NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 17 A 4.3179 8.2644 123.5860 51.7169 21.1543 177.5666 18 R 4.0040 7.8511 115.6315 56.1970 30.8479 174.6073 19 S 4.9911 7.5856 109.1356 55.7322 67.6939 172.8288 20 L 5.0316 8.7039 122.4980 54.8400 42.2271 176.0747 21 S 4.8046 8.6781 119.8664 56.7740 66.9179 172.5484 22 I 4.9366 8.2612 122.0707 60.1222 38.9267 175.3811 23 T 3.9795 8.6572 124.2184 64.3315 68.1728 172.9781 24 T 3.2108 8.7948 126.1514 63.3345 64.7740 170.4404 25 P 4.4051 0.0000 0.0000 64.0218 32.6989 175.2046 26 E 5.1320 7.5435 119.8512 54.0156 33.1023 173.9353 27 E 4.8041 8.5052 122.9457 55.5318 33.2402 173.1714 28 M 5.1498 8.7375 124.9958 53.8598 34.9408 174.8578 29 I 4.5429 8.7013 125.8433 59.7612 40.9198 173.9563 30 E 5.0277 8.8342 127.1290 55.0725 30.7788 176.0167 31 K 4.7975 8.8471 122.3996 54.4969 37.2137 175.5494 32 A 4.7595 9.1459 124.0632 50.6960 20.4180 177.2324 33 K 4.0820 8.6368 122.0699 58.1391 32.7108 177.3131 34 G 3.9786 9.1485 114.6360 45.1513 0.0000 173.2340 35 E 4.5089 7.8135 119.1040 55.7978 31.7551 175.1972 36 T 4.9378 8.2344 110.6869 60.1061 70.6184 173.8401 37 A 4.3315 8.6750 128.8547 51.1308 20.2822 175.3684 38 Y 4.8248 8.5258 124.5956 56.1521 39.7876 175.1697 39 L 4.3292 8.3368 129.2090 52.5659 42.4232 174.0923 40 P 4.2748 0.0000 0.0000 62.2424 32.3520 178.0780 41 C 5.0458 9.1193 123.1012 55.6229 45.6899 172.2489 42 K 5.1208 8.1803 121.9100 55.0540 33.8307 175.9173 43 F 5.4735 8.7465 117.6998 55.7388 41.9638 173.3290 44 T 4.7255 8.9703 116.1951 61.9243 71.6126 173.3085 45 L 5.1928 8.6060 123.9247 53.1827 44.6388 175.7514 46 S 4.8161 9.0499 115.8520 55.8917 65.6402 173.3873 47 P 4.3000 0.0000 0.0000 65.6476 31.1613 178.0104 48 E 4.1166 8.0684 114.5604 58.6326 29.8116 177.4775 49 D 4.8796 7.8181 120.7375 53.6933 38.8337 175.7929 50 Q 4.4182 8.0340 117.9363 55.3030 29.9843 176.1744 51 G 3.9064 7.9796 108.2506 43.7719 0.0000 171.6894 52 P 4.3816 0.0000 0.0000 62.1181 31.8881 175.9674 53 L 4.2859 8.3540 123.7766 55.3997 43.0581 176.0056 54 D 4.7265 9.1033 125.8193 53.2967 43.7342 173.4066 55 I 5.2045 9.0402 127.3723 59.4472 40.4181 174.7890 56 E 5.3972 9.0379 122.2990 54.8138 33.7055 173.8478 57 W 5.2776 9.3399 120.5813 55.0318 32.4870 174.7721 58 L 5.1975 8.9588 123.0088 52.8472 45.4334 175.0736 59 I 4.3643 8.4934 121.1413 59.2847 40.9713 174.5659 60 S 4.8663 8.6806 126.3113 56.2442 63.6330 171.4497 61 P 4.8463 0.0000 0.0000 61.7965 31.2015 176.7260 62 A 4.1231 8.8655 124.9428 55.2481 18.7877 179.5854 63 D 4.4888 8.2596 115.4918 57.3636 40.6171 175.9972 64 N 4.9237 7.4770 110.4319 51.7948 40.2287 174.9174 65 Q 4.1371 8.5707 116.5379 58.2123 28.9428 177.4209 66 K 4.2809 7.2824 118.0888 56.3769 33.3802 176.7047 67 V 4.3653 7.6390 119.6080 60.8197 34.9795 174.6071 68 D 4.1962 8.1207 119.1931 55.6066 38.6686 174.2881 69 Q 4.5146 8.1230 118.1559 53.8746 31.0515 177.4533 70 V 3.9350 8.4794 124.5619 63.9551 31.2798 175.3560 71 I 4.5193 8.8370 120.6801 62.1013 39.7747 175.7997 72 I 4.9200 7.5474 120.2624 59.8400 41.3802 173.2649 73 L 5.5488 9.5536 128.2978 53.2022 45.7932 174.7055 74 Y 5.3382 9.2215 123.1477 56.0670 41.6610 174.2909 75 S 4.5545 9.1406 120.7054 57.5204 66.6249 174.2918 76 G 4.1528 9.1134 114.4824 47.5524 0.0000 172.6342 77 D 4.5976 7.8076 111.5389 53.4383 39.0321 174.1117 78 K 4.5042 7.2385 115.7496 54.5116 35.8154 175.4024 79 I 4.9286 7.9376 121.8668 59.9165 38.9139 174.9076 80 Y 4.8382 9.1430 122.7233 56.5038 40.0882 175.7516 81 D 5.2427 8.7804 123.7986 53.2508 40.6238 175.2885 82 D 4.9567 7.8288 116.6660 55.0980 41.5279 175.7381 83 Y 4.4839 8.1856 116.6857 59.1075 40.2155 175.9020 84 Y 4.5838 7.8515 123.5592 54.9853 39.1359 173.6647 85 P 4.2671 0.0000 0.0000 