 2.15 2.20 0.00 3.22 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.73 0.00 29 F 8.56 4.21 0.00 3.47 3.45 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.03 3.80 0.00 3.20 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 31 I 7.78 3.72 2.00 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.74 0.87 0.00 0.00 32 L 7.92 3.93 0.00 1.72 1.62 0.99 0.61 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 33 V 7.45 3.39 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 1.08 0.00 0.00 0.11 0.00 0.00 34 L 7.61 4.32 0.00 1.76 1.71 1.01 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.07 4.13 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 2.32 2.57 0.00 36 I 7.49 4.17 1.83 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.52 0.90 0.00 0.00 37 A 8.41 4.57 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 38 P 0.00 4.26 0.00 2.18 2.15 0.00 3.61 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 2.18 0.00 39 A 8.08 4.09 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 40 A 8.11 4.15 1.53 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 0.00 0.00 41 K 8.01 3.98 0.00 1.97 1.85 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.50 7.81 42 D 7.56 4.46 0.00 2.75 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 43 L 7.62 4.05 0.00 1.17 1.09 0.59 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 44 F 7.55 4.28 0.00 2.58 1.53 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 45 S 8.49 4.08 0.00 4.01 4.11 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 46 F 7.49 4.58 0.00 3.01 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 47 L 8.08 4.47 0.00 1.89 1.69 0.55 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 48 K 7.14 4.08 0.00 1.83 1.75 0.00 1.66 0.00 0.00 1.81 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.55 7.81 49 G 9.03 3.96 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 0.00 0.00 0.00 50 T 7.16 4.30 4.35 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 1.27 0.00 0.00 51 S 8.63 4.51 0.00 3.82 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 52 E 7.71 4.61 0.00 1.99 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 2.23 2.27 0.00 53 V 8.22 3.65 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 0.81 0.00 0.00 0.92 0.00 0.00 54 P 0.00 4.35 0.00 2.19 2.06 0.00 3.82 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 2.02 2.05 0.00 55 Q 8.55 4.37 0.00 1.97 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 7.53 0.00 0.00 0.00 0.00 0.00 2.24 2.31 0.00 56 N 7.79 5.13 0.00 2.60 2.70 0.00 0.00 6.74 8.00 0.00 0.00 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 N 7.74 4.78 0.00 2.68 2.51 0.00 0.00 6.81 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 58 P 0.00 4.29 0.00 2.28 2.26 0.00 3.71 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 2.05 2.03 0.00 59 E 8.05 3.83 0.00 2.19 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 2.44 2.39 0.00 60 L 7.32 2.65 0.00 0.82 1.52 0.71 1.17 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 61 Q 7.99 4.02 0.00 2.12 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.36 2.48 0.00 62 A 7.99 4.05 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 63 H 8.45 4.14 0.00 3.56 3.68 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 A 8.93 4.30 1.58 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 65 G 8.46 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 66 K 8.08 4.16 0.00 2.05 1.96 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.55 1.69 7.81 67 V 7.64 3.60 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 0.77 0.00 0.00 1.04 0.00 0.00 68 F 8.34 4.08 0.00 2.92 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 69 K 8.45 4.00 0.00 2.33 1.96 0.00 1.74 0.00 0.00 1.85 0.00 0.00 3.03 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.38 1.62 7.81 70 L 7.89 3.94 0.00 1.91 1.67 0.99 1.20 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 71 V 7.68 3.58 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 1.27 0.00 0.00 0.99 0.00 0.00 72 Y 8.05 3.71 0.00 2.79 2.62 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 73 E 7.80 3.07 0.00 1.95 1.69 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 1.92 2.20 0.00 74 A 7.61 3.79 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 75 A 7.35 3.73 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 I 7.09 3.56 1.60 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.26 0.76 0.00 0.00 77 Q 7.78 3.81 0.00 2.04 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.78 0.00 0.00 0.00 0.00 0.00 2.47 2.30 0.00 78 L 7.95 3.95 0.00 1.81 1.63 0.86 0.85 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 79 E 7.81 4.05 0.00 1.91 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 2.40 2.59 0.00 80 V 7.80 3.69 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 0.86 0.00 0.00 0.92 0.00 0.00 81 T 8.02 4.19 4.19 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 1.15 0.00 0.00 82 G 8.62 3.96 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 0.00 0.00 0.00 83 V 7.25 4.36 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 0.66 0.00 0.00 0.88 0.00 0.00 84 V 7.97 3.97 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 0.69 0.00 0.00 0.83 0.00 0.00 85 V 8.11 3.66 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.90 0.00 0.00 86 T 8.46 4.03 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 1.24 0.00 0.00 87 D 8.19 5.09 0.00 2.77 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 88 A 8.57 4.01 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 89 T 7.79 3.83 4.46 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 1.23 0.00 0.00 90 L 7.98 4.03 0.00 1.62 1.69 0.92 1.02 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 91 K 8.05 4.13 0.00 2.02 1.86 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.69 