NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 M 4.3866 8.2893 120.3451 55.4257 32.9671 174.5936 1 I 4.2360 8.1256 119.9847 59.1725 39.4879 173.4461 2 Q 4.9032 9.2628 121.5205 54.3801 33.0423 175.9508 3 R 4.7391 9.3297 123.0356 54.4806 33.4934 174.9523 4 T 4.7111 8.9161 118.8409 60.1979 68.3831 172.3056 5 P 4.7734 0.0000 0.0000 62.8632 32.2084 176.1764 6 K 4.3903 9.3753 123.2383 56.5070 33.5412 176.0931 7 I 5.1835 8.2357 123.0579 59.8417 40.9398 174.6485 8 Q 4.9323 9.3584 125.4071 53.9974 32.5465 174.5649 9 V 5.1627 8.5304 123.1434 60.2557 33.8093 174.2605 10 Y 5.3000 8.4812 121.6543 56.5543 41.6376 173.1881 11 S 5.0735 9.0111 114.6020 56.9288 64.8406 174.3152 12 R 4.1241 8.9000 122.6031 59.3586 30.1345 176.4746 13 H 5.1225 8.3971 113.6081 52.7126 31.6075 172.1866 14 P 4.2836 0.0000 0.0000 63.0771 31.6005 176.2417 15 A 4.2551 8.7507 125.8454 51.9840 19.0975 176.3732 16 E 4.5668 8.5901 123.2218 53.8753 32.0090 174.5249 17 N 4.6246 8.9196 123.6180 55.4495 38.9009 175.4943 18 G 3.9550 9.1753 112.1028 45.0625 0.0000 173.2670 19 K 4.3978 7.5165 119.2719 54.4068 33.4719 176.3844 20 S 4.1836 8.3509 118.4713 59.0880 63.2617 172.6000 21 N 5.0540 8.7389 123.6255 52.8672 42.9502 171.9651 22 F 5.2369 8.9737 116.3037 55.6700 42.7721 174.0580 23 L 3.9100 8.7250 126.4385 53.6374 43.3363 174.7775 24 N 5.3463 8.7804 123.8948 51.4077 41.7793 172.8123 25 C 5.3866 9.4718 123.1706 55.1174 46.7980 171.8338 26 Y 5.4377 9.4658 129.2502 56.4199 40.2527 174.4447 27 V 5.0843 8.7509 121.0719 59.7516 34.4149 175.2874 28 S 5.0041 8.9765 118.6030 57.9931 66.8889 174.8061 29 G 4.2815 8.6517 106.8683 46.8032 0.0000 173.3253 30 F 5.3432 7.4442 114.1500 55.6778 41.1773 174.0534 31 H 5.2136 8.9386 117.8593 54.6728 33.7698 171.7773 32 P 5.0564 0.0000 0.0000 62.6269 31.9450 176.2173 33 S 4.0875 8.4609 113.1820 60.1690 63.2647 174.2348 34 D 4.3852 7.9752 121.3839 54.7213 40.7004 175.1834 35 I 4.7442 7.9737 123.1217 59.6640 41.4636 173.3758 36 E 4.6882 9.0342 126.6809 54.4626 32.7450 175.1530 37 V 4.5437 8.0330 123.1495 61.1182 34.2490 173.9737 38 D 5.0006 9.1247 127.8174 52.4663 44.1422 175.0591 39 L 4.9886 8.3392 121.7742 53.3621 44.1634 175.3249 40 L 5.2492 9.1688 122.9211 52.7425 45.4956 175.2953 41 K 4.2891 8.9927 124.7341 54.7115 34.4453 175.7864 42 N 4.2062 10.1150 127.1421 54.2001 36.7327 175.5259 43 G 4.0009 8.5348 106.5164 45.1007 0.0000 173.9524 44 E 4.5249 7.7983 119.2528 54.3857 31.1239 175.2130 45 R 4.4253 8.3316 123.2163 56.4999 30.7162 175.9962 46 I 4.0890 8.7416 128.5525 61.2996 37.1213 175.7114 47 E 4.2688 8.8032 125.7161 56.0357 31.4505 176.7452 48 K 3.9637 8.7086 119.5339 57.1857 29.4742 176.2007 49 V 3.6249 7.1204 119.8333 63.4545 31.8058 175.5812 50 E 4.5262 8.3657 127.3412 55.4209 31.8833 174.4734 51 H 5.3154 7.7440 115.3226 54.0071 31.5117 173.1851 52 S 4.5605 8.7140 115.3562 58.1238 64.1500 173.3318 53 D 4.5894 8.4672 120.2586 53.2101 41.4553 176.3751 54 L 3.9717 8.5103 124.9391 56.3272 42.6026 175.8912 55 S 4.7492 8.2610 119.3441 56.9403 66.7048 171.8112 56 F 5.2852 7.5091 115.0687 55.5171 41.0027 174.4299 57 S 4.7227 9.1416 117.0595 57.0616 64.3565 175.5612 58 K 3.6457 8.4861 120.0642 59.3813 31.6736 177.7967 59 D 4.5272 7.8952 116.0380 52.6286 39.4375 177.4003 60 W 3.6380 7.9472 119.0775 56.9955 28.2192 174.7269 61 S 4.2658 8.0744 113.9984 58.1818 64.0215 173.8775 62 F 5.0737 8.4033 120.9277 57.0416 40.5740 174.3006 63 Y 5.5333 8.3253 117.9032 55.8416 41.6304 174.0059 64 L 5.2093 9.6470 120.6513 53.2903 47.0603 174.6645 65 L 5.4376 9.2955 124.2957 53.8006 44.6453 174.5487 66 Y 5.2605 9.3197 124.4501 56.6493 40.7222 174.3694 67 Y 5.4038 8.7633 120.4591 56.5338 42.0026 173.4671 68 T 4.9923 8.7135 114.4435 60.6999 71.4614 172.6376 69 E 4.1466 