NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4767 8.3049 120.3261 55.1309 32.4767 174.0286 2 K 4.4810 7.9976 123.2227 51.6136 34.8579 175.5093 3 P 4.2516 0.0000 0.0000 65.1808 32.2556 176.9325 4 A 4.0251 7.9932 120.3654 53.2881 18.6220 176.6459 5 A 4.6635 7.9409 118.9551 50.7076 20.1319 176.2549 6 R 4.3699 8.4973 122.3982 56.2761 30.7640 172.9241 7 R 3.7773 8.2058 126.0347 55.6136 28.9631 175.7110 8 R 4.0095 9.2205 124.5685 60.6175 29.7760 180.7018 9 A 3.4803 6.8416 116.2942 52.8795 20.0674 179.0283 10 R 3.9728 7.5468 113.8985 60.0643 31.5432 178.4036 11 E 3.8145 8.1775 116.8438 59.4375 29.6391 178.9543 12 C 4.2280 8.9071 119.0006 62.2530 31.5282 175.3906 13 A 4.7260 9.1416 125.2423 54.5356 17.8344 179.7750 14 V 3.5568 7.5235 117.7428 65.2233 31.3314 178.5772 15 Q 3.9962 7.8272 118.1685 58.7341 28.5217 178.8888 16 A 3.9847 7.4740 121.1133 54.9818 18.2611 179.4590 17 L 4.0602 8.2285 118.0821 58.0961 41.3220 179.1259 18 Y 4.3787 8.1801 119.7048 60.8595 38.3717 177.9847 19 S 4.1432 8.0893 115.7835 61.0297 62.8565 176.3732 20 W 4.6195 8.3386 131.3465 60.5310 30.2263 177.7464 21 Q 3.8755 7.6642 117.8149 59.2249 28.6475 178.0598 22 L 4.1495 7.4029 118.0643 57.7592 41.8376 179.1443 23 S 4.1808 9.2330 113.7850 60.9239 62.2462 175.5703 24 Q 3.8175 8.4050 116.5977 56.1009 27.1782 174.8734 25 N 4.7700 7.6006 114.4813 53.2637 39.8952 173.0074 26 D 4.1409 9.1090 112.8566 57.3416 40.1666 178.0188 27 I 3.8110 8.5450 133.4322 62.2882 35.8531 174.3569 28 A 3.9723 7.4102 122.1381 55.3384 18.4879 179.2392 29 D 4.6821 8.0457 117.4193 56.2512 39.5121 178.7864 30 V 3.6058 7.1293 119.1486 64.6288 31.4077 177.5112 31 E 3.9385 7.7814 120.3763 59.1076 29.5370 178.6090 32 Y 4.2214 7.5078 115.7734 60.5564 37.8323 178.1666 33 Q 4.1414 8.2659 119.1205 59.1538 28.2830 178.3590 34 F 4.0335 7.8628 121.8291 61.1248 39.5666 176.7892 35 L 4.3866 8.1966 118.1547 58.0413 41.3206 179.4559 36 A 4.1367 8.0102 118.6493 54.2221 19.0702 177.9232 37 E 4.0066 8.0478 116.6707 57.1903 30.1483 176.8836 38 Q 3.1879 8.6378 117.4837 56.3146 26.3403 174.3466 39 D 4.0617 7.2519 110.0772 55.9702 38.3672 174.6857 40 V 3.9423 7.6739 128.5049 61.3704 30.1116 176.1905 41 K 3.8163 7.8961 117.1541 55.8162 30.8055 175.1299 42 D 4.2390 8.1259 112.5638 55.0298 37.4485 172.3647 43 V 4.3346 7.6178 120.0812 60.5086 34.7665 174.2852 44 D 4.4125 8.7274 126.3379 54.6577 41.2092 175.4229 45 V 4.4361 8.2264 124.8429 62.0710 32.6868 176.7571 46 L 3.9920 7.8314 119.7974 58.0872 41.5786 178.4899 47 Y 4.2710 7.9784 118.7493 60.7750 38.8061 177.8264 48 F 3.9884 8.2654 118.2489 60.2726 38.7921 177.4502 49 R 3.2879 7.4182 117.6400 59.2866 30.0194 178.8121 50 E 3.9554 7.8508 117.6066 59.2744 29.2581 179.3150 51 L 3.8900 7.4155 119.1896 57.8239 41.5717 179.5425 52 L 4.1078 8.0825 118.7673 57.5546 41.4943 179.1866 53 A 4.1607 7.9761 120.7115 55.0633 18.1290 179.8114 54 G 3.8213 8.0469 104.0853 48.2528 0.0000 176.1497 55 V 3.6453 7.9565 120.0507 65.4931 31.4205 177.7032 56 A 4.3807 8.0012 119.8690 54.0178 18.3186 177.8610 57 T 4.6559 7.7040 104.5670 61.5954 69.9761 174.5087 58 N 5.1286 8.6871 119.8202 52.7030 40.9081 176.7168 59 T 3.7952 8.2777 117.1787 66.9935 68.3063 176.0087 60 A 4.0111 7.9907 120.4855 55.2278 18.7485 178.5258 61 Y 4.2888 7.8424 117.7107 60.9879 38.9335 178.1737 62 L 3.3429 7.5579 119.7864 57.2662 41.6304 178.7995 63 D 4.3720 8.0469 118.2206 56.9905 40.7607 178.5118 64 G 3.7250 7.5315 105.5460 47.7027 