1.73 7.81 92 N 8.48 4.37 0.00 2.85 2.83 0.00 0.00 7.23 6.22 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 93 L 8.31 4.17 0.00 2.03 1.83 0.98 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 94 G 8.02 3.75 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 0.00 0.00 0.00 95 S 7.79 4.12 0.00 3.89 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 96 V 7.87 3.68 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 0.81 0.00 0.00 0.90 0.00 0.00 97 H 8.09 4.12 0.00 3.49 3.47 0.00 5.82 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.72 3.62 2.28 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 1.05 0.00 0.00 1.08 0.00 0.00 99 S 7.95 4.15 0.00 4.03 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 0.00 100 K 7.69 4.34 0.00 1.83 1.66 0.00 1.67 0.00 0.00 1.65 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.59 1.50 7.81 101 G 7.95 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 0.00 102 V 7.84 3.79 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 0.76 0.00 0.00 0.81 0.00 0.00 103 A 8.69 4.93 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 0.00 104 D 8.87 4.64 0.00 2.81 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 0.00 105 A 7.93 4.39 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 0.00 106 H 8.38 4.45 0.00 3.34 3.22 0.00 5.66 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 F 8.37 4.27 0.00 3.35 3.39 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 0.00 108 P 0.00 4.35 0.00 2.20 2.16 0.00 3.95 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.23 0.00 109 V 7.69 3.52 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 0.99 0.00 0.00 0.96 0.00 0.00 110 V 7.73 3.66 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 1.35 0.00 0.00 0.98 0.00 0.00 111 K 8.04 2.70 0.00 1.41 1.77 0.00 1.79 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.26 1.05 7.81 112 E 8.06 3.87 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 2.50 2.45 0.00 113 A 7.76 4.01 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 0.00 114 I 7.99 3.86 1.72 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.69 0.59 0.00 0.00 115 L 8.13 3.99 0.00 1.65 1.76 0.97 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 116 K 8.47 3.93 0.00 1.79 1.81 0.00 1.63 0.00 0.00 1.60 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.61 7.81 117 T 7.92 3.89 4.64 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 1.33 0.00 0.00 118 I 8.22 3.64 1.50 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 -0.36 0.64 0.00 0.00 119 K 8.25 3.96 0.00 1.74 1.75 0.00 1.22 0.00 0.00 0.87 0.00 0.00 2.13 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.99 0.29 7.81 120 E 7.95 3.93 0.00 2.10 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 2.28 2.49 0.00 121 V 7.84 3.64 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 0.82 0.00 0.00 0.72 0.00 0.00 122 V 7.86 4.30 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 1.23 0.00 0.00 1.23 0.00 0.00 123 G 8.41 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 0.00 0.00 0.00 124 A 8.91 4.25 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 0.00 125 K 7.64 4.37 0.00 1.96 1.92 0.00 1.76 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.50 1.43 7.81 126 W 8.06 4.27 0.00 3.49 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 S 7.33 4.51 0.00 3.87 3.79 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 0.00 128 E 8.25 3.51 0.00 1.93 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.31 0.00 129 E 7.96 3.89 0.00 2.00 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 2.35 2.26 0.00 130 L 7.58 3.97 0.00 1.72 1.48 1.21 0.69 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 0.00 131 N 7.70 4.47 0.00 2.59 2.80 0.00 0.00 6.98 7.15 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 0.00 132 S 8.26 4.12 0.00 4.08 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 0.00 133 A 7.89 4.05 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 0.00 134 W 8.55 4.10 0.00 3.51 3.44 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 0.00 135 T 8.14 4.07 4.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 136 I 7.90 3.70 1.97 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 1.47 0.90 0.89 0.00 0.00 137 A 8.02 3.92 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 0.00 138 Y 8.34 3.93 0.00 3.17 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 0.00 139 D 8.31 4.49 0.00 3.06 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 0.00 140 E 8.29 3.93 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 2.55 2.42 0.00 141 L 8.00 3.94 0.00 1.71 1.56 0.82 0.86 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 0.00 142 A 8.18 3.70 0.97 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 0.00 0.00 143 I 7.44 3.47 1.95 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 1.34 0.84 0.84 0.00 0.00 144 V 7.13 3.52 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 0.97 0.00 0.00 0.92 0.00 0.00 145 I 7.62 3.74 1.76 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 1.51 0.61 0.99 0.00 0.00 146 K 7.86 3.77 0.00 1.61 1.60 0.00 0.61 0.00 0.00 0.82 0.00 0.00 2.64 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.18 0.21 7.81 147 K 7.50 3.84 0.00 1.86 1.94 0.00 1.60 0.00 0.00 1.59 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.39 1.43 7.81 148 E 7.97 4.06 0.00 2.17 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 2.56 2.58 0.00 149 M 8.18 4.26 0.00 2.12 2.29 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.84 0.00 150 D 7.66 4.38 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 0.00 151 D 7.89 4.46 0.00 2.76 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 0.00 152 A 7.64 4.32 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 0.00 153 A 7.58 4.16 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