65.6287 31.7030 178.9250 86 D 4.3284 7.6279 116.6055 56.8016 41.0009 176.9650 87 L 4.5130 8.0700 117.2672 53.8521 41.9806 175.7598 88 K 3.8855 7.5880 120.7980 58.2559 32.0205 177.0539 89 G 3.9985 9.0071 113.8697 45.8698 0.0000 173.4239 90 R 4.7637 8.3507 117.8744 54.9900 31.7013 175.5095 91 V 5.1564 7.8715 119.2237 60.2386 34.0840 174.2298 92 H 4.8620 7.9852 121.1190 54.0362 31.7988 172.7712 93 F 4.7792 8.7437 119.8339 58.2341 38.8366 175.5607 94 T 4.3005 8.9089 113.0281 62.9698 69.5948 175.0828 95 S 4.6233 8.0025 116.8422 56.7953 63.3671 173.6246 96 N 4.5096 8.8125 124.8274 54.9135 37.7457 174.7708 97 D 4.7919 7.5363 119.6813 52.0200 40.8271 175.7475 98 L 4.3617 7.9855 125.1102 56.6067 42.6816 178.7186 99 K 4.2732 7.7576 115.7398 58.7805 32.7807 177.4759 100 S 4.2752 7.4226 113.6773 58.6344 63.1630 173.8295 101 G 2.3237 6.7402 109.4982 45.1044 0.0000 173.2175 102 D 4.8634 7.7647 119.6317 52.3968 41.9875 174.6557 103 A 5.0940 8.9561 127.3957 51.8076 20.0462 176.9605 104 S 4.7926 8.7916 115.1454 60.0829 64.1909 173.5833 105 I 4.9298 7.9352 115.1878 59.1951 41.0224 173.5711 106 N 5.2210 8.5041 120.3562 51.5766 41.2644 174.2495 107 V 4.3377 8.4862 123.8527 61.4864 33.2794 174.6329 108 T 4.4555 8.8006 119.2843 60.4772 70.9934 173.6526 109 N 4.5583 8.4193 118.6754 53.2432 37.1828 174.1015 110 L 4.2357 8.3069 120.1156 55.1900 43.0604 177.3794 111 Q 4.9316 9.4556 122.1173 53.9762 30.8850 176.9524 112 L 4.0752 8.3900 120.1161 57.9385 41.8061 179.3881 113 S 4.5019 7.9779 110.7611 59.8473 63.1789 174.2906 114 D 4.7369 7.9050 120.4453 55.1194 41.1330 176.4545 115 I 4.0316 7.8963 122.7875 61.4267 38.2017 176.0685 116 G 4.0570 8.0069 112.7936 47.0357 0.0000 170.6209 117 T 5.0856 7.9896 117.0306 62.2475 70.5459 173.7588 118 Y 4.9776 9.4902 125.1615 56.3603 40.3701 174.4247 119 Q 4.9676 9.0204 126.2036 54.3439 31.8036 173.1651 120 C 3.8016 8.4723 127.4353 54.8281 46.4421 172.1155 121 K 4.8389 8.6505 126.0648 54.4891 34.7697 175.0991 122 V 4.5550 8.6734 125.6784 60.8145 34.1208 174.3059 123 K 4.8642 8.9217 127.2655 54.6761 35.7333 175.7428 124 K 4.9387 9.1252 125.8557 54.7575 34.3134 174.0111 125 A 4.4602 8.6014 128.0916 51.6145 19.1803 176.0837 126 P 4.4529 0.0000 0.0000 63.3152 32.1936 177.0424 127 G 3.7162 8.0571 110.2889 45.9652 0.0000 172.7962 128 V 4.9115 7.9448 121.5196 61.4693 34.8393 173.4679 129 A 4.8342 8.8407 127.2548 50.8197 22.8909 174.7713 130 N 5.4292 8.4891 116.0771 51.0639 41.0398 173.6294 131 K 4.9514 8.6318 120.6584 53.7386 35.8248 174.8640 132 K 4.9897 8.6522 126.1088 54.9199 34.9039 175.2365 133 I 4.7624 8.9204 124.7784 59.9383 40.8779 174.2314 134 H 5.1435 9.2274 125.3930 54.6494 29.9157 174.0156 135 L 4.9862 8.9508 127.2596 53.6596 43.6499 175.2258 136 V 4.5249 8.6164 126.5502 61.1116 34.1919 174.4690 137 V 4.8062 8.3389 126.4270 61.3158 33.6140 174.9273 138 L 4.5387 9.2139 128.6055 53.5970 44.2484 177.5187 139 V 3.8931 8.0957 118.5820 63.1834 31.5448 175.4186 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 17 A 8.26 4.32 1.29 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 0.00 0.00 18 R 7.85 4.00 0.00 1.85 1.96 0.00 3.26 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.74 0.00 19 S 7.59 4.99 0.00 3.85 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 20 L 8.70 5.03 0.00 1.90 1.61 0.79 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 21 S 8.68 4.80 0.00 3.89 3.89 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 0.00 0.00 0.00 22 I 8.26 4.94 1.86 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.63 0.97 0.00 0.00 23 T 8.66 3.98 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 1.23 0.00 0.00 24 T 8.79 3.21 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 