NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1521 8.1727 122.0511 56.3112 34.1048 174.1221 2 V 4.5231 8.1776 127.2667 60.6366 32.1018 174.4599 3 F 4.2737 9.9922 128.7347 57.6309 40.1999 174.8114 4 E 4.2990 8.9193 120.5977 55.5254 31.0798 176.8599 5 R 3.3307 8.9692 121.3610 60.7184 29.9402 179.5039 6 C 4.3195 8.0062 115.1956 59.7664 34.5112 175.6186 7 E 3.8919 8.1585 120.6362 59.2396 29.1873 178.5752 8 L 3.6179 8.0177 120.0608 57.7619 42.0762 178.4588 9 A 3.9301 7.7237 120.7867 55.5518 18.2766 179.8850 10 R 3.8847 8.0592 116.2322 59.5913 30.0808 179.5250 11 T 3.8405 7.7336 115.0213 66.6936 68.4837 176.7096 12 L 3.8606 8.1274 121.2652 57.4834 41.5827 179.5757 13 K 3.8766 8.0113 119.6297 59.5742 31.9819 178.8882 14 R 3.9468 7.9079 117.7017 59.1001 29.9938 177.4684 15 L 4.3695 7.5342 116.3328 54.1308 41.6650 176.9477 16 G 3.8579 7.8114 106.7499 46.9406 0.0000 175.2016 17 M 3.8764 7.7878 121.1883 56.4149 32.3344 175.7755 18 D 4.3785 7.9805 117.8699 56.1237 41.1201 175.5797 19 G 3.9472 9.3014 115.5691 45.4657 0.0000 171.2284 20 Y 4.2732 8.3104 122.0715 58.5510 38.9687 176.2796 21 R 3.6364 9.0149 126.7276 57.2873 27.8078 177.2089 22 G 3.7986 8.0008 102.8787 45.7476 0.0000 174.0425 23 I 4.0663 7.5702 122.0190 59.0696 37.9571 175.9083 24 S 4.6766 8.2986 120.3324 57.6637 64.0182 174.9261 25 L 4.1676 8.8737 123.1201 58.6346 41.7936 179.2195 26 A 4.1346 8.2357 120.0430 55.4892 18.1438 179.2657 27 N 4.4828 8.1695 114.5387 56.3101 38.6068 177.7568 28 W 4.2023 8.0790 119.9166 59.9739 29.1858 178.3805 29 M 4.1809 8.5322 119.0522 58.4350 31.4178 177.9498 30 C 3.2166 8.0609 118.7087 59.0129 44.5974 175.3386 31 L 3.9703 8.2379 121.8648 58.2796 41.7627 178.7773 32 A 4.1088 8.3245 120.7665 54.9627 18.3447 179.4317 33 K 2.7366 8.0107 117.9741 59.3002 32.0109 179.0901 34 W 4.2508 7.4022 116.8497 59.1691 29.0919 178.4012 35 E 4.3169 8.3363 118.6453 58.6794 29.5626 177.8021 36 S 4.5251 7.9320 109.8187 56.4811 64.5237 174.5413 37 G 3.4048 7.9232 108.4588 46.8815 0.0000 173.2362 38 Y 3.6496 7.6780 113.4736 58.6550 35.0596 168.5984 39 N 5.3199 7.5740 118.2059 51.9521 40.0299 175.6262 40 T 4.0939 8.9959 117.3245 63.7592 69.2041 175.9035 41 R 4.5165 8.0052 116.9431 55.5945 30.1090 176.1784 42 A 4.3161 7.6483 121.5574 52.7551 19.2871 177.0348 43 T 4.9963 8.4025 111.4852 59.9349 72.3836 172.9643 44 N 4.9267 8.8327 121.9222 52.2359 42.2925 172.2789 45 Y 4.8482 8.7452 127.6444 57.1239 40.8704 173.7813 46 N 4.7068 8.5878 124.8460 51.2496 38.8967 175.2854 47 A 3.6198 8.3716 127.7285 54.8889 18.8343 179.1260 48 G 3.7247 8.0501 103.8590 47.9459 0.0000 173.7501 49 D 4.7308 7.5647 115.1403 51.9643 40.2360 175.8089 50 R 3.8626 8.1657 116.9545 57.0931 28.1300 175.7809 51 S 4.9690 7.8360 111.9339 57.0238 66.5433 172.6634 52 T 5.1214 8.7692 115.5868 61.9688 72.8060 172.8307 53 D 5.5134 8.9921 125.0971 53.1554 43.2765 175.0288 54 Y 4.9222 9.1477 121.0167 57.4305 41.4343 177.4573 55 G 4.1326 9.0288 112.0375 45.2118 0.0000 173.3885 56 I 3.9713 8.2760 116.8531 62.9869 37.8396 177.3560 57 F 4.7480 7.9784 115.3035 56.3988 39.7959 175.4854 58 Q 3.5877 7.9299 118.9234 57.1345 26.4290 173.6796 59 I 4.4505 8.2827 119.2419 60.8558 39.3505 176.5898 60 N 5.4195 9.2535 126.2037 53.3513 39.6922 175.8210 61 S 4.7108 9.0665 120.8045 60.4824 63.2804 175.5032 62 R 3.7419 8.8501 122.2156 58.5391 30.3496 177.7902 63 Y 4.2235 7.6653 114.3273 57.8196 40.5160 176.7668 64 W 4.8221 8.0169 118.7313 57.5471 31.3024 174.0402 65 C 5.8550 8.0756 112.2524 52.8606 46.6603 172.2885 66 N 5.0989 9.0371 119.1467 51.9203 40.5198 174.6442 67 D 4.8669 8.6437 123.2222 52.3194 40.6756 177.0509 68 G 4.1930 8.4871 112.3470 45.9391 0.0000 174.9125 69 K 4.3063 7.9902 115.7628 56.7351 33.0670 176.2984 70 T 4.3600 7.4052 116.4473 61.7009 68.8651 173.0638 71 P 4.1530 0.0000 