NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 T 4.3037 8.1749 110.9375 60.6177 70.0947 173.1020 4 P 4.3106 0.0000 0.0000 61.1094 32.0320 174.3596 5 K 4.3266 9.0151 122.5348 54.4615 34.0720 174.6052 6 P 4.5538 0.0000 0.0000 62.6266 32.3852 176.5248 7 R 4.6353 8.4505 120.2894 55.1672 32.5746 177.8133 8 I 3.3574 8.3185 122.3359 64.1185 38.0327 178.4028 9 L 4.0859 7.8689 119.3804 57.4111 41.6230 177.5837 10 P 4.3377 0.0000 0.0000 65.1869 31.3573 178.4781 11 W 4.1666 8.3120 127.0214 60.3414 30.6271 177.8529 12 L 3.4795 8.4787 120.7081 57.9633 41.4348 179.0932 13 V 3.3851 7.8366 118.2383 65.9214 31.3744 177.9453 14 S 4.0152 7.9248 112.8898 61.4628 62.1389 176.1746 15 Q 3.6613 7.4716 120.6847 58.7022 28.0627 178.7707 16 L 3.5822 7.2497 119.2099 57.6667 41.5491 179.0536 17 D 4.7108 8.1473 118.1149 57.4662 40.9073 178.5058 18 L 4.1188 8.1461 118.9275 55.4806 42.0639 177.6287 19 G 3.8807 8.0476 105.9591 46.5956 0.0000 174.5089 20 Q 4.0637 8.0299 120.9568 57.8434 30.2096 175.8292 21 L 4.2700 7.4434 117.6767 53.5930 42.6896 175.6497 22 E 4.1323 8.4464 123.9006 57.1135 30.2730 176.8056 23 G 3.8735 8.8808 113.4290 45.0077 0.0000 173.1387 24 V 4.3124 7.0824 118.0340 60.9522 32.0433 174.9391 25 A 4.6339 8.1283 128.1010 50.2932 22.6446 175.1128 26 W 4.7228 8.8235 119.6113 57.0901 29.7992 176.9523 27 V 4.3613 9.1506 116.3605 61.2343 31.6967 175.2448 28 N 5.0158 7.6755 116.7511 51.2930 40.0250 175.3816 29 K 3.8852 8.6172 120.4691 59.4709 32.3412 178.1518 30 S 4.0580 8.0132 110.9135 58.9453 63.3827 173.9411 31 R 2.8521 7.0750 119.0339 57.1346 27.2798 175.4357 32 T 5.1731 7.7019 105.4268 61.0525 72.7521 175.1977 33 R 5.3147 8.5336 121.5585 54.2704 33.1580 175.0869 34 F 5.7657 8.5476 117.6647 55.2177 41.7748 173.3838 35 R 5.1372 9.3285 115.0387 54.5242 32.9601 174.5023 36 I 4.9791 8.7946 120.8947 58.8207 40.8701 173.2750 37 P 4.8642 0.0000 0.0000 62.1326 31.9013 176.3039 38 W 5.1328 8.7280 135.0000 56.2588 30.3891 175.3286 39 K 4.0528 8.3025 119.3524 56.4783 32.8002 175.3487 40 H 4.3933 8.8824 125.4017 55.7107 30.5889 176.1020 41 G 4.0299 8.8776 115.6049 48.9801 0.0000 174.2804 42 L 4.3031 8.2599 116.8276 55.5462 42.1644 177.4749 43 R 4.1627 7.6669 117.9508 56.0292 30.8056 176.8024 44 Q 4.1003 8.7640 121.8641 59.4572 29.2154 177.6581 45 D 4.6456 8.0687 113.0098 54.0171 39.5561 176.1564 46 A 4.3081 7.5098 123.7351 52.7130 19.1974 176.9937 47 Q 4.6239 8.4938 116.2527 55.4157 31.8857 175.3346 48 Q 4.0941 8.5913 119.1881 59.3718 28.8894 179.0257 49 E 4.3362 8.2212 112.7525 57.3679 29.9447 176.5905 50 D 4.7753 8.7574 119.2927 54.7011 41.3017 176.4036 51 F 4.7079 8.3006 118.4929 56.5227 40.6621 177.7057 52 G 3.4997 8.1451 109.5798 48.0342 0.0000 175.9616 53 I 3.6515 6.9653 121.8412 63.8876 37.1541 178.3589 54 F 4.2707 6.9018 118.1521 60.6256 38.7688 177.3796 55 Q 2.7301 8.4269 119.3936 58.5899 28.7397 177.9492 56 A 4.0270 8.2230 122.2561 54.9815 18.4316 179.4490 57 W 3.4811 8.6210 126.9587 60.2315 30.6992 178.1624 58 A 3.7247 7.5880 120.3211 55.0690 17.8817 179.5153 59 E 4.1806 8.6526 118.6731 58.9728 29.2996 179.4271 60 A 3.8895 8.0016 120.5219 54.6895 18.4459 178.7885 61 T 3.8999 7.0474 105.3778 61.0717 69.1550 175.7517 62 G 3.7536 7.4459 108.8999 46.0750 0.0000 174.8439 63 A 4.1509 7.8576 123.8575 53.9886 18.7673 177.9212 64 Y 5.0320 7.6114 115.3900 56.0496 42.0923 174.4433 65 V 4.1119 7.1626 122.2216 59.8375 32.5283 171.8912 66 P 3.4461 0.0000 0.0000 63.7562 30.8590 175.2796 67 G 4.2662 8.2809 119.3809 45.7814 0.0000 175.0258 68 R 3.9826 7.6817 119.9534 58.4890 30.7701 177.5725 69 D 4.7359 7.3982 116.5135 53.4248 41.7740 176.1143 70 K 4.4220 8.3028 120.4584 54.9811 33.9717 174.8414 71 P 3.7627 0.0000 0.0000 62.9343 31.2099 175.8867 72 D 4.2746 6.9249 124.3534 51.5080 41.0884 176.2243 73 L 3.1818 7.1676 124.8808 56.5388 41.7505 176.9586 74 P 4.2420 0.0000 0.0000 65.8005 31.2547 178.5838 75 T 3.9113 7.8119 111.5235 64.7711 67.1480 176.2494 76 W 4.4793 7.7523 121.0864 59.7146 29.0156 178.3913 77 K 2.9568 8.1573 119.5772 59.0139 31.5104 178.8740 78 R 3.8809 8.3233 119.4960 59.5795 30.0236 178.3393 79 N 4.4607 8.5432 