0.0000 175.4055 65 L 4.2445 7.7961 121.2437 57.9277 41.6213 179.3670 66 M 3.0611 7.9815 117.8035 57.1573 31.6622 178.6613 67 K 4.0503 7.9512 120.4400 59.0351 32.5832 175.6160 68 P 4.3196 0.0000 0.0000 64.6309 31.5319 175.4692 69 Y 4.7378 8.3848 116.9821 55.2571 39.3357 174.1860 70 L 4.2356 8.7658 123.3131 56.1589 43.8755 177.7761 71 S 3.8278 8.2709 109.8051 59.7314 58.8782 170.2138 72 R 4.3407 8.9835 124.4523 56.2785 28.6727 177.1029 73 L 4.6163 7.0162 115.2295 53.3685 45.7769 176.8515 74 L 4.0337 8.4953 122.6685 57.7792 41.8619 178.4117 75 E 4.0778 8.0378 118.0896 58.7906 30.0631 177.8141 76 E 4.0239 8.1139 117.6829 59.1716 29.7556 177.1508 77 L 3.9387 7.4280 118.7795 54.7504 42.0426 176.8856 78 G 3.8746 8.5335 108.0597 45.3475 0.0000 173.6003 79 Q 3.7436 8.8316 125.4426 59.7717 28.5804 180.0351 80 V 3.4224 6.9713 111.6906 64.5361 31.8297 178.3046 81 E 4.0770 8.0879 117.6678 59.5421 29.4927 179.1830 82 K 3.9092 9.4154 119.3705 59.6341 32.2367 178.6266 83 A 4.0698 8.0148 121.2800 54.7960 18.1742 179.8308 84 V 3.4835 8.5084 118.9537 65.2606 31.3348 178.7870 85 L 4.0195 8.2270 120.1015 56.8614 41.1108 179.3630 86 R 3.8735 7.8061 118.6390 59.7329 30.1256 178.7620 87 I 3.8048 7.7743 119.0416 64.1470 36.7995 178.2641 88 A 4.0550 7.5405 120.9209 54.9202 18.2587 179.3128 89 L 4.0827 7.8186 117.8075 58.2778 41.7069 179.1343 90 Y 4.3488 7.5853 119.2133 60.4199 38.4336 177.1612 91 E 4.0012 7.8323 119.4505 59.4848 29.6458 178.6251 92 L 4.2107 7.6299 118.2808 57.5718 41.6950 179.1448 93 S 4.4222 8.0573 112.6966 61.1970 62.3776 175.2752 94 K 4.7111 8.3314 118.6930 55.2528 32.0538 175.9758 95 R 3.9591 7.3037 116.6072 56.1678 28.7397 176.4890 96 S 4.2718 8.6099 118.0264 61.0905 62.8168 177.3165 97 D 4.6234 7.6935 118.7303 52.8603 41.3791 174.6057 98 V 4.4811 7.6878 116.2388 58.1684 33.9272 174.5852 99 P 4.6082 0.0000 0.0000 63.1083 32.2190 174.4815 100 Y 4.4718 8.7453 114.1100 59.5416 39.2992 177.8021 101 K 3.2312 6.4222 120.1893 58.4688 32.6435 179.4451 102 V 3.5434 7.6101 118.5136 64.7373 31.2205 178.1757 103 A 4.7963 7.6742 122.0962 54.3658 18.2467 179.5321 104 I 3.6001 7.4108 118.2489 64.5818 35.5097 177.9487 105 N 4.3057 8.0055 117.3268 56.6611 38.6570 176.7519 106 E 4.2548 8.2619 119.9326 59.3708 29.4319 177.8613 107 A 3.7146 7.8008 118.6878 55.9729 18.3627 179.2005 108 I 3.8106 7.7634 115.2725 64.4624 37.4801 178.4335 109 E 4.0588 7.5912 117.8771 59.4429 29.2282 178.8254 110 L 4.2223 8.4292 115.4464 55.3962 41.7587 177.1794 111 A 4.8055 7.6990 120.0918 51.3031 20.1209 176.6644 112 K 4.6888 8.1416 114.6814 56.8728 34.5748 177.0702 113 S 4.5608 8.3023 111.6836 58.0212 64.1279 174.2472 114 F 4.6597 8.4963 116.2938 57.4935 41.1303 175.4163 115 G 4.2145 8.1488 106.6460 45.4695 0.0000 174.8000 116 A 4.7912 7.5777 125.6193 50.2231 23.1256 176.1120 117 E 4.5109 8.3950 120.4735 56.3544 30.0706 172.3224 118 D 4.5786 7.7909 114.5604 54.8170 40.8354 174.6672 119 S 4.6127 7.5858 118.4314 57.9864 62.8959 174.0554 120 H 4.7331 7.6382 118.8908 57.1990 30.4797 178.0928 121 K 3.9819 7.5835 119.3774 59.3584 32.3960 178.5359 122 F 4.0151 8.3003 120.9340 61.1012 39.1240 177.2937 123 V 3.6532 7.7916 111.8531 64.2367 31.2329 177.8092 124 N 4.2672 8.0165 116.4509 56.8054 38.7674 177.1121 125 G 3.4352 7.4701 105.5730 47.6907 0.0000 175.9349 126 V 3.0278 6.8906 114.1277 64.1473 31.3126 178.6722 127 L 3.9486 7.5018 118.0616 57.4022 41.2483 178.8336 128 D 4.3059 7.4245 117.2624 57.3071 