NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 A 4.1794 8.2644 123.5818 51.9176 18.7303 176.1319 4 T 3.7742 8.3104 116.9760 61.7933 67.0802 172.6216 5 L 3.7836 9.2865 130.0440 55.5655 42.8886 176.5238 6 L 4.5051 8.2709 123.5709 52.6286 42.2141 176.3210 7 S 4.3669 8.6312 119.0397 57.1635 63.0267 172.5181 8 P 4.4258 0.0000 0.0000 63.5803 32.3663 174.8840 9 L 4.9666 7.0383 123.0614 53.3087 44.1783 175.4571 10 S 4.8837 8.9192 119.9029 57.0546 67.1858 172.2596 11 T 5.1183 8.1082 113.7662 61.6154 71.1600 171.7884 12 H 4.9469 8.3829 119.5945 55.1757 33.5585 172.1441 13 V 4.6510 8.7275 126.0296 60.8952 34.0225 173.7353 14 L 4.7877 8.4188 129.7018 53.1405 45.2215 174.7777 15 N 5.1894 9.1371 126.3540 52.7029 38.7957 175.1677 16 I 4.1033 8.7084 120.1852 62.4240 37.8058 177.2872 17 A 4.2884 8.5926 126.1310 54.3295 18.5204 178.0846 18 Q 4.5613 8.3031 111.1917 54.8018 30.1559 175.3718 19 G 3.9983 8.3448 105.9279 46.9132 0.0000 173.9700 20 V 4.6578 7.3891 110.0736 58.1563 36.2624 174.1176 21 P 4.5679 0.0000 0.0000 62.9627 32.0910 177.4354 22 G 3.8201 8.6956 111.0655 45.1632 0.0000 172.6258 23 A 4.4452 8.1880 126.3218 52.4106 19.8244 176.9242 24 N 4.2208 8.5430 117.3813 54.8304 36.5202 174.0268 25 M 4.7438 8.3781 117.5924 54.1852 35.0488 174.9182 26 T 4.7220 8.4245 122.1614 63.3426 70.2105 173.6340 27 I 4.9128 8.7883 126.4941 59.3760 41.4879 174.6156 28 V 4.6125 8.3009 124.6860 61.0006 34.8697 173.7029 29 L 5.1870 8.9136 129.9392 53.7924 44.4685 174.7307 30 H 5.4713 9.2685 121.7677 54.1115 33.6925 172.2147 31 R 4.9372 9.0022 119.8435 54.2093 33.5545 174.1186 32 L 3.8422 8.4495 128.5307 54.8692 42.6440 175.6551 33 D 4.5843 9.0373 127.4253 52.9244 41.6057 175.3535 34 P 4.2090 0.0000 0.0000 64.9749 32.1130 178.0585 35 V 3.6403 8.3048 119.6476 65.7542 31.7098 176.3009 36 S 4.5512 7.7215 112.4942 57.4558 65.2824 173.4263 37 S 4.5784 8.1783 109.0936 56.4370 62.4179 172.2704 38 A 4.5884 7.7890 127.8172 50.3650 23.2942 175.8920 39 W 4.6208 8.6621 120.7032 56.8935 30.0680 175.3375 40 N 5.0320 9.3919 122.5605 51.2113 40.4272 174.2048 41 I 3.7533 8.4993 124.5857 61.5266 38.3456 174.6463 42 L 4.5823 9.0348 129.2033 56.3838 43.0418 176.5178 43 T 4.7085 7.3914 111.0801 61.1882 70.8784 171.7347 44 T 5.0499 8.3894 115.2353 60.0482 71.7423 172.9711 45 G 4.2797 9.0484 110.5832 45.1874 0.0000 171.0340 46 I 5.2002 8.0153 119.8837 59.0261 40.3587 176.1749 47 T 4.2709 8.9555 117.9638 61.9207 70.1140 174.4783 48 N 4.8710 9.0764 122.2639 52.0407 39.0189 175.3636 49 D 4.3834 8.5613 116.9118 56.9461 39.5000 176.7925 50 D 4.5854 8.6976 118.3462 53.7394 41.2597 177.3529 51 G 3.6258 8.4991 105.8205 45.9903 0.0000 173.5424 52 R 4.9342 7.5237 117.2388 54.6028 32.7577 175.2508 53 C 4.5337 8.0255 118.5591 56.7706 31.6403 171.4670 54 P 4.3115 0.0000 0.0000 63.4634 31.7704 177.1638 55 G 3.8677 8.7096 106.6591 46.3621 0.0000 174.7940 56 L 4.0432 7.9966 121.7576 57.4833 42.1008 177.4317 57 I 4.2016 7.3235 115.1218 60.3347 41.4481 173.4037 58 T 4.5186 7.9943 115.6987 60.0201 70.4015 175.5854 59 K 4.0492 8.6381 123.3474 59.7412 32.3560 177.9968 60 E 4.1930 8.2082 117.1295 59.1438 29.5570 177.5632 61 N 4.6494 7.9322 114.3123 54.5694 39.1325 175.9052 62 F 4.8508 7.8790 121.5167 56.8822 37.6409 174.3476 63 I 4.2773 7.8815 118.3264 57.9468 39.9005 176.2773 64 A 4.1072 8.3831 122.6779 51.7474 19.0492 177.6379 65 G 3.7948 7.4825 106.4341 46.4134 0.0000 170.6245 66 V 4.8885 7.3868 119.2936 61.3645 33.5516 174.5303 67 Y 5.1898 8.7199 124.9326 55.9823 41.8818 174.4244 68 K 4.8094 8.8313 121.7290 54.9403 35.7017 174.6055 69 M 4.9491 9.1870 127.0187 53.5465 34.8282 174.5460 70 R 4.9152 8.7978 124.9552 54.6588 32.5229 174.5224 71 F 5.0617 9.4090 125.6857 55.8500 41.5059 175.8551 72 E 4.9295 8.8816 126.0267 55.5255 26.4800 177.2776 73 T 4.1351 8.0339 114.0321 64.4922 69.5820 176.9374 74 G 3.8189 8.3919 108.7034 47.7410 0.0000 175.8536 75 K 4.0991 8.1265 120.6504 59.0378 32.0310 178.6239 76 Y 3.9702 8.1773 119.8675 60.7272 38.6859 178.4415 77 W 4.1942 8.6545 119.9664 59.3254 29.1560 177.9918 78 D 4.4732 8.4247 118.0997 57.6091 40.4298 178.4215 79 A 4.1107 7.8592 119.5744 54.9663 18.4545 178.8610 80 L 4.1821 7.2975 114.6525 55.0403 41.7283 177.7032 81 G 3.9396 8.5183 107.4907 46.0814 0.0000 173.3013 