NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.5887 8.3649 120.5341 54.0853 42.2680 174.2781 2 I 4.0554 8.1785 121.9303 59.7805 37.9350 170.4064 3 V 4.3293 9.2693 128.8573 61.5323 34.1488 174.0269 4 L 5.1517 8.4567 125.6062 53.3555 44.0345 175.9682 5 T 4.4674 9.2088 121.6017 62.1833 70.0819 173.1564 6 Q 5.2931 8.5885 128.6509 54.7949 31.2282 174.3660 7 S 5.0025 9.1427 119.7069 56.5834 66.9840 172.1373 8 P 5.0279 0.0000 0.0000 61.4786 33.2171 175.7384 9 A 4.2656 8.5463 119.2306 54.7126 19.0753 177.7240 10 S 5.2606 7.9144 108.0919 57.1034 67.5922 174.0828 11 L 4.6671 9.2949 121.3105 53.7400 46.2163 174.9979 12 S 5.3994 8.7963 119.6551 56.8644 64.8626 173.2783 13 A 4.7638 9.3021 125.2377 51.0863 23.2884 174.8567 14 S 5.1962 8.7052 114.5213 56.3560 66.1266 174.5859 15 V 4.0091 8.4074 121.8238 64.7037 31.7931 175.9446 16 G 4.0259 9.2668 115.6936 45.3442 0.0000 173.4628 17 E 4.2628 8.0397 118.8568 56.4488 31.2807 175.8250 18 T 4.9381 8.2648 117.4277 62.0340 71.3598 173.9847 19 V 4.7948 8.3871 118.0496 59.8275 36.4861 174.5733 20 T 4.9649 8.1930 117.1518 62.0110 72.0512 173.6312 21 I 4.7168 8.6112 126.8458 59.5915 40.5565 174.7336 22 T 5.4711 9.0337 115.3855 60.2703 72.5604 172.1014 23 C 5.4530 9.7319 120.0759 55.4048 40.7350 172.8068 24 R 5.1954 9.2194 124.5933 54.5633 31.8683 174.5696 25 A 5.1090 9.1703 128.8834 50.8460 20.6396 177.7875 26 S 4.2570 8.9699 115.3694 59.5291 63.5542 174.0686 27 G 4.0456 7.3889 107.7482 44.4288 0.0000 172.6986 28 N 4.4246 8.6264 119.3600 53.6336 39.2431 174.6012 29 I 3.9772 8.1653 118.1508 59.8910 38.1735 175.2715 30 H 3.9769 9.1020 116.9139 57.3903 26.6425 175.2798 31 N 4.7500 8.2230 112.2719 54.2725 37.3525 174.6333 32 Y 4.5941 7.9003 118.9901 56.5581 36.4870 173.4750 33 L 5.2374 7.6560 122.2986 53.0369 46.3594 174.8201 34 A 5.3028 8.8727 126.4457 49.9190 23.0072 174.6771 35 W 5.4607 9.1547 118.7516 55.1551 33.0956 174.4657 36 Y 5.3895 9.5143 120.5609 56.3215 41.7308 174.1646 37 Q 4.7407 9.1946 123.2787 54.3106 32.1911 174.0999 38 Q 4.7812 8.7640 126.2021 54.4792 32.1656 174.4910 39 K 4.7780 8.6033 125.3935 54.4712 35.2020 175.3903 40 Q 3.9671 8.7781 120.5415 56.9919 28.2318 177.7525 41 G 3.9850 8.7657 112.9760 46.6584 0.0000 172.1503 42 K 4.6714 8.0395 116.8169 53.8307 35.7003 176.3612 43 S 4.5015 8.2451 115.8719 57.4848 63.7251 172.8296 44 P 4.6495 0.0000 0.0000 63.0019 32.1827 175.6765 45 Q 4.6516 9.2951 123.0358 53.9934 32.1779 174.2528 46 L 4.4132 9.0671 128.7848 55.7947 42.6197 175.5500 47 L 4.5816 9.1680 125.1186 55.8297 44.5851 176.6895 48 V 5.0600 7.5894 117.2372 61.3732 35.3550 173.2809 49 Y 4.9866 8.3437 124.4893 55.0874 42.0414 174.4767 50 S 4.1151 9.4224 110.4633 58.8170 61.2107 173.4489 51 T 4.0153 8.5496 122.2744 64.0930 67.6635 174.0950 52 T 4.5630 7.5354 105.6259 61.0828 70.4075 173.3683 53 T 4.1426 7.5693 120.8985 62.4492 69.5932 174.3400 54 L 4.6534 8.3296 126.5728 54.3606 42.7162 176.9385 55 A 4.5651 9.2194 124.7870 51.4317 19.8975 176.9979 56 D 4.4723 8.6720 119.1490 55.7087 41.3719 178.1118 57 G 3.9607 8.7789 109.4312 45.8716 0.0000 173.8991 58 V 3.8209 7.3843 120.1908 61.2420 31.9918 174.0623 59 P 4.4976 0.0000 0.0000 62.9198 31.5880 177.5007 60 S 4.3348 8.6256 116.0313 