116.4813 56.2766 38.4161 177.2939 80 F 4.1580 8.6088 122.2215 61.2269 39.5060 177.2405 81 R 4.1483 8.8557 119.0623 59.6285 30.0192 178.4920 82 S 4.1410 8.7954 113.1305 61.1129 62.5092 175.9206 83 A 4.0058 8.1118 123.6397 55.2515 17.9179 179.6900 84 L 3.8781 7.0830 116.2283 57.6807 41.6454 178.8315 85 N 4.4731 7.6881 116.3575 56.5664 38.9088 176.7228 86 R 4.1417 7.5112 116.0292 57.4977 30.1118 177.1521 87 K 3.7619 6.9274 118.1017 56.6825 32.4999 175.3745 88 E 4.3362 8.7362 125.5633 56.9638 30.7419 176.3943 89 G 4.0250 10.3181 109.7499 45.4028 0.0000 172.3595 90 L 5.0173 7.5498 119.4007 53.3160 45.2038 174.7092 91 R 4.7481 8.9648 121.4296 54.2478 33.6120 173.6463 92 L 3.6080 8.2925 122.2637 55.0398 42.0818 175.5623 93 A 4.3739 8.7540 128.4513 53.4099 20.0518 176.1608 94 E 4.5281 7.5016 112.2104 54.8322 34.2756 175.3691 95 D 4.6534 8.0654 118.4123 53.2466 41.8746 174.3407 96 R 4.6470 8.6760 121.7002 55.7396 31.0736 179.0244 97 S 4.2777 8.1380 116.6803 60.4966 63.1665 174.9187 98 K 4.4595 7.8405 118.4430 56.3959 32.6598 175.8525 99 D 4.5609 7.7657 118.5429 53.7561 41.7223 174.3009 100 P 4.3372 0.0000 0.0000 65.8445 31.6760 177.7196 101 H 4.5892 7.9992 114.3184 57.7144 29.5361 175.7828 102 D 4.7738 8.6518 118.5895 51.9429 41.5527 171.5469 103 P 4.9605 0.0000 0.0000 62.6375 33.2282 176.0965 104 H 5.2339 8.3282 117.7712 55.4517 32.3539 172.8664 105 K 4.7464 8.6779 117.8500 54.5266 36.1342 175.4702 106 I 4.8685 7.7367 122.0659 59.9797 40.0568 174.5676 107 Y 4.5971 7.8812 124.9941 56.2346 40.5702 174.4377 108 E 5.0360 8.7611 122.2220 54.4466 33.3151 174.4792 109 F 5.1020 9.2641 125.1984 56.5772 39.8633 175.9373 110 V 4.6288 8.4594 117.5170 61.9740 35.0325 173.4630 111 N 5.0293 9.2802 125.8279 55.5545 38.6559 175.0440 112 S 4.4490 9.3802 123.8481 58.9274 62.6723 175.3860 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 3 T 8.17 4.30 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 4 P 0.00 4.31 0.00 2.17 2.04 0.00 3.68 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.14 0.00 5 K 9.02 4.33 0.00 1.67 1.69 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.80 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.33 1.30 7.81 6 P 0.00 4.55 0.00 2.15 2.19 0.00 3.52 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.15 0.00 7 R 8.45 4.64 0.00 2.00 1.93 0.00 3.28 0.00 0.00 3.34 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.81 0.00 8 I 8.32 3.36 1.20 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.73 0.00 0.00 9 L 7.87 4.09 0.00 1.83 1.89 1.12 1.26 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 10 P 0.00 4.34 0.00 2.28 2.17 0.00 3.84 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.20 0.00 11 W 8.31 4.17 0.00 3.71 3.59 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 12 L 8.48 3.48 0.00 2.02 1.48 0.39 0.54 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 13 V 7.84 3.39 2.27 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 1.33 0.00 0.00 1.12 0.00 0.00 14 S 7.92 4.02 0.00 3.96 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 15 Q 7.47 3.66 0.00 1.63 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.58 0.00 0.00 0.00 0.00 0.00 1.17 1.16 0.00 16 L 7.25 3.58 0.00 1.17 0.37 -0.73 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 17 D 8.15 4.71 0.00 2.80 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 18 L 8.15 4.12 0.00 1.61 1.66 0.90 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 19 G 8.05 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 Q 8.03 4.06 0.00 1.93 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.84 0.00 0.00 0.00 0.00 0.00 2.29 2.40 0.00 21 L 7.44 4.27 0.00 1.59 1.43 0.73 0.77 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 22 E 8.45 4.13 0.00 1.89 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 2.26 2.28 0.00 23 G 8.88 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 V 7.08 4.31 1.90 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 0.77 0.00 0.00 0.79 0.00 0.00 25 A 8.13 4.63 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 26 W 8.82 4.72 0.00 3.27 3.30 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 