82 E 4.7988 8.4842 117.8760 54.0593 33.0196 176.0710 83 T 4.2930 8.1794 111.3063 61.3785 70.0559 173.5733 84 C 4.2525 7.9473 121.5948 57.3602 34.8130 173.8202 85 F 4.2314 8.1484 127.0264 59.8681 39.1895 175.0357 86 Y 4.4080 7.4328 118.1208 55.1696 39.0623 173.6464 87 P 4.6392 0.0000 0.0000 65.6782 32.6767 175.3788 88 Y 5.3622 7.1876 115.7152 56.2145 41.4714 174.2146 89 V 4.3207 9.0162 118.8879 61.1236 34.4929 173.7380 90 E 5.3357 9.1124 126.8861 54.6708 32.1626 175.2476 91 I 4.6280 8.8914 124.9196 59.6315 39.7951 174.5892 92 V 4.9892 8.6729 127.2782 61.0433 33.6148 174.5863 93 F 5.1796 8.8410 121.6169 55.8937 41.7398 173.0854 94 T 4.8970 8.7480 117.4209 62.4001 70.1475 174.0184 95 I 4.0087 8.6406 127.9197 60.3380 38.2023 175.7672 96 T 4.0154 8.6438 120.9286 63.1755 68.9223 173.5882 97 N 4.6266 8.0640 122.2554 53.0479 38.2579 174.7498 98 T 3.9843 8.4148 120.6567 63.1092 67.8773 175.2593 99 S 4.5284 8.0651 114.0323 59.4786 63.7244 174.1736 100 Q 4.4795 7.4303 120.1137 54.9050 29.8337 174.3577 101 H 4.8090 8.3360 119.9899 55.8333 31.8005 173.3967 102 Y 4.8771 8.7851 123.0903 56.5278 40.8203 173.8303 103 H 5.1621 9.1894 125.5922 54.6446 32.0707 173.7943 104 V 4.6022 8.4857 125.7582 60.5236 32.1760 172.6542 105 P 4.8891 0.0000 0.0000 60.7912 34.3708 174.6296 106 L 4.4676 8.7322 121.1113 53.3523 45.0729 174.8761 107 L 5.1580 8.6935 127.6615 52.9708 43.6879 175.7303 108 L 5.4035 9.0720 124.4381 54.2982 44.3212 176.1828 109 S 5.6604 8.6296 115.7047 56.8346 65.8496 173.7302 110 R 2.9884 8.1653 117.1910 58.7182 29.7098 177.8372 111 F 4.9104 7.8483 115.2102 56.4555 40.3793 174.5313 112 S 4.8312 8.2712 112.8574 58.1419 64.9542 172.8940 113 Y 5.4243 7.6163 118.7648 56.5798 40.7193 173.3376 114 S 4.7325 9.0778 113.5148 57.4600 66.8320 172.7448 115 T 5.1076 8.3016 114.4150 61.0677 70.5534 172.5750 116 T 4.7725 8.1442 113.9882 59.9510 72.2992 172.9284 117 R 4.2256 8.6436 123.7547 56.0168 31.1298 175.4280 118 G 4.4830 9.0391 114.0396 44.7012 0.0000 172.9105 119 S 4.6934 8.2292 112.9760 58.1584 63.0253 173.7195 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 3 A 8.26 4.18 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 4 T 8.31 3.77 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 1.20 0.00 0.00 5 L 9.29 3.78 0.00 1.67 1.64 0.92 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.27 4.51 0.00 1.59 1.60 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 7 S 8.63 4.37 0.00 3.80 3.68 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 8 P 0.00 4.43 0.00 1.86 2.28 0.00 3.54 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.97 0.00 9 L 7.04 4.97 0.00 0.77 1.10 0.89 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 10 S 8.92 4.88 0.00 3.96 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 11 T 8.11 5.12 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 1.26 0.00 0.00 12 H 8.38 4.95 0.00 3.30 3.12 0.00 5.68 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 13 V 8.73 4.65 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 0.39 0.00 0.00 0.97 0.00 0.00 14 L 8.42 4.79 0.00 1.53 1.32 0.99 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 15 N 9.14 5.19 0.00 2.74 2.92 0.00 0.00 6.61 7.73 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 16 I 8.71 4.10 1.93 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.81 0.94 0.00 0.00 17 A 8.59 4.29 1.59 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 0.00 0.00 0.00 0.00 0.00 0.00 18 Q 8.30 4.56 0.00 2.10 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.82 0.00 0.00 0.00 0.00 0.00 2.36 2.50 0.00 19 G 8.34 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 20 V 7.39 4.66 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 0.88 0.00 0.00 0.97 0.00 0.00 21 P 0.00 4.57 0.00 2.08 2.14 0.00 3.69 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.14 0.00 22 G 8.70 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 23 A 8.19 4.45 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 24 N 8.54 4.22 0.00 2.92 2.97 0.00 0.00 6.80 7.73 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 25 M 8.38 4.74 0.00 1.99 1.78 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.52 0.00 26 T 8.42 4.72 4.24 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 1.17 0.00 