NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.7496 8.3544 109.7340 44.6294 0.0000 177.2097 2 S 3.3267 6.3645 119.7301 57.7789 63.3490 166.5679 3 H 4.4693 8.7530 117.7492 56.7819 26.1493 175.2303 4 M 4.7596 7.7572 114.3385 54.1942 35.0690 174.0114 5 P 4.5764 0.0000 0.0000 63.5515 31.7546 177.3477 6 E 3.9485 8.2997 119.2907 59.9300 29.2283 179.3362 7 K 3.9633 7.9534 117.6979 59.3938 32.3044 179.1918 8 K 3.9455 8.0505 119.8671 59.5592 31.9058 179.3714 9 V 3.6257 7.6670 110.9846 64.1270 31.9957 178.0020 10 A 4.1453 8.1749 120.8266 55.2018 18.4841 179.5325 11 E 3.9241 8.3688 115.9898 59.5810 29.6316 178.9900 12 A 4.1675 8.1567 121.0313 54.0148 18.4349 179.0680 13 E 3.9326 8.0251 118.4303 58.8056 29.2962 178.7596 14 K 3.9532 8.0052 118.6967 59.7549 32.5398 178.9465 15 K 3.9363 7.6588 119.6706 59.3102 32.2579 179.0243 16 V 3.6625 7.9705 118.0142 65.3740 31.2115 177.6566 17 E 4.0174 8.1255 118.5151 59.2421 29.4412 178.3638 18 E 3.8917 7.8735 117.9382 59.0982 29.6953 178.5565 19 A 3.9713 8.1188 120.8600 55.1481 18.3707 179.4657 20 K 3.8199 8.1654 117.9996 59.5214 32.0641 178.6617 21 K 3.8428 8.0780 118.8947 59.6268 32.5107 178.2779 22 K 4.0728 8.3026 119.5657 59.3878 32.0556 178.6360 23 A 4.0455 8.0605 121.1908 55.1587 18.2858 179.4310 24 E 3.9642 8.5707 117.1648 59.2337 29.5827 178.9567 25 D 4.3581 8.0042 118.0029 56.8771 41.2980 177.6316 26 Q 4.3123 7.8582 117.3729 57.2550 28.6770 177.7195 27 K 4.0036 8.2256 121.4639 59.3183 32.2266 178.0624 28 E 3.9765 8.3526 119.7344 59.6326 29.3802 178.0362 29 E 3.9958 7.8668 117.9920 59.5771 29.3670 178.9776 30 D 5.0333 7.9115 113.3927 54.8531 41.3517 176.9155 31 R 4.6660 7.8250 110.9118 54.2558 31.4477 176.1842 32 R 4.3341 8.2465 117.5394 57.2776 30.6430 176.3500 33 N 5.1845 8.4119 116.8090 52.8528 39.3299 175.7923 34 Y 3.5442 8.3815 117.8204 62.1333 37.9142 176.9436 35 P 4.1544 0.0000 0.0000 65.0773 32.1127 177.4691 36 T 4.3000 7.9803 107.3153 60.5009 70.4873 173.8911 37 N 4.3692 7.4566 118.5969 54.2803 36.8660 174.4605 38 T 4.2815 7.9404 112.5937 65.6038 70.5472 178.9019 39 Y 3.7132 8.2199 119.2345 59.4256 40.4643 176.1847 40 K 3.7597 5.7666 120.6888 54.9133 31.1179 178.6805 41 T 4.0984 7.2977 111.0109 60.7520 68.6583 175.4083 42 L 3.8818 8.4734 129.2771 57.8652 41.3964 178.8895 43 E 3.9985 8.3118 117.1748 59.7207 29.1001 178.6794 44 L 4.0878 8.1905 121.0564 58.2972 42.1167 178.9325 45 E 4.1648 8.0394 117.8408 59.1814 29.5016 179.0620 46 I 3.6528 8.2590 120.2870 64.4952 37.1639 178.1354 47 A 3.9642 7.7846 121.0739 55.2538 18.2582 179.2876 48 E 3.8842 8.6646 118.1785 59.4121 29.7317 179.1622 49 S 4.0819 8.3609 115.4851 61.8022 62.7866 176.2054 50 D 4.3436 8.1003 120.6250 57.3270 40.8413 178.4687 51 V 3.6060 8.2220 119.2551 66.0094 31.5915 177.7675 52 E 4.0456 8.4727 117.8073 58.5996 29.2050 179.2946 53 V 3.6555 7.5766 118.5551 65.3759 31.5266 178.0055 54 K 3.8756 7.7484 119.5864 59.2559 32.2592 178.3511 55 K 3.7897 8.1549 119.9572 60.0040 32.0357 178.2484 56 A 4.1937 8.0335 120.5297 55.0391 18.2121 179.3917 57 E 3.9093 8.4474 117.4681 59.6801 29.1492 179.5354 58 L 3.9899 7.9067 118.8659 57.7842 41.4906 179.4919 59 E 4.0342 8.1184 118.3142 59.4699 29.3429 179.4262 60 L 4.0204 8.0168 118.9448 57.4744 41.7049 179.5418 61 V 3.5574 8.0286 118.5593 65.7886 31.2615 178.1210 62 K 4.0190 7.7192 117.0922 59.5675 31.8441 178.7125 63 E 4.2604 7.6805 116.5161 57.8817 29.5405 178.6158 64 E 4.1007 8.4663 118.7545 57.9555 30.0475 177.7727 65 A 4.5920 7.5175 120.6125 50.8237 20.1149 177.4702 66 K 4.1306 8.1414 116.6216 57.9147 32.5962 176.0932 67 E 4.6428 7.4824 117.6116 54.9237 