41.2578 178.1816 129 K 4.1700 7.7612 117.3360 59.3320 32.3436 179.0660 130 A 4.8980 8.8095 121.2905 54.2363 17.8977 179.4129 131 A 4.2056 8.6313 120.3694 54.5051 19.0372 177.9843 132 P 4.2957 0.0000 0.0000 62.8054 30.7463 176.1362 133 V 4.2434 7.4128 118.1669 65.5861 33.7438 177.0982 134 I 3.6597 7.2187 116.1260 63.7161 37.0378 176.6297 135 R 4.4486 7.2974 119.4804 54.2350 30.7567 173.0315 136 P 4.4885 0.0000 0.0000 62.3975 31.3739 177.4182 137 N 4.3005 7.9958 117.5525 55.4910 39.9102 174.7462 138 K 3.5872 7.6489 112.9724 56.5007 29.1402 174.4491 139 K 4.0957 8.2832 120.9161 56.9862 31.9882 177.0714 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 M 8.30 4.48 0.00 2.02 2.13 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.51 0.00 2 K 8.00 4.48 0.00 1.85 1.67 0.00 1.67 0.00 0.00 1.85 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.40 1.49 7.81 3 P 0.00 4.25 0.00 2.18 2.19 0.00 3.76 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 1.99 1.97 0.00 4 A 7.99 4.03 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 5 A 7.94 4.66 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 6 R 8.50 4.37 0.00 1.81 1.95 0.00 3.48 0.00 0.00 3.16 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.54 0.00 7 R 8.21 3.78 0.00 1.87 1.91 0.00 3.20 0.00 0.00 3.16 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.56 0.00 8 R 9.22 4.01 0.00 1.94 2.08 0.00 3.43 0.00 0.00 3.45 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.64 0.00 9 A 6.84 3.48 1.12 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 10 R 7.55 3.97 0.00 1.98 1.96 0.00 3.28 0.00 0.00 3.28 7.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.89 0.00 11 E 8.18 3.81 0.00 2.26 1.12 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 2.45 2.35 0.00 12 C 8.91 4.23 0.00 3.09 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 13 A 9.14 4.73 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 14 V 7.52 3.56 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 0.90 0.00 0.00 0.96 0.00 0.00 15 Q 7.83 4.00 0.00 1.31 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.84 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 16 A 7.47 3.98 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 17 L 8.23 4.06 0.00 1.85 1.82 0.97 0.75 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 18 Y 8.18 4.38 0.00 3.04 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 19 S 8.09 4.14 0.00 4.21 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 20 W 8.34 4.62 0.00 3.42 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 21 Q 7.66 3.88 0.00 2.31 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.87 0.00 0.00 0.00 0.00 0.00 2.41 2.45 0.00 22 L 7.40 4.15 0.00 1.59 1.66 0.70 0.86 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 23 S 9.23 4.18 0.00 3.75 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 24 Q 8.41 3.82 0.00 2.22 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.48 0.00 0.00 0.00 0.00 0.00 2.42 2.47 0.00 25 N 7.60 4.77 0.00 2.81 2.90 0.00 0.00 7.13 8.40 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 26 D 9.11 4.14 0.00 2.75 2.55 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 0.00 27 I 8.55 3.81 1.93 0.00 0.00 -1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.58 1.01 0.00 0.00 28 A 7.41 3.97 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 29 D 8.05 4.68 0.00 3.00 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 30 V 7.13 