0.0000 64.1216 32.2790 176.7101 72 G 3.8507 8.4921 110.5194 46.4388 0.0000 172.0618 73 A 4.6546 7.4571 117.7391 50.6382 21.3704 177.3179 74 A 4.5931 8.5471 120.4238 50.2825 22.7755 176.3713 75 N 4.8147 8.1753 115.9817 51.8620 38.5164 174.5595 76 A 3.9296 9.4141 126.0575 54.7800 18.9805 179.4079 77 A 4.2443 7.9982 115.9878 53.0252 19.1959 176.7210 78 H 4.1154 7.6557 112.3143 56.5437 26.6779 173.9881 79 L 4.8385 7.3477 117.5605 52.9103 46.6569 176.4296 80 S 4.6775 8.3218 114.8460 57.9688 63.3558 176.0525 81 C 4.1576 8.6897 123.9897 59.6118 36.4957 176.3030 82 S 3.9295 7.6830 115.1768 61.3867 61.6361 176.0528 83 A 4.1232 7.7056 121.9305 54.4732 17.8101 177.9552 84 L 4.4542 7.7611 116.3290 55.0949 41.7414 177.6305 85 L 5.2572 7.6768 116.6133 53.7302 42.2848 176.6608 86 Q 4.4004 7.7705 117.9525 55.2740 29.6361 175.8601 87 D 4.4302 8.4929 119.2571 56.9241 41.1714 176.7876 88 N 4.6189 8.0562 118.2085 53.0798 39.2743 174.5811 89 I 4.2744 8.4541 118.9535 61.1149 38.0250 177.0981 90 A 3.9412 8.4745 125.2850 56.0172 18.1743 180.2433 91 D 4.3175 8.0853 116.5504 57.3441 40.9216 178.6981 92 A 4.1377 7.9808 120.9948 55.0216 18.4630 179.7572 93 V 3.3730 8.2196 117.0146 66.0610 31.7559 178.1286 94 A 3.8543 8.0722 120.3214 54.9514 18.1376 179.5585 95 A 3.9213 8.1089 119.0690 55.3243 18.6534 179.6338 96 A 4.0221 8.0847 119.4276 55.3207 18.0709 180.0203 97 K 3.8439 7.5934 116.0518 59.3898 32.3246 179.2428 98 R 4.0616 7.7205 118.6531 59.3320 30.0402 178.5088 99 V 2.0000 7.3121 117.9274 65.7298 31.5209 178.0466 100 V 3.8731 7.6411 109.7189 62.7910 31.2352 178.0731 101 R 4.2068 7.6900 117.7129 57.2991 30.5207 176.5146 102 D 4.7354 7.3466 119.0899 52.5640 41.8401 175.3154 103 P 4.2459 0.0000 0.0000 66.3066 31.0865 177.8299 104 Q 4.0048 8.1648 117.2918 56.5411 29.8969 177.2562 105 G 3.7045 8.0055 107.1567 46.8762 0.0000 175.5628 106 I 3.7277 7.7239 119.5421 63.2591 38.0569 178.1145 107 R 4.3149 7.3352 117.9352 58.1805 29.9696 177.5838 108 A 3.9489 7.7602 120.8868 53.9983 18.6525 177.4859 109 W 4.7909 8.2247 116.5722 55.3149 30.1879 177.4999 110 V 3.7437 8.7448 123.6303 66.0017 30.9168 177.6523 111 A 4.0839 8.2997 120.1781 54.7472 18.1167 179.2546 112 W 3.9538 8.3786 127.1654 60.5543 30.5616 178.4715 113 R 3.6166 8.0799 116.5040 59.2892 29.7007 178.3570 114 N 4.3626 7.7914 114.6168 55.5241 38.6989 176.8014 115 R 4.1317 7.6724 113.8590 55.9546 30.3296 175.6404 116 C 4.5666 7.6260 116.2608 58.1838 42.5383 174.3032 117 Q 3.2549 6.4187 118.6206 57.2700 28.7114 175.3275 118 N 4.1980 8.6842 120.1007 54.4044 36.1720 173.7706 119 R 4.5594 7.3161 114.4735 54.0479 33.8436 174.9551 120 D 4.5814 8.5262 118.6515 54.0727 40.7603 175.9248 121 V 4.5969 8.2519 119.2196 61.3504 32.5421 178.1197 122 R 4.0450 8.1492 122.0870 59.4111 29.5594 178.5604 123 Q 3.9823 8.1238 116.0963 59.7012 28.2135 178.3280 124 Y 4.3867 7.8896 117.6344 59.8394 38.2820 176.7272 125 V 4.3448 7.7656 110.8775 60.6021 32.9297 175.0613 126 Q 4.1537 7.9824 122.4725 57.4907 29.0446 176.2668 127 G 3.9863 9.0289 113.6538 45.7463 0.0000 174.2666 128 C 4.3922 7.9030 115.6881 57.1374 40.6109 174.3912 129 G 3.8788 8.3160 107.1870 46.2612 0.0000 174.0070 130 V 4.0034 7.7917 118.0289 61.0979 32.0507 175.7366 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 K 8.17 4.15 0.00 1.81 1.69 0.00 1.25 0.00 0.00 0.90 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.91 1.11 7.81 2 V 8.18 4.52 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 0.90 0.00 0.00 0.95 0.00 0.00 3 F 9.99 4.27 0.00 2.85 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 4 E 8.92 4.30 0.00 1.97 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 2.29 2.40 0.00 5 R 8.97 3.33 0.00 1.92 1.91 0.00 3.45 0.00 0.00 3.47 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.77 0.00 6 C 8.01 4.32 0.00 