31.9972 173.4340 68 P 4.4070 0.0000 0.0000 63.1801 31.9036 176.1859 69 R 3.9024 7.6324 117.8046 57.4137 28.4598 178.4531 70 N 4.6496 7.3615 116.0619 52.0487 36.2182 173.1681 71 E 3.8400 8.2598 124.8216 59.3944 29.9073 177.7771 72 E 4.1104 8.1980 117.8237 59.0739 29.4859 179.1889 73 K 4.0371 8.4025 119.3673 59.0239 32.1372 179.5893 74 V 3.6174 7.7402 119.0553 64.8730 31.1968 178.5275 75 K 3.9232 7.6862 117.9024 58.9334 31.7800 178.7692 76 Q 3.9259 8.3703 120.1078 59.6053 28.8188 178.9390 77 A 4.0303 7.9962 121.2550 54.6613 18.2848 179.4271 78 K 3.8062 8.3144 118.3964 59.7996 32.0597 178.8963 79 A 4.0474 7.6274 119.2043 54.9985 18.3556 179.2963 80 E 4.0668 7.8959 117.2556 59.7672 29.6377 179.8595 81 V 3.7257 8.1183 112.3090 63.8145 31.5588 178.1972 82 E 4.0059 8.6079 119.9848 59.2948 29.3919 179.0143 83 S 4.1496 7.8412 115.4795 61.4189 62.8244 176.7445 84 K 4.0602 7.9032 120.8291 58.9237 31.7684 179.1358 85 K 3.8775 8.5155 120.4270 59.5311 32.0629 178.6650 86 A 3.9782 8.1701 120.9940 55.1195 18.2155 179.5480 87 E 3.8626 8.3234 116.9104 59.4611 29.4113 179.1070 88 A 3.9905 8.0947 120.8802 55.8759 17.9269 179.9392 89 T 3.8922 8.2525 114.0838 66.5726 68.3365 177.4137 90 R 4.0230 8.4257 120.6682 59.0490 29.9528 178.9782 91 L 3.9955 8.0293 119.0593 57.6082 41.4776 178.9377 92 E 3.9051 7.8988 119.3403 59.1194 29.3855 179.2392 93 K 4.0771 7.6559 117.5817 59.4282 32.1655 179.3220 94 I 3.7328 7.4602 120.3982 64.1762 36.9944 178.5773 95 K 4.0350 8.2715 119.8409 60.2763 32.3169 179.4591 96 T 3.8391 7.5659 115.4474 66.4169 68.4108 176.2753 97 D 4.3007 8.5082 120.3960 57.2387 41.1411 178.1314 98 R 3.8365 8.3979 119.0195 59.2868 30.0210 178.5157 99 K 3.8229 8.1174 119.2443 59.7167 31.9504 178.8796 100 K 3.9295 7.8015 116.9690 59.7064 32.5131 178.7755 101 A 4.1411 7.7893 121.5773 54.8174 18.5257 178.7274 102 E 4.2441 8.1274 112.8325 56.5526 31.3088 177.3527 103 E 4.3284 7.3988 122.2107 55.9241 27.8971 177.3062 104 E 4.1459 7.7576 116.7990 56.6096 30.0998 177.3827 105 A 3.7855 8.1251 116.4875 54.1664 16.2521 178.5879 106 K 4.0474 8.6480 122.5669 59.9659 32.8146 179.7497 107 R 4.3208 7.7052 118.8509 55.2475 27.9641 177.2735 108 K 3.9966 7.8656 115.5198 57.2873 33.1302 177.9923 109 A 3.7390 7.8212 119.7908 53.0978 16.8930 177.8706 110 A 4.6700 7.7857 117.0539 53.3957 20.7425 178.6689 111 E 4.0822 8.2708 116.2880 57.9664 30.0127 178.0930 112 E 4.0486 8.0741 123.3932 57.8247 30.5613 175.3858 113 D 4.3830 8.0021 117.1172 57.2451 40.8656 178.1769 114 K 4.0553 8.2609 118.8925 59.7827 31.9236 178.8706 115 V 3.7486 7.7366 120.1088 64.8176 31.0584 178.1833 116 K 4.1003 7.7385 118.5521 59.1906 32.4251 178.2969 117 E 4.4629 7.9158 118.1201 56.6940 31.6558 176.4348 118 K 4.5762 7.9246 117.6996 53.5228 32.3942 174.4483 119 P 4.4162 0.0000 0.0000 62.8039 31.2681 177.3397 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 S 6.36 3.33 0.00 3.99 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 3 H 8.75 4.47 0.00 3.23 3.61 0.00 5.73 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 4 M 7.76 4.76 0.00 1.98 2.01 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.52 0.00 5 P 0.00 4.58 0.00 2.29 2.29 0.00 3.79 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.10 0.00 6 E 8.30 3.95 0.00 2.00 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 0.00 2.42 2.39 0.00 7 K 7.95 3.96 0.00 1.82 1.88 0.00 1.69 0.00 0.00 1.75 0.00 0.00 2.94 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.58 1.54 7.81 8 K 8.05 3.95 0.00 1.83 1.88 0.00 1.36 0.00 0.00 1.53 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.29 1.46 7.81 9 V 7.67 3.63 