3.61 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 0.59 0.00 0.00 1.00 0.00 0.00 31 E 7.78 3.94 0.00 1.83 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 1.50 1.47 0.00 32 Y 7.51 4.22 0.00 3.18 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 33 Q 8.27 4.14 0.00 2.40 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.63 0.00 34 F 7.86 4.03 0.00 3.10 3.25 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 35 L 8.20 4.39 0.00 2.01 1.85 1.35 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 36 A 8.01 4.14 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 37 E 8.05 4.01 0.00 2.09 1.72 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 2.29 2.50 0.00 38 Q 8.64 3.19 0.00 1.98 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 5.97 0.00 0.00 0.00 0.00 0.00 2.08 2.09 0.00 39 D 7.25 4.06 0.00 2.80 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 40 V 7.67 3.94 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 0.79 0.00 0.00 1.06 0.00 0.00 41 K 7.90 3.82 0.00 1.96 1.95 0.00 1.98 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.29 1.45 7.81 42 D 8.13 4.24 0.00 2.78 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 43 V 7.62 4.33 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 0.75 0.00 0.00 1.01 0.00 0.00 44 D 8.73 4.41 0.00 2.65 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 45 V 8.23 4.44 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 0.93 0.00 0.00 1.01 0.00 0.00 46 L 7.83 3.99 0.00 1.75 1.66 0.92 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 47 Y 7.98 4.27 0.00 3.03 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 48 F 8.27 3.99 0.00 3.11 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 49 R 7.42 3.29 0.00 1.94 1.96 0.00 3.40 0.00 0.00 3.36 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.90 0.00 50 E 7.85 3.96 0.00 2.03 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 2.56 2.58 0.00 51 L 7.42 3.89 0.00 1.55 1.59 -0.06 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 52 L 8.08 4.11 0.00 1.98 1.64 0.54 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 53 A 7.98 4.16 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 54 G 8.05 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 55 V 7.96 3.65 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 1.19 0.00 0.00 1.04 0.00 0.00 56 A 8.00 4.38 1.46 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 0.00 0.00 57 T 7.70 4.66 4.29 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 1.30 0.00 0.00 58 N 8.69 5.13 0.00 2.96 3.04 0.00 0.00 7.24 6.79 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 59 T 8.28 3.80 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 1.32 0.00 0.00 60 A 7.99 4.01 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 61 Y 7.84 4.29 0.00 2.94 3.04 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 62 L 7.56 3.34 0.00 1.72 1.44 0.74 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 63 D 8.05 4.37 0.00 2.64 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 64 G 7.53 3.72 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 0.00 0.00 0.00 65 L 7.80 4.24 0.00 1.78 1.85 0.98 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 66 M 7.98 3.06 0.00 1.42 1.77 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.40 0.00 67 K 7.95 4.05 0.00 1.81 1.79 0.00 1.76 0.00 0.00 1.79 0.00 0.00 3.14 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.51 7.81 68 P 