3.00 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 7 E 8.16 3.89 0.00 2.06 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 0.00 2.62 2.43 0.00 8 L 8.02 3.62 0.00 1.40 1.39 -0.08 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.72 3.93 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 10 R 8.06 3.88 0.00 1.87 1.99 0.00 3.13 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 11 T 7.73 3.84 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 1.20 0.00 0.00 12 L 8.13 3.86 0.00 1.73 1.58 0.94 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.01 3.88 0.00 1.94 1.95 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.45 7.81 14 R 7.91 3.95 0.00 1.97 2.06 0.00 3.30 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 15 L 7.53 4.37 0.00 1.66 1.54 0.85 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.81 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 17 M 7.79 3.88 0.00 1.28 1.93 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.21 0.00 18 D 7.98 4.38 0.00 2.66 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 19 G 9.30 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 20 Y 8.31 4.27 0.00 3.16 3.19 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 0.00 21 R 9.01 3.64 0.00 1.86 1.82 0.00 3.24 0.00 0.00 2.95 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 1.33 0.00 22 G 8.00 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 23 I 7.57 4.07 1.81 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 0.86 0.88 -0.31 0.00 0.00 24 S 8.30 4.68 0.00 4.06 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 25 L 8.87 4.17 0.00 2.08 1.81 0.97 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.24 4.13 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 N 8.17 4.48 0.00 2.80 2.71 0.00 0.00 6.97 8.62 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 28 W 8.08 4.20 0.00 3.52 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 29 M 8.53 4.18 0.00 2.15 2.35 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.88 0.00 30 C 8.06 3.22 0.00 2.66 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 31 L 8.24 3.97 0.00 1.82 1.86 0.44 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.32 4.11 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 33 K 8.01 2.74 0.00 1.47 1.63 0.00 0.63 0.00 0.00 1.06 0.00 0.00 2.62 0.00 0.00 2.61 0.00 0.00 0.00 0.00 0.96 0.21 7.81 34 W 7.40 4.25 0.00 3.33 3.27 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 35 E 8.34 4.32 0.00 2.01 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 2.56 2.38 0.00 36 S 7.93 4.53 0.00 4.07 4.18 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.92 3.40 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 0.00 0.00 0.00 0.00 38 Y 7.68 3.65 0.00 3.21 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 39 N 7.57 5.32 0.00 2.90 2.81 0.00 0.00 7.01 7.10 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 40 T 9.00 4.09 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 1.47 0.00 0.00 41 R 8.01 4.52 0.00 2.00 2.10 0.00 3.09 0.00 0.00 3.25 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.62 0.00 42 A 7.65 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 43 T 8.40 5.00 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 1.33 0.00 0.00 44 N 8.83 4.93 0.00 2.95 2.66 0.00 0.00 6.75 7.04 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 45 Y 8.75 4.85 0.00 3.04 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 46 N 8.59 4.71 0.00 2.65 2.60 0.00 0.00 6.56 7.01 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 47 A 8.37 3.62 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 48 G 8.05 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 49 D 7.56 4.73 0.00 2.70 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 50 R 8.17 3.86 0.00 2.02 