1.28 0.00 0.00 25 P 0.00 4.41 0.00 2.07 2.07 0.00 3.56 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 2.11 2.08 0.00 26 E 7.54 5.13 0.00 2.11 1.77 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 2.26 2.20 0.00 27 E 8.51 4.80 0.00 2.08 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.30 0.00 28 M 8.74 5.15 0.00 2.03 1.93 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.60 0.00 29 I 8.70 4.54 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.72 0.89 0.00 0.00 30 E 8.83 5.03 0.00 1.85 1.88 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 2.27 2.34 0.00 31 K 8.85 4.80 0.00 1.61 1.62 0.00 1.75 0.00 0.00 1.68 0.00 0.00 2.83 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.33 1.48 7.81 32 A 9.15 4.76 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 33 K 8.64 4.08 0.00 1.91 1.74 0.00 1.79 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.52 7.81 34 G 9.15 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 35 E 7.81 4.51 0.00 2.03 1.88 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 2.29 2.32 0.00 36 T 8.23 4.94 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 37 A 8.67 4.33 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 38 Y 8.53 4.82 0.00 2.87 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 39 L 8.34 4.33 0.00 0.89 1.44 0.20 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 40 P 0.00 4.27 0.00 1.94 1.96 0.00 3.64 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 2.05 1.99 0.00 41 C 9.12 5.05 0.00 3.18 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 42 K 8.18 5.12 0.00 1.77 1.71 0.00 1.69 0.00 0.00 1.88 0.00 0.00 2.98 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.68 1.49 7.81 43 F 8.75 5.47 0.00 3.09 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 44 T 8.97 4.73 4.28 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 1.25 0.00 0.00 45 L 8.61 5.19 0.00 1.57 1.62 1.06 0.99 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 46 S 9.05 4.82 0.00 3.88 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 47 P 0.00 4.30 0.00 2.07 2.18 0.00 3.69 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 2.04 2.09 0.00 48 E 8.07 4.12 0.00 2.07 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 0.00 2.28 2.33 0.00 49 D 7.82 4.88 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 50 Q 8.03 4.42 0.00 2.03 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.03 0.00 0.00 0.00 0.00 0.00 2.29 2.33 0.00 51 G 7.98 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 0.00 0.00 0.00 52 P 0.00 4.38 0.00 2.19 2.07 0.00 3.77 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 1.98 1.95 0.00 53 L 8.35 4.29 0.00 1.75 1.77 0.80 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 54 D 9.10 4.73 0.00 2.95 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 55 I 9.04 5.20 2.08 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.87 1.05 0.00 0.00 56 E 9.04 5.40 0.00 2.02 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 2.12 2.24 0.00 57 W 9.34 5.28 0.00 3.22 3.13 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 58 L 8.96 5.20 0.00 1.49 1.42 0.91 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 59 I 8.49 4.36 1.12 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 0.84 0.63 -0.03 0.00 0.00 60 S 8.68 4.87 0.00 3.71 3.74 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 61 P 0.00 4.85 0.00 2.27 2.06 0.00 3.98 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.11 0.00 62 A 8.87 4.12 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 0.00 0.00 63 D 8.26 4.49 0.00 2.70 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 64 N 7.48 4.92 0.00 2.84 2.91 0.00 0.00 7.06 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 