8.6687 126.8132 56.4796 30.1966 176.0723 70 F 4.8637 8.8933 117.4732 55.9625 42.1223 173.4617 71 T 4.3580 8.0758 116.0087 60.6352 70.4608 172.2571 72 P 4.5774 0.0000 0.0000 62.9378 32.7436 175.7225 73 T 4.9341 8.4564 111.2807 59.4664 72.0083 173.3258 74 E 4.1277 8.8576 121.5965 58.5827 29.8523 177.4691 75 K 4.2897 7.9568 116.4121 58.4752 33.7606 177.0765 76 D 4.5414 8.1166 119.7795 54.2031 41.3022 175.2386 77 E 4.7456 9.3474 124.3332 55.3394 31.5246 174.8623 78 Y 5.3865 8.8547 120.4871 56.6181 42.1016 174.2666 79 A 5.0889 8.8067 122.2617 51.3520 23.8120 174.0930 80 C 5.3327 9.1750 119.1667 54.7521 43.8478 172.5545 81 R 5.1376 9.2358 126.7267 54.4996 32.3086 174.3835 82 V 4.7972 8.8495 126.3699 60.9785 34.6772 173.4873 83 N 5.2965 9.1040 126.3310 52.1810 41.8722 172.4541 84 H 5.1347 8.4916 123.6803 54.6184 33.1925 174.4221 85 V 3.5895 8.1602 122.4672 64.7031 31.2850 177.4301 86 T 4.1145 7.9950 109.5052 62.7468 69.1879 173.5204 87 L 4.7150 7.6561 123.5208 52.9471 43.2112 176.9464 88 S 4.3356 8.6711 118.2219 60.5107 63.5831 173.9532 89 Q 4.5936 7.5247 116.6022 53.5825 31.1845 172.2601 90 P 4.4940 0.0000 0.0000 62.9428 32.2789 175.5582 91 K 4.4512 9.0166 125.2999 55.2032 33.8766 174.9712 92 I 4.9034 8.3574 127.9766 59.5518 39.4104 174.9710 93 V 4.4127 8.5244 126.8349 60.8802 33.8091 174.8262 94 K 4.7091 8.7487 127.6542 55.7381 33.0689 176.6723 95 W 4.5159 9.3447 135.0000 57.4517 31.4824 174.8455 96 D 4.4191 8.4530 126.3643 51.8467 42.3995 176.3705 97 R 3.6651 7.5810 123.5362 58.3038 29.4145 176.8332 98 D 4.7445 7.9847 117.5775 54.4306 41.1645 176.3583 99 M 4.3874 8.1626 125.3344 55.5570 32.9108 175.0534 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 0 M 8.29 4.39 0.00 1.97 2.06 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.61 0.00 1 I 8.13 4.24 1.87 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 1.30 0.81 0.88 0.00 0.00 2 Q 9.26 4.90 0.00 1.95 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.71 0.00 0.00 0.00 0.00 0.00 2.31 2.39 0.00 3 R 9.33 4.74 0.00 1.91 1.99 0.00 3.15 0.00 0.00 3.16 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 4 T 8.92 4.71 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 1.25 0.00 0.00 5 P 0.00 4.77 0.00 1.98 1.70 0.00 3.78 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.73 0.00 6 K 9.38 4.39 0.00 1.87 1.82 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.86 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.47 7.81 7 I 8.24 5.18 1.91 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 1.31 0.59 0.95 0.00 0.00 8 Q 9.36 4.93 0.00 2.32 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.75 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 9 V 8.53 5.16 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 1.00 0.00 0.00 1.06 0.00 0.00 10 Y 8.48 5.30 0.00 3.20 3.20 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 0.00 11 S 9.01 5.07 0.00 4.33 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 12 R 8.90 4.12 0.00 1.84 2.18 0.00 3.07 0.00 0.00 2.99 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.46 0.00 13 H 8.40 5.12 0.00 3.34 3.23 0.00 5.93 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 P 0.00 4.28 0.00 2.10 2.09 0.00 3.78 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.18 0.00 15 A 8.75 4.26 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 16 E 8.59 4.57 0.00 1.98 1.78 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 2.26 2.30 0.00 17 N 8.92 4.62 0.00 2.77 2.80 0.00 0.00 7.31 7.65 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 18 G 9.18 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 0.00 0.00 0.00 19 K 7.52 4.40 0.00 1.91 1.70 0.00 1.81 0.00 0.00 1.61 0.00 0.00 2.72 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.38 