2.20 0.00 3.10 0.00 0.00 3.18 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.52 0.00 51 S 7.84 4.97 0.00 3.89 3.90 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 52 T 8.77 5.12 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 0.64 0.00 0.00 53 D 8.99 5.51 0.00 2.74 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 54 Y 9.15 4.92 0.00 3.01 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 55 G 9.03 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 56 I 8.28 3.97 1.67 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 1.81 0.06 0.00 0.00 57 F 7.98 4.75 0.00 3.25 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 58 Q 7.93 3.59 0.00 2.54 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.73 6.81 0.00 0.00 0.00 0.00 0.00 2.54 2.80 0.00 59 I 8.28 4.45 2.15 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.17 1.18 0.00 0.00 60 N 9.25 5.42 0.00 3.10 3.07 0.00 0.00 6.97 7.62 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 61 S 9.07 4.71 0.00 4.05 4.37 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 62 R 8.85 3.74 0.00 1.52 1.25 0.00 2.49 0.00 0.00 2.84 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.11 0.00 63 Y 7.67 4.22 0.00 1.43 1.68 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 64 W 8.02 4.82 0.00 3.45 3.29 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 65 C 8.08 5.86 0.00 3.06 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 66 N 9.04 5.10 0.00 2.81 2.68 0.00 0.00 7.06 9.28 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 67 D 8.64 4.87 0.00 2.85 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 68 G 8.49 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 0.00 0.00 0.00 0.00 69 K 7.99 4.31 0.00 1.92 1.94 0.00 1.61 0.00 0.00 1.72 0.00 0.00 2.84 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.48 7.81 70 T 7.41 4.36 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 1.15 0.00 0.00 71 P 0.00 4.15 0.00 2.01 1.98 0.00 3.82 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 72 G 8.49 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 73 A 7.46 4.65 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 74 A 8.55 4.59 1.08 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 0.00 0.00 75 N 8.18 4.81 0.00 2.74 2.53 0.00 0.00 6.76 8.15 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 76 A 9.41 3.93 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 77 A 8.00 4.24 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 78 H 7.66 4.12 0.00 3.29 3.39 0.00 5.80 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 79 L 7.35 4.84 0.00 1.69 1.50 0.97 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.32 4.68 0.00 3.83 3.69 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 81 C 8.69 4.16 0.00 2.28 1.40 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 0.00 82 S 7.68 3.93 0.00 3.79 3.83 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 83 A 7.71 4.12 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 84 L 7.76 4.45 0.00 1.94 1.82 1.04 0.42 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 85 L 7.68 5.26 0.00 1.81 1.71 1.12 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.77 4.40 0.00 2.23 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.54 7.11 0.00 0.00 0.00 0.00 0.00 2.37 2.55 0.00 87 D 8.49 4.43 0.00 2.65 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 88 N 8.06 4.62 0.00 2.70 2.75 0.00 0.00 6.95 7.94 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 89 I 8.45 4.27 1.79 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.86 0.98 0.00 0.00 90 A 8.47 3.94 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 91 D 8.09 4.32 0.00 2.72 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 92 A 7.98 4.14 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 93 