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 0.93 0.00 0.00 1.01 0.00 0.00 10 A 8.17 4.15 1.35 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 0.00 0.00 0.00 11 E 8.37 3.92 0.00 2.22 2.29 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 2.56 2.33 0.00 12 A 8.16 4.17 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 13 E 8.03 3.93 0.00 2.17 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 0.00 2.30 2.31 0.00 14 K 8.01 3.95 0.00 2.02 2.21 0.00 1.56 0.00 0.00 1.82 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.60 1.50 7.81 15 K 7.66 3.94 0.00 1.99 2.03 0.00 1.53 0.00 0.00 1.57 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.49 7.81 16 V 7.97 3.66 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 0.93 0.00 0.00 0.96 0.00 0.00 17 E 8.13 4.02 0.00 2.25 1.97 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 2.46 2.45 0.00 18 E 7.87 3.89 0.00 2.08 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 0.00 2.31 2.33 0.00 19 A 8.12 3.97 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 20 K 8.17 3.82 0.00 1.96 1.97 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.45 7.81 21 K 8.08 3.84 0.00 1.87 2.00 0.00 1.86 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.46 7.81 22 K 8.30 4.07 0.00 1.91 1.79 0.00 1.67 0.00 0.00 1.65 0.00 0.00 3.06 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.50 7.81 23 A 8.06 4.05 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 24 E 8.57 3.96 0.00 2.14 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 2.34 2.46 0.00 25 D 8.00 4.36 0.00 2.86 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 26 Q 7.86 4.31 0.00 2.28 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.79 0.00 0.00 0.00 0.00 0.00 2.41 2.41 0.00 27 K 8.23 4.00 0.00 2.01 1.93 0.00 1.58 0.00 0.00 1.76 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.56 1.52 7.81 28 E 8.35 3.98 0.00 2.14 2.15 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 2.33 2.40 0.00 29 E 7.87 4.00 0.00 2.25 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 0.00 2.33 2.41 0.00 30 D 7.91 5.03 0.00 2.90 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 R 7.83 4.67 0.00 1.89 1.90 0.00 3.09 0.00 0.00 3.15 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.56 0.00 32 R 8.25 4.33 0.00 1.87 2.26 0.00 3.62 0.00 0.00 3.20 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.79 0.00 33 N 8.41 5.18 0.00 2.90 2.97 0.00 0.00 7.37 7.18 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 34 Y 8.38 3.54 0.00 3.17 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 35 P 0.00 4.15 0.00 2.28 2.12 0.00 3.87 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.25 0.00 36 T 7.98 4.30 4.26 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 1.22 0.00 0.00 37 N 7.46 4.37 0.00 2.46 2.87 0.00 0.00 6.85 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 38 T 7.94 4.28 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 1.18 0.00 0.00 39 Y 8.22 3.71 0.00 2.90 2.85 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 40 K 5.77 3.76 0.00 0.79 1.03 0.00 1.66 0.00 0.00 1.61 0.00 0.00 3.22 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.14 1.16 7.81 41 T 7.30 4.10 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 1.23 0.00 0.00 42 L 8.47 3.88 0.00 1.63 1.75 0.90 0.84 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 43 E 8.31 4.00 0.00 2.18 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 2.35 2.38 0.00 44 L 8.19 4.09 0.00 1.75 1.82 0.99 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 45 E 8.04 4.16 0.00 2.03 1.97 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 