27 V 9.15 4.36 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 0.80 0.00 0.00 1.09 0.00 0.00 28 N 7.68 5.02 0.00 2.88 2.94 0.00 0.00 5.84 6.54 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 29 K 8.62 3.89 0.00 1.69 1.85 0.00 1.63 0.00 0.00 1.70 0.00 0.00 2.86 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.42 7.81 30 S 8.01 4.06 0.00 3.97 3.94 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 31 R 7.07 2.85 0.00 1.12 0.66 0.00 2.38 0.00 0.00 2.89 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.21 0.00 32 T 7.70 5.17 4.45 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 1.29 0.00 0.00 33 R 8.53 5.31 0.00 1.88 1.87 0.00 3.13 0.00 0.00 3.29 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.83 0.00 34 F 8.55 5.77 0.00 2.77 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 35 R 9.33 5.14 0.00 2.02 2.14 0.00 2.75 0.00 0.00 3.24 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.75 0.00 36 I 8.79 4.98 2.63 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 1.78 1.74 0.95 0.00 0.00 37 P 0.00 4.86 0.00 1.76 1.94 0.00 3.47 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.13 0.00 38 W 8.73 5.13 0.00 3.66 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 39 K 8.30 4.05 0.00 1.78 1.67 0.00 2.00 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.51 1.50 7.81 40 H 8.88 4.39 0.00 3.30 3.22 0.00 5.75 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 G 8.88 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 42 L 8.26 4.30 0.00 1.69 1.76 0.95 0.94 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 43 R 7.67 4.16 0.00 2.12 2.08 0.00 3.20 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.62 0.00 44 Q 8.76 4.10 0.00 2.10 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 7.02 0.00 0.00 0.00 0.00 0.00 2.45 2.36 0.00 45 D 8.07 4.65 0.00 2.86 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 46 A 7.51 4.31 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 47 Q 8.49 4.62 0.00 2.41 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.55 0.00 0.00 0.00 0.00 0.00 2.38 2.32 0.00 48 Q 8.59 4.09 0.00 2.20 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 7.05 0.00 0.00 0.00 0.00 0.00 2.47 2.43 0.00 49 E 8.22 4.34 0.00 2.09 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 2.31 2.38 0.00 50 D 8.76 4.78 0.00 2.95 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 F 8.30 4.71 0.00 3.39 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 52 G 8.15 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 I 6.97 3.65 0.87 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.21 0.65 0.00 0.00 54 F 6.90 4.27 0.00 3.32 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 Q 8.43 2.73 0.00 1.66 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 1.82 1.16 0.00 56 A 8.22 4.03 1.66 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 0.00 0.00 57 W 8.62 3.48 0.00 3.22 3.26 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 58 A 7.59 3.72 1.11 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 0.00 0.00 59 E 8.65 4.18 0.00 2.07 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 2.44 2.36 0.00 60 A 8.00 3.89 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 61 T 7.05 3.90 3.77 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 -0.48 0.00 0.00 62 G 7.45 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 63 A 7.86 4.15 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 64 Y 7.61 5.03 0.00 3.10 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 65 V 7.16 4.11 1.91 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 0.81 0.00 0.00 0.89 0.00 0.00 66 P 0.00 3.45 0.00 1.93 1.97 0.00 3.39 0.00 0.00 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.02 0.00 67 G 8.28 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 0.00 0.00 0.00 0.00 68 R 7.68 3.98 0.00 1.76 1.98 0.00 3.34 0.00 0.00 3.20 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.55 0.00 69 D 7.40 4.74 0.00 2.76 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 70 K 8.30 4.42 0.00 1.85 1.82 0.00 1.56 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.38 