0.00 27 I 8.79 4.91 1.70 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.84 0.40 0.00 0.00 28 V 8.30 4.61 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 0.86 0.00 0.00 0.84 0.00 0.00 29 L 8.91 5.19 0.00 1.74 1.47 1.09 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 30 H 9.27 5.47 0.00 2.93 3.33 0.00 5.81 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 R 9.00 4.94 0.00 1.36 1.50 0.00 2.85 0.00 0.00 2.75 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.50 0.00 32 L 8.45 3.84 0.00 0.51 1.08 -0.35 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 33 D 9.04 4.58 0.00 2.85 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 34 P 0.00 4.21 0.00 2.13 2.05 0.00 3.70 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 1.90 1.85 0.00 35 V 8.30 3.64 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 0.76 0.00 0.00 0.89 0.00 0.00 36 S 7.72 4.55 0.00 3.95 3.84 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 37 S 8.18 4.58 0.00 3.77 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 38 A 7.79 4.59 1.17 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 0.00 0.00 39 W 8.66 4.62 0.00 3.19 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 40 N 9.39 5.03 0.00 2.76 2.72 0.00 0.00 6.32 7.25 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 41 I 8.50 3.75 1.80 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.53 0.89 0.00 0.00 42 L 9.03 4.58 0.00 1.67 1.73 1.12 0.92 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 43 T 7.39 4.71 4.24 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 1.18 0.00 0.00 44 T 8.39 5.05 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 1.15 0.00 0.00 45 G 9.05 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 46 I 8.02 5.20 1.86 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 1.39 0.70 0.92 0.00 0.00 47 T 8.96 4.27 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 1.27 0.00 0.00 48 N 9.08 4.87 0.00 2.93 3.03 0.00 0.00 6.92 7.79 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 49 D 8.56 4.38 0.00 2.69 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 50 D 8.70 4.59 0.00 2.75 2.73 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 51 G 8.50 3.63 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 0.00 52 R 7.52 4.93 0.00 1.88 1.85 0.00 3.16 0.00 0.00 3.08 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.80 0.00 53 C 8.03 4.53 0.00 2.85 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 54 P 0.00 4.31 0.00 2.20 2.03 0.00 3.87 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 1.98 1.96 0.00 55 G 8.71 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 56 L 8.00 4.04 0.00 1.72 1.71 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 57 I 7.32 4.20 1.89 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.21 0.67 0.00 0.00 58 T 7.99 4.52 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 59 K 8.64 4.05 0.00 1.77 1.94 0.00 1.83 0.00 0.00 1.82 0.00 0.00 3.22 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.48 1.61 7.81 60 E 8.21 4.19 0.00 2.04 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 2.36 2.31 0.00 61 N 7.93 4.65 0.00 2.78 2.98 0.00 0.00 6.98 8.80 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 62 F 7.88 4.85 0.00 3.06 3.16 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 0.00 63 I 7.88 4.28 1.85 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.77 0.93 0.00 0.00 64 A 8.38 4.11 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 65 G 7.48 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 0.00 0.00 0.00 66 V 7.39 4.89 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 1.19 0.00 0.00 0.88 0.00 0.00 67 Y 8.72 5.19 0.00 1.51 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 68 K 8.83 4.81 0.00 0.79 0.96 0.00 1.21 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.92 1.04 7.81 69 M 9.19 4.95 0.00 1.51 2.14 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.43 0.00 70 R 8.80 4.92 0.00 1.64 1.61 0.00 2.84 0.00 0.00 2.94 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.39 0.00 71 F 9.41 5.06 0.00 2.76 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 72 E 8.88 4.93 0.00 2.02 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 2.39 2.44 0.00 73 T 8.03 4.14 4.47 