2.40 2.39 0.00 46 I 8.26 3.65 2.07 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 1.68 0.77 0.90 0.00 0.00 47 A 7.78 3.96 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 48 E 8.66 3.88 0.00 2.08 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 2.31 2.36 0.00 49 S 8.36 4.08 0.00 4.04 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 50 D 8.10 4.34 0.00 2.80 2.66 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 51 V 8.22 3.61 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 1.00 0.00 0.00 0.97 0.00 0.00 52 E 8.47 4.05 0.00 2.15 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 2.33 2.42 0.00 53 V 7.58 3.66 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 1.02 0.00 0.00 1.03 0.00 0.00 54 K 7.75 3.88 0.00 2.11 1.77 0.00 1.61 0.00 0.00 1.57 0.00 0.00 2.97 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.48 7.81 55 K 8.15 3.79 0.00 1.93 2.03 0.00 1.70 0.00 0.00 1.65 0.00 0.00 3.10 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.45 1.65 7.81 56 A 8.03 4.19 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 57 E 8.45 3.91 0.00 2.18 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 2.32 2.55 0.00 58 L 7.91 3.99 0.00 1.77 1.71 0.96 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 59 E 8.12 4.03 0.00 2.23 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 2.33 2.52 0.00 60 L 8.02 4.02 0.00 1.77 1.71 0.92 0.90 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 61 V 8.03 3.56 2.19 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 0.95 0.00 0.00 0.97 0.00 0.00 62 K 7.72 4.02 0.00 2.03 1.83 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.64 7.81 63 E 7.68 4.26 0.00 1.89 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 2.34 2.44 0.00 64 E 8.47 4.10 0.00 2.11 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 2.53 2.41 0.00 65 A 7.52 4.59 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 66 K 8.14 4.13 0.00 1.85 1.87 0.00 1.76 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.63 1.55 7.81 67 E 7.48 4.64 0.00 1.96 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 2.31 2.40 0.00 68 P 0.00 4.41 0.00 2.22 2.28 0.00 3.84 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 1.98 0.00 69 R 7.63 3.90 0.00 1.93 1.98 0.00 3.32 0.00 0.00 3.23 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.69 0.00 70 N 7.36 4.65 0.00 2.85 2.71 0.00 0.00 6.87 7.53 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 71 E 8.26 3.84 0.00 2.07 1.97 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 2.39 2.44 0.00 72 E 8.20 4.11 0.00 2.22 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 2.40 2.40 0.00 73 K 8.40 4.04 0.00 1.75 1.84 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.63 1.58 7.81 74 V 7.74 3.62 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 0.80 0.00 0.00 0.98 0.00 0.00 75 K 7.69 3.92 0.00 2.01 1.89 0.00 1.70 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.66 1.59 7.81 76 Q 8.37 3.93 0.00 2.12 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.81 0.00 0.00 0.00 0.00 0.00 2.44 2.40 0.00 77 A 8.00 4.03 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 78 K 8.31 3.81 0.00 1.94 1.89 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.46 7.81 79 A 7.63 4.05 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 80 E 7.90 4.07 0.00 2.13 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 2.32 2.49 0.00 81 V 8.12 3.73 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 0.89 0.00 0.00 1.01 0.00 0.00 82 E 8.61 4.01 0.00 2.12 2.12 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 2.30 2.35 0.00 