0.00 4.32 0.00 2.29 2.20 0.00 3.72 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 2.20 2.12 0.00 69 Y 8.38 4.74 0.00 2.97 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 70 L 8.77 4.24 0.00 1.63 1.68 0.87 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 71 S 8.27 3.83 0.00 4.23 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 72 R 8.98 4.34 0.00 1.97 2.10 0.00 3.19 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 1.51 1.64 0.00 73 L 7.02 4.62 0.00 1.68 1.48 0.91 0.60 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 74 L 8.50 4.03 0.00 1.61 1.71 0.86 0.79 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 75 E 8.04 4.08 0.00 1.90 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 2.31 0.00 76 E 8.11 4.02 0.00 2.18 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 2.22 0.00 77 L 7.43 3.94 0.00 1.57 1.62 0.94 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 78 G 8.53 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 79 Q 8.83 3.74 0.00 1.58 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.99 0.00 0.00 0.00 0.00 0.00 2.39 2.44 0.00 80 V 6.97 3.42 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 1.01 0.00 0.00 0.83 0.00 0.00 81 E 8.09 4.08 0.00 2.13 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 2.44 2.38 0.00 82 K 9.42 3.91 0.00 1.84 2.03 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.50 1.87 7.81 83 A 8.01 4.07 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 84 V 8.51 3.48 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 0.85 0.00 0.00 0.81 0.00 0.00 85 L 8.23 4.02 0.00 1.80 1.82 0.89 1.06 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 86 R 7.81 3.87 0.00 2.00 2.09 0.00 3.12 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 87 I 7.77 3.80 1.84 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 1.41 0.88 0.90 0.00 0.00 88 A 7.54 4.05 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 89 L 7.82 4.08 0.00 1.73 1.60 0.91 0.86 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 90 Y 7.59 4.35 0.00 2.85 2.82 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 91 E 7.83 4.00 0.00 2.01 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 0.00 2.35 2.53 0.00 92 L 7.63 4.21 0.00 1.77 1.81 1.06 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 93 S 8.06 4.42 0.00 4.23 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 0.00 94 K 8.33 4.71 0.00 1.59 1.67 0.00 1.63 0.00 0.00 1.67 0.00 0.00 3.09 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.95 1.11 7.81 95 R 7.30 3.96 0.00 2.20 2.29 0.00 3.13 0.00 0.00 3.33 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.63 0.00 96 S 8.61 4.27 0.00 3.99 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 97 D 7.69 4.62 0.00 2.61 2.61 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 98 V 7.69 4.48 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 0.95 0.00 0.00 0.93 0.00 0.00 99 P 0.00 4.61 0.00 2.19 2.19 0.00 3.75 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 1.94 0.00 100 Y 8.75 4.47 0.00 3.17 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 0.00 101 K 6.42 3.23 0.00 1.06 1.54 0.00 1.54 0.00 0.00 1.66 0.00 0.00 2.88 0.00 0.00 3.04 0.00 0.00 0.00 0.00 0.83 1.00 7.81 102 V 7.61 3.54 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 0.79 0.00 0.00 0.90 0.00 0.00 103 A 7.67 4.80 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 0.00 104 I 7.41 3.60 1.99 