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 1.15 0.00 0.00 74 G 8.39 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 75 K 8.13 4.10 0.00 1.88 1.91 0.00 1.71 0.00 0.00 1.76 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.57 1.55 7.81 76 Y 8.18 3.97 0.00 2.99 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.65 4.19 0.00 3.45 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 78 D 8.42 4.47 0.00 2.96 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 79 A 7.86 4.11 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 80 L 7.30 4.18 0.00 1.72 1.74 0.03 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 81 G 8.52 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 0.00 0.00 0.00 82 E 8.48 4.80 0.00 2.04 1.76 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 2.42 2.48 0.00 83 T 8.18 4.29 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 1.23 0.00 0.00 84 C 7.95 4.25 0.00 2.92 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 85 F 8.15 4.23 0.00 2.66 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 0.00 0.00 0.00 86 Y 7.43 4.41 0.00 3.00 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 87 P 0.00 4.64 0.00 2.18 2.30 0.00 3.50 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 1.78 1.84 0.00 88 Y 7.19 5.36 0.00 3.04 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 89 V 9.02 4.32 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 0.42 0.00 0.00 -0.10 0.00 0.00 90 E 9.11 5.34 0.00 2.00 1.82 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 2.13 2.45 0.00 91 I 8.89 4.63 2.23 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.93 1.12 0.00 0.00 92 V 8.67 4.99 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 1.07 0.00 0.00 0.90 0.00 0.00 93 F 8.84 5.18 0.00 3.12 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 94 T 8.75 4.90 4.32 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 1.24 0.00 0.00 95 I 8.64 4.01 1.70 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.26 0.23 0.00 0.00 96 T 8.64 4.02 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 1.27 0.00 0.00 97 N 8.06 4.63 0.00 2.86 2.88 0.00 0.00 6.79 7.22 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 98 T 8.41 3.98 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 1.25 0.00 0.00 99 S 8.07 4.53 0.00 4.03 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 0.00 100 Q 7.43 4.48 0.00 1.86 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.81 0.00 0.00 0.00 0.00 0.00 2.29 2.29 0.00 101 H 8.34 4.81 0.00 3.19 3.09 0.00 5.61 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 Y 8.79 4.88 0.00 2.87 2.79 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 0.00 103 H 9.19 5.16 0.00 3.18 3.16 0.00 5.53 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 V 8.49 4.60 1.81 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 0.62 0.00 0.00 0.31 0.00 0.00 105 P 0.00 4.89 0.00 2.06 1.94 0.00 3.90 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.94 0.00 106 L 8.73 4.47 0.00 0.48 0.85 0.40 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 107 L 8.69 5.16 0.00 1.66 1.56 0.87 0.12 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 0.00 108 L 9.07 5.40 0.00 1.76 1.66 0.83 0.65 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 0.00 109 S 8.63 5.66 0.00 4.10 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 0.00 110 R 8.17 2.99 0.00 1.18 0.67 0.00 2.75 0.00 0.00 2.77 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.55 0.00 111 F 7.85 4.91 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 0.00 112 S 8.27 4.83 0.00 4.01 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 0.00 113 Y 7.62 5.42 0.00 2.90 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 0.00 114 S 9.08 4.73 0.00 3.84 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 0.00 115 T 8.30 5.11 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 1.26 0.00 0.00 116 T 8.14 4.77 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 1.21 0.00 0.00 117 R 8.64 4.23 0.00 1.89 1.91 0.00 3.34 0.00 0.00 3.21 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.73 0.00 118 G 9.04 4.48 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 0.00 119 S 8.23 4.69 0.00 3.84 3.68 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