1.43 7.81 71 P 0.00 3.76 0.00 1.89 1.95 0.00 3.62 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.35 0.00 72 D 6.92 4.27 0.00 2.32 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 0.00 0.00 0.00 0.00 73 L 7.17 3.18 0.00 1.08 0.81 0.76 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 74 P 0.00 4.24 0.00 2.05 2.05 0.00 3.57 0.00 0.00 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.98 0.00 75 T 7.81 3.91 4.53 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 1.18 0.00 0.00 76 W 7.75 4.48 0.00 3.78 3.21 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 77 K 8.16 2.96 0.00 1.35 1.76 0.00 1.49 0.00 0.00 1.48 0.00 0.00 2.13 0.00 0.00 2.54 0.00 0.00 0.00 0.00 0.99 0.21 7.81 78 R 8.32 3.88 0.00 1.90 2.09 0.00 3.17 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.71 0.00 79 N 8.54 4.46 0.00 3.19 3.10 0.00 0.00 6.70 8.16 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 80 F 8.61 4.16 0.00 3.46 3.23 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 81 R 8.86 4.15 0.00 2.35 2.23 0.00 3.26 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 2.04 0.00 82 S 8.80 4.14 0.00 3.93 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 83 A 8.11 4.01 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 84 L 7.08 3.88 0.00 1.40 1.55 0.12 0.61 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 85 N 7.69 4.47 0.00 2.84 3.02 0.00 0.00 7.27 8.72 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 86 R 7.51 4.14 0.00 2.15 2.05 0.00 3.37 0.00 0.00 3.29 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.79 0.00 87 K 6.93 3.76 0.00 2.00 1.87 0.00 1.68 0.00 0.00 1.68 0.00 0.00 3.10 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.55 7.81 88 E 8.74 4.34 0.00 2.03 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 2.30 2.27 0.00 89 G 10.32 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 90 L 7.55 5.02 0.00 1.63 1.54 0.42 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 91 R 8.96 4.75 0.00 1.77 1.93 0.00 2.78 0.00 0.00 3.06 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.44 0.00 92 L 8.29 3.61 0.00 1.24 1.33 -0.09 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 93 A 8.75 4.37 1.13 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 94 E 7.50 4.53 0.00 1.69 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 2.16 2.12 0.00 95 D 8.07 4.65 0.00 2.42 2.37 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 96 R 8.68 4.65 0.00 1.69 1.86 0.00 3.32 0.00 0.00 3.16 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.63 0.00 97 S 8.14 4.28 0.00 4.06 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 98 K 7.84 4.46 0.00 1.89 1.95 0.00 1.56 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.33 1.35 7.81 99 D 7.77 4.56 0.00 2.67 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 0.00 100 P 0.00 4.34 0.00 1.93 1.95 0.00 3.73 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.08 0.00 101 H 8.00 4.59 0.00 3.18 3.37 0.00 5.67 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 D 8.65 4.77 0.00 2.55 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 P 0.00 4.96 0.00 2.27 2.44 0.00 3.85 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 2.14 2.02 0.00 104 H 8.33 5.23 0.00 3.49 3.49 0.00 5.20 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 K 8.68 4.75 0.00 1.51 1.26 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.80 0.81 7.81 106 I 7.74 4.87 1.73 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 1.27 0.67 0.85 0.00 0.00 107 Y 7.88 4.60 0.00 1.43 2.34 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 0.00 108 E 8.76 5.04 0.00 1.88 1.65 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 2.22 2.29 0.00 109 F 9.26 5.10 0.00 3.24 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 0.00 110 V 8.46 4.63 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 0.72 0.00 0.00 1.03 0.00 0.00 111 N 9.28 5.03 0.00 2.66 2.16 0.00 0.00 6.53 7.57 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 0.00 112 S 9.38 4.45 0.00 3.62 3.61 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 0.00 0.00 0.00 0.00