1.46 7.81 20 S 8.35 4.18 0.00 3.79 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 21 N 8.74 5.05 0.00 2.52 2.36 0.00 0.00 6.81 8.30 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 22 F 8.97 5.24 0.00 3.02 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 23 L 8.72 3.91 0.00 0.27 0.67 -0.14 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 24 N 8.78 5.35 0.00 1.44 2.03 0.00 0.00 5.98 7.59 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 25 C 9.47 5.39 0.00 2.90 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 26 Y 9.47 5.44 0.00 3.38 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 27 V 8.75 5.08 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 0.59 0.00 0.00 1.08 0.00 0.00 28 S 8.98 5.00 0.00 3.85 3.35 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 29 G 8.65 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 0.00 0.00 0.00 0.00 30 F 7.44 5.34 0.00 3.04 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 31 H 8.94 5.21 0.00 3.30 3.22 0.00 5.59 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 32 P 0.00 5.06 0.00 2.16 2.17 0.00 3.93 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.00 0.00 33 S 8.46 4.09 0.00 3.23 2.63 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 34 D 7.98 4.39 0.00 2.67 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 35 I 7.97 4.74 1.60 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.59 0.84 0.00 0.00 36 E 9.03 4.69 0.00 1.87 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 2.21 0.00 37 V 8.03 4.54 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 0.24 0.00 0.00 0.45 0.00 0.00 38 D 9.12 5.00 0.00 2.49 2.47 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 39 L 8.34 4.99 0.00 1.57 1.53 0.86 0.52 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 40 L 9.17 5.25 0.00 1.51 1.51 0.92 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 41 K 8.99 4.29 0.00 1.83 1.62 0.00 1.93 0.00 0.00 1.66 0.00 0.00 2.82 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.12 0.78 7.81 42 N 10.12 4.21 0.00 2.74 2.79 0.00 0.00 7.29 7.85 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 43 G 8.53 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 44 E 7.80 4.52 0.00 2.11 1.85 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 2.23 2.35 0.00 45 R 8.33 4.43 0.00 1.81 1.84 0.00 3.22 0.00 0.00 3.22 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 46 I 8.74 4.09 1.95 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.77 0.93 0.00 0.00 47 E 8.80 4.27 0.00 1.92 1.85 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 2.36 2.33 0.00 48 K 8.71 3.96 0.00 1.89 1.91 0.00 1.64 0.00 0.00 1.63 0.00 0.00 3.05 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.32 1.46 7.81 49 V 7.12 3.62 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 0.79 0.00 0.00 0.96 0.00 0.00 50 E 8.37 4.53 0.00 1.16 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 2.09 2.18 0.00 51 H 7.74 5.32 0.00 2.25 2.01 0.00 5.72 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 S 8.71 4.56 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 53 D 8.47 4.59 0.00 2.70 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 54 L 8.51 3.97 0.00 1.62 1.62 0.78 0.54 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 55 S 8.26 4.75 0.00 3.72 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 56 F 7.51 5.29 0.00 2.83 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 57 S 9.14 4.72 0.00 4.12 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 58 K 8.49 3.65 0.00 1.65 1.74 0.00 1.67 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.33 1.35 7.81 59 D 7.90 4.53 0.00 2.79 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 60 W 7.95 3.64 