V 8.22 3.37 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 0.70 0.00 0.00 0.88 0.00 0.00 94 A 8.07 3.85 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 95 A 8.11 3.92 1.48 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 0.00 0.00 96 A 8.08 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.59 3.84 0.00 1.64 1.46 0.00 1.27 0.00 0.00 0.79 0.00 0.00 2.15 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.30 0.92 7.81 98 R 7.72 4.06 0.00 2.01 2.13 0.00 3.29 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.95 0.00 99 V 7.31 2.00 1.73 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 -0.30 0.00 0.00 -0.60 0.00 0.00 100 V 7.64 3.87 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 1.02 0.00 0.00 1.41 0.00 0.00 101 R 7.69 4.21 0.00 2.10 2.05 0.00 3.24 0.00 0.00 3.30 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.80 0.00 102 D 7.35 4.74 0.00 3.04 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 0.00 103 P 0.00 4.25 0.00 2.15 2.20 0.00 3.78 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 2.01 0.00 104 Q 8.16 4.00 0.00 2.09 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.86 0.00 0.00 0.00 0.00 0.00 2.43 2.33 0.00 105 G 8.01 3.70 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 0.00 0.00 0.00 106 I 7.72 3.73 0.96 0.00 0.00 -0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.68 -0.79 0.00 0.00 107 R 7.34 4.31 0.00 2.04 2.06 0.00 3.25 0.00 0.00 3.30 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.59 0.00 108 A 7.76 3.95 0.94 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 0.00 0.00 109 W 8.22 4.79 0.00 3.54 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 0.00 110 V 8.74 3.74 2.18 0.00 0.00 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 1.00 0.00 0.00 111 A 8.30 4.08 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 W 8.38 3.95 0.00 3.48 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 0.00 113 R 8.08 3.62 0.00 2.00 1.96 0.00 3.65 0.00 0.00 3.51 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 2.03 0.00 114 N 7.79 4.36 0.00 2.58 2.72 0.00 0.00 6.96 7.06 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 0.00 115 R 7.67 4.13 0.00 1.11 1.00 0.00 2.77 0.00 0.00 2.90 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.01 0.00 116 C 7.63 4.57 0.00 1.69 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 0.00 117 Q 6.42 3.25 0.00 0.93 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.90 0.00 0.00 0.00 0.00 0.00 2.13 2.25 0.00 118 N 8.68 4.20 0.00 2.80 2.82 0.00 0.00 6.79 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 0.00 119 R 7.32 4.56 0.00 1.85 1.79 0.00 3.24 0.00 0.00 3.09 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.56 0.00 120 D 8.53 4.58 0.00 2.64 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 0.00 121 V 8.25 4.60 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 0.87 0.00 0.00 1.07 0.00 0.00 122 R 8.15 4.04 0.00 1.82 2.02 0.00 3.16 0.00 0.00 3.24 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.83 0.00 123 Q 8.12 3.98 0.00 2.01 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.12 0.00 0.00 0.00 0.00 0.00 1.95 1.49 0.00 124 Y 7.89 4.39 0.00 3.20 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 0.00 125 V 7.77 4.34 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 0.92 0.00 0.00 1.06 0.00 0.00 126 Q 7.98 4.15 0.00 2.13 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.67 0.00 0.00 0.00 0.00 0.00 2.34 2.43 0.00 127 G 9.03 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 0.00 0.00 0.00 128 C 7.90 4.39 0.00 3.08 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 0.00 129 G 8.32 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 0.00 130 V 7.79 4.00 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 0.74 0.00 0.00 0.96 0.00 0.00