60.9923 63.0229 175.7493 61 R 4.0163 7.9891 116.8152 58.0793 30.2347 176.2157 62 F 5.0765 8.0493 119.4944 56.4291 40.3770 175.6139 63 S 4.6787 9.1221 117.1774 56.7415 66.4597 173.1350 64 G 4.7478 8.8806 109.0701 44.0497 0.0000 171.7419 65 S 4.6845 9.1480 115.6792 57.2142 67.0674 172.4331 66 G 4.1451 7.9718 105.2954 43.7032 0.0000 172.4986 67 S 4.6661 7.4241 112.4723 58.1551 66.7801 177.3544 68 G 3.9905 9.0861 113.8361 46.2728 0.0000 174.0987 69 T 4.8295 8.5012 110.5249 60.7034 71.9476 174.5330 70 Q 4.9329 7.7370 124.4884 54.6665 31.6397 173.7254 71 Y 5.1889 9.2339 123.5783 56.4751 42.2997 174.7412 72 S 5.3590 9.7682 117.8114 56.8787 67.9748 172.5913 73 L 4.5455 8.3558 125.1575 52.8542 44.3338 174.7687 74 K 4.8120 8.9864 127.8235 54.5394 35.1859 174.4757 75 I 4.4012 8.4207 128.1579 59.4950 39.6096 174.1555 76 N 4.9266 8.5662 125.6519 51.8599 39.4307 175.5646 77 S 3.8157 8.5971 119.1556 57.4090 59.9383 171.4666 78 L 3.9429 8.6007 122.4427 55.0183 42.5711 177.0052 79 Q 4.9438 8.9074 121.2976 53.2273 31.6822 174.9878 80 P 4.7348 0.0000 0.0000 65.9042 31.4288 177.8898 81 E 4.4923 8.2195 112.9905 56.9440 29.8927 176.6611 82 D 4.8183 8.1018 119.2419 55.4674 41.5110 176.9380 83 F 4.5630 7.8661 117.9863 56.1627 39.8861 176.3324 84 G 3.9167 7.4527 110.2374 46.3183 0.0000 171.0397 85 S 5.3684 7.8270 115.8825 57.2164 66.0346 173.2155 86 Y 5.3265 8.5984 118.9942 56.6753 42.0130 174.2361 87 Y 5.6146 9.4432 119.7270 56.6055 42.8492 171.8724 88 C 4.9616 9.1397 117.0253 53.8062 45.3101 172.2590 89 Q 4.7712 8.5291 121.1162 54.6770 32.2429 173.3702 90 H 5.2981 8.2253 121.5139 53.9923 30.7148 174.5547 91 F 4.6729 9.2491 118.4769 57.0366 40.3319 175.1129 92 W 4.3939 8.8941 129.8339 56.5949 30.7549 176.3247 93 S 3.1861 7.7616 123.5749 58.6481 61.4657 170.8681 94 T 4.6558 7.8814 106.3389 59.0977 71.7068 171.7754 95 P 4.4130 0.0000 0.0000 62.6849 32.2951 176.0349 96 R 4.1468 7.9534 118.6318 55.8444 31.5521 175.5387 97 T 4.6368 7.4336 109.7090 60.4207 72.7349 172.3228 98 F 5.0491 8.6893 120.0670 55.5055 41.8021 175.8220 99 G 4.2891 8.8057 109.8471 44.0706 0.0000 175.3439 100 G 3.4223 8.5778 108.2818 46.7393 0.0000 175.1058 101 G 4.1987 8.8001 104.7071 45.4770 0.0000 173.0406 102 T 4.8498 7.7509 114.6521 61.7387 73.0568 172.9835 103 K 4.7271 9.3452 126.7475 55.0663 34.0331 175.3947 104 L 5.1902 9.1774 129.1011 53.6331 43.3494 174.8663 105 E 5.2512 9.4295 124.8211 54.1069 33.2164 175.3966 106 I 4.2658 7.8893 121.2587 61.1754 37.9301 176.1922 107 K 4.2141 9.2388 127.3879 56.6880 31.6766 176.3447 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 D 8.36 4.59 0.00 2.70 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 2 I 8.18 4.06 1.68 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 0.66 0.93 0.00 0.00 3 V 9.27 4.33 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 0.99 0.00 0.00 0.95 0.00 0.00 4 L 8.46 5.15 0.00 1.56 1.56 0.84 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 5 T 9.21 4.47 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 6 Q 8.59 5.29 0.00 2.23 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.78 0.00 0.00 0.00 0.00 0.00 2.50 2.75 0.00 7 S 9.14 5.00 0.00 3.92 3.93 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 