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.85 0.85 0.00 0.00 105 N 8.01 4.31 0.00 2.74 2.86 0.00 0.00 7.16 7.17 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 0.00 106 E 8.26 4.25 0.00 2.26 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 0.00 2.28 2.30 0.00 107 A 7.80 3.71 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 0.00 108 I 7.76 3.81 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 1.71 0.92 1.00 0.00 0.00 109 E 7.59 4.06 0.00 2.16 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 2.37 0.00 110 L 8.43 4.22 0.00 1.44 1.33 0.68 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 111 A 7.70 4.81 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 0.00 112 K 8.14 4.69 0.00 1.82 2.03 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.53 1.34 7.81 113 S 8.30 4.56 0.00 3.85 3.81 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 0.00 114 F 8.50 4.66 0.00 3.16 3.09 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 0.00 115 G 8.15 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 0.00 116 A 7.58 4.79 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 0.00 117 E 8.39 4.51 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 2.25 2.31 0.00 118 D 7.79 4.58 0.00 2.89 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.59 4.61 0.00 3.80 3.73 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 0.00 120 H 7.64 4.73 0.00 3.31 3.57 0.00 5.46 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 K 7.58 3.98 0.00 1.94 2.04 0.00 1.50 0.00 0.00 1.73 0.00 0.00 2.87 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.41 1.45 7.81 122 F 8.30 4.02 0.00 3.08 3.03 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 0.00 123 V 7.79 3.65 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 0.96 0.00 0.00 0.98 0.00 0.00 124 N 8.02 4.27 0.00 2.72 2.91 0.00 0.00 7.01 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 0.00 125 G 7.47 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 0.00 0.00 0.00 126 V 6.89 3.03 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.00 0.00 0.47 0.00 0.00 127 L 7.50 3.95 0.00 1.70 1.65 0.92 0.99 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 0.00 128 D 7.42 4.31 0.00 2.56 2.82 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 0.00 129 K 7.76 4.17 0.00 1.87 1.88 0.00 1.77 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.66 1.58 7.81 130 A 8.81 4.90 1.57 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 0.00 0.00 131 A 8.63 4.21 1.72 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 0.00 0.00 132 P 0.00 4.30 0.00 2.07 1.85 0.00 3.76 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 2.15 2.12 0.00 133 V 7.41 4.24 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 1.04 0.00 0.00 1.05 0.00 0.00 134 I 7.22 3.66 1.91 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.88 1.04 0.00 0.00 135 R 7.30 4.45 0.00 1.80 1.81 0.00 3.41 0.00 0.00 3.26 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.73 0.00 136 P 0.00 4.49 0.00 2.17 2.06 0.00 3.79 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.93 0.00 137 N 8.00 4.30 0.00 2.68 2.85 0.00 0.00 7.53 6.70 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 0.00 138 K 7.65 3.59 0.00 1.81 1.79 0.00 1.74 0.00 0.00 1.55 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.22 1.31 7.81 139 K 8.28 4.10 0.00 2.04 1.87 0.00 1.84 0.00 0.00 1.78 0.00 0.00 3.10 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.55 1.55 7.81