83 S 7.84 4.15 0.00 4.02 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 84 K 7.90 4.06 0.00 1.90 1.85 0.00 1.77 0.00 0.00 1.74 0.00 0.00 2.89 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.69 1.43 7.81 85 K 8.52 3.88 0.00 1.78 1.98 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.59 7.81 86 A 8.17 3.98 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 87 E 8.32 3.86 0.00 2.20 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 2.33 2.50 0.00 88 A 8.09 3.99 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.25 3.89 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 1.21 0.00 0.00 90 R 8.43 4.02 0.00 2.01 1.97 0.00 3.19 0.00 0.00 3.16 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.77 0.00 91 L 8.03 4.00 0.00 1.85 1.70 0.94 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 92 E 7.90 3.91 0.00 2.09 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 2.30 2.35 0.00 93 K 7.66 4.08 0.00 2.04 1.83 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.65 7.81 94 I 7.46 3.73 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 1.71 0.77 0.88 0.00 0.00 95 K 8.27 4.03 0.00 1.95 2.05 0.00 1.30 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.47 7.81 96 T 7.57 3.84 4.38 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 1.20 0.00 0.00 97 D 8.51 4.30 0.00 2.79 2.64 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 0.00 98 R 8.40 3.84 0.00 2.07 2.08 0.00 3.14 0.00 0.00 3.04 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.62 0.00 99 K 8.12 3.82 0.00 1.92 1.97 0.00 1.63 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.46 7.81 100 K 7.80 3.93 0.00 1.95 1.92 0.00 1.54 0.00 0.00 1.70 0.00 0.00 3.35 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.46 1.76 7.81 101 A 7.79 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 0.00 102 E 8.13 4.24 0.00 2.11 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 0.00 2.46 2.30 0.00 103 E 7.40 4.33 0.00 2.26 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 2.31 2.38 0.00 104 E 7.76 4.15 0.00 2.11 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 2.44 2.30 0.00 105 A 8.13 3.79 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 0.00 106 K 8.65 4.05 0.00 1.74 1.89 0.00 1.72 0.00 0.00 1.70 0.00 0.00 3.21 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.58 1.56 7.81 107 R 7.71 4.32 0.00 1.84 1.88 0.00 3.38 0.00 0.00 3.41 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.56 0.00 108 K 7.87 4.00 0.00 1.86 1.93 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.40 1.58 7.81 109 A 7.82 3.74 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 0.00 110 A 7.79 4.67 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 0.00 111 E 8.27 4.08 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 2.28 2.24 0.00 112 E 8.07 4.05 0.00 2.24 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 0.00 2.19 2.23 0.00 113 D 8.00 4.38 0.00 2.82 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 0.00 114 K 8.26 4.06 0.00 2.01 2.25 0.00 1.57 0.00 0.00 1.87 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.50 1.52 7.81 115 V 7.74 3.75 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 0.91 0.00 0.00 0.93 0.00 0.00 116 K 7.74 4.10 0.00 1.90 1.99 0.00 1.59 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.57 1.48 7.81 117 E 7.92 4.46 0.00 2.10 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 2.25 2.38 0.00 118 K 7.92 4.58 0.00 1.67 1.70 0.00 1.72 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.47 7.81 119 P 0.00 4.42 0.00 2.17 2.03 0.00 3.79 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00