Q 8.57 4.14 0.00 2.07 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 7.00 0.00 0.00 0.00 0.00 0.00 2.37 2.30 0.00 66 K 7.28 4.28 0.00 2.05 1.83 0.00 1.60 0.00 0.00 1.79 0.00 0.00 3.19 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.49 1.46 7.81 67 V 7.64 4.37 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 0.77 0.00 0.00 0.91 0.00 0.00 68 D 8.12 4.20 0.00 2.79 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 69 Q 8.12 4.51 0.00 1.88 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.91 0.00 0.00 0.00 0.00 0.00 2.31 2.58 0.00 70 V 8.48 3.93 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 0.00 0.00 0.65 0.00 0.00 71 I 8.84 4.52 1.89 0.00 0.00 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 1.25 0.89 0.64 0.00 0.00 72 I 7.55 4.92 1.81 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.59 0.63 0.00 0.00 73 L 9.55 5.55 0.00 2.02 1.78 0.93 0.90 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 74 Y 9.22 5.34 0.00 2.86 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 75 S 9.14 4.55 0.00 3.97 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 76 G 9.11 4.15 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 0.00 0.00 0.00 77 D 7.81 4.60 0.00 2.76 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 78 K 7.24 4.50 0.00 1.65 1.07 0.00 1.60 0.00 0.00 1.55 0.00 0.00 3.00 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.22 1.46 7.81 79 I 7.94 4.93 1.96 0.00 0.00 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 1.86 0.82 1.20 0.00 0.00 80 Y 9.14 4.84 0.00 3.28 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 D 8.78 5.24 0.00 2.77 2.78 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 82 D 7.83 4.96 0.00 2.53 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 0.00 0.00 0.00 0.00 83 Y 8.19 4.48 0.00 3.18 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 84 Y 7.85 4.58 0.00 3.24 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 P 0.00 4.27 0.00 2.07 2.03 0.00 3.31 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.07 0.00 86 D 7.63 4.33 0.00 2.41 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 87 L 8.07 4.51 0.00 1.99 1.78 1.02 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 88 K 7.59 3.89 0.00 1.86 1.80 0.00 1.86 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.44 7.81 89 G 9.01 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.35 4.76 0.00 1.84 2.08 0.00 3.30 0.00 0.00 3.20 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 91 V 7.87 5.16 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 0.63 0.00 0.00 0.89 0.00 0.00 92 H 7.99 4.86 0.00 3.27 3.33 0.00 5.71 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 F 8.74 4.78 0.00 3.04 3.01 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 0.00 0.00 0.00 94 T 8.91 4.30 4.42 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 1.42 0.00 0.00 95 S 8.00 4.62 0.00 4.08 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 96 N 8.81 4.51 0.00 2.88 2.95 0.00 0.00 5.91 8.06 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 97 D 7.54 4.79 0.00 2.67 2.52 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 98 L 7.99 4.36 0.00 1.38 1.10 -0.57 -0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 99 K 7.76 4.27 0.00 1.99 2.01 0.00 1.70 0.00 0.00 1.96 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.48 7.81 100 S 7.42 4.28 0.00 3.97 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 0.00 101 G 6.74 2.32 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 0.00 102 D 7.76 4.86 0.00 2.56 2.50 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 0.00 103 A 8.96 5.09 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 S 