0.00 3.28 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 61 S 8.07 4.27 0.00 3.87 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 62 F 8.40 5.07 0.00 1.51 2.45 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 0.00 63 Y 8.33 5.53 0.00 3.04 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 64 L 9.65 5.21 0.00 1.90 1.72 1.20 0.38 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 65 L 9.30 5.44 0.00 2.06 1.71 1.09 0.87 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 66 Y 9.32 5.26 0.00 2.98 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 67 Y 8.76 5.40 0.00 3.04 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 68 T 8.71 4.99 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 1.10 0.00 0.00 69 E 8.67 4.15 0.00 1.71 1.50 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 1.47 2.17 0.00 70 F 8.89 4.86 0.00 2.73 2.63 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 71 T 8.08 4.36 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 1.12 0.00 0.00 72 P 0.00 4.58 0.00 2.29 2.14 0.00 3.35 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.67 0.00 73 T 8.46 4.93 4.30 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 1.36 0.00 0.00 74 E 8.86 4.13 0.00 1.98 2.05 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 2.31 2.32 0.00 75 K 7.96 4.29 0.00 1.91 1.93 0.00 1.64 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.38 1.48 7.81 76 D 8.12 4.54 0.00 2.88 2.44 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 77 E 9.35 4.75 0.00 1.85 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 2.28 0.00 78 Y 8.85 5.39 0.00 3.14 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 79 A 8.81 5.09 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 80 C 9.17 5.33 0.00 2.98 2.92 0.00 0.00 0.00 0.00 0.00 0.00 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 9.24 5.14 0.00 1.83 1.69 0.00 3.05 0.00 0.00 3.07 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.50 0.00 82 V 8.85 4.80 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 0.79 0.00 0.00 0.80 0.00 0.00 83 N 9.10 5.30 0.00 2.71 2.54 0.00 0.00 6.26 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 84 H 8.49 5.13 0.00 3.06 3.02 0.00 5.73 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 8.16 3.59 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 0.70 0.00 0.00 0.91 0.00 0.00 86 T 8.00 4.11 4.31 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 1.33 0.00 0.00 87 L 7.66 4.71 0.00 1.74 1.83 0.95 0.82 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 88 S 8.67 4.34 0.00 3.98 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 89 Q 7.52 4.59 0.00 2.12 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.97 0.00 0.00 0.00 0.00 0.00 2.22 2.37 0.00 90 P 0.00 4.49 0.00 1.93 1.99 0.00 3.65 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.06 0.00 91 K 9.02 4.45 0.00 1.80 1.64 0.00 1.59 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.41 7.81 92 I 8.36 4.90 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.74 0.93 0.00 0.00 93 V 8.52 4.41 2.14 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 1.06 0.00 0.00 0.96 0.00 0.00 94 K 8.75 4.71 0.00 1.74 1.80 0.00 1.83 0.00 0.00 1.66 0.00 0.00 2.87 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.50 1.48 7.81 95 W 9.34 4.52 0.00 3.26 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 96 D 8.45 4.42 0.00 2.58 2.39 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 97 R 7.58 3.67 0.00 1.88 1.17 0.00 3.00 0.00 0.00 3.20 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.53 0.00 98 D 7.98 4.74 0.00 2.78 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 99 M 8.16 4.39 0.00 1.97 1.92 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.45 0.00