8.79 4.79 0.00 3.94 3.46 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 0.00 105 I 7.94 4.93 1.27 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.26 0.00 0.00 0.00 106 N 8.50 5.22 0.00 2.33 2.60 0.00 0.00 6.76 7.20 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 0.00 107 V 8.49 4.34 1.84 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 0.94 0.00 0.00 0.60 0.00 0.00 108 T 8.80 4.46 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 1.22 0.00 0.00 109 N 8.42 4.56 0.00 2.80 2.84 0.00 0.00 7.37 7.78 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 0.00 110 L 8.31 4.24 0.00 1.73 1.58 0.91 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 111 Q 9.46 4.93 0.00 2.06 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.01 6.79 0.00 0.00 0.00 0.00 0.00 2.43 2.48 0.00 112 L 8.39 4.08 0.00 1.72 1.74 0.93 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 113 S 7.98 4.50 0.00 4.14 4.01 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 0.00 0.00 0.00 114 D 7.90 4.74 0.00 2.94 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 0.00 115 I 7.90 4.03 1.92 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.03 0.96 0.00 0.00 116 G 8.01 4.06 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 0.00 0.00 0.00 117 T 7.99 5.09 4.20 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 1.07 0.00 0.00 118 Y 9.49 4.98 0.00 2.91 3.17 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 0.00 0.00 0.00 0.00 119 Q 9.02 4.97 0.00 2.05 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.86 0.00 0.00 0.00 0.00 0.00 2.08 2.26 0.00 120 C 8.47 3.80 0.00 1.23 2.22 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 0.00 121 K 8.65 4.84 0.00 1.54 1.54 0.00 1.76 0.00 0.00 1.48 0.00 0.00 2.71 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.19 1.18 7.81 122 V 8.67 4.55 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 0.02 0.00 0.00 0.63 0.00 0.00 123 K 8.92 4.86 0.00 1.74 1.59 0.00 1.67 0.00 0.00 1.53 0.00 0.00 2.75 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.27 1.26 7.81 124 K 9.13 4.94 0.00 1.71 1.61 0.00 1.71 0.00 0.00 1.76 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.48 1.46 7.81 125 A 8.60 4.46 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 0.00 126 P 0.00 4.45 0.00 2.18 2.16 0.00 4.00 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 127 G 8.06 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 0.00 128 V 7.94 4.91 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 0.72 0.00 0.00 0.94 0.00 0.00 129 A 8.84 4.83 1.15 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 0.00 0.00 130 N 8.49 5.43 0.00 2.61 2.64 0.00 0.00 5.76 7.13 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 0.00 131 K 8.63 4.95 0.00 1.73 1.47 0.00 1.75 0.00 0.00 1.85 0.00 0.00 2.94 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.29 1.31 7.81 132 K 8.65 4.99 0.00 1.89 1.58 0.00 1.65 0.00 0.00 1.81 0.00 0.00 2.81 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.39 1.40 7.81 133 I 8.92 4.76 2.04 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.91 0.94 0.00 0.00 134 H 9.23 5.14 0.00 3.19 3.31 0.00 5.79 0.00 0.00 0.00 0.00 6.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 L 8.95 4.99 0.00 1.66 1.68 0.90 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 136 V 8.62 4.52 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 0.89 0.00 0.00 0.97 0.00 0.00 137 V 8.34 4.81 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 0.91 0.00 0.00 0.95 0.00 0.00 138 L 9.21 4.54 0.00 1.59 1.58 0.93 0.67 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 0.00 139 V 8.10 3.89 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 0.78 0.00 0.00 0.94 0.00 0.00