8 P 0.00 5.03 0.00 2.22 2.13 0.00 3.78 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.96 0.00 9 A 8.55 4.27 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 10 S 7.91 5.26 0.00 3.73 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 11 L 9.29 4.67 0.00 1.68 1.52 0.85 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 12 S 8.80 5.40 0.00 3.76 3.81 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 13 A 9.30 4.76 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 14 S 8.71 5.20 0.00 3.85 3.81 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 15 V 8.41 4.01 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 0.89 0.00 0.00 1.13 0.00 0.00 16 G 9.27 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 0.00 0.00 0.00 17 E 8.04 4.26 0.00 2.07 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 2.30 2.28 0.00 18 T 8.26 4.94 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 1.16 0.00 0.00 19 V 8.39 4.79 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 0.66 0.00 0.00 0.68 0.00 0.00 20 T 8.19 4.96 4.17 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 1.14 0.00 0.00 21 I 8.61 4.72 1.45 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.49 1.18 0.00 0.00 22 T 9.03 5.47 4.36 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 1.26 0.00 0.00 23 C 9.73 5.45 0.00 2.81 2.96 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 24 R 9.22 5.20 0.00 1.90 1.82 0.00 3.09 0.00 0.00 3.19 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.72 0.00 25 A 9.17 5.11 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 26 S 8.97 4.26 0.00 3.91 4.10 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 0.00 0.00 0.00 27 G 7.39 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 0.00 0.00 0.00 28 N 8.63 4.42 0.00 2.54 2.49 0.00 0.00 6.88 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 29 I 8.17 3.98 1.96 0.00 0.00 0.51 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 0.49 0.88 0.00 0.00 30 H 9.10 3.98 0.00 3.04 3.30 0.00 5.75 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 N 8.22 4.75 0.00 2.97 2.89 0.00 0.00 6.93 7.40 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 32 Y 7.90 4.59 0.00 3.36 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 33 L 7.66 5.24 0.00 0.99 1.01 0.52 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 34 A 8.87 5.30 1.21 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 0.00 0.00 35 W 9.15 5.46 0.00 3.21 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 36 Y 9.51 5.39 0.00 3.17 2.98 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 37 Q 9.19 4.74 0.00 1.89 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.05 1.56 0.00 38 Q 8.76 4.78 0.00 2.23 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.48 0.00 0.00 0.00 0.00 0.00 2.27 2.41 0.00 39 K 8.60 4.78 0.00 1.73 1.73 0.00 1.95 0.00 0.00 1.86 0.00 0.00 2.91 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.47 1.42 7.81 40 Q 8.78 3.97 0.00 2.06 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.92 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 41 G 8.77 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 42 K 8.04 4.67 0.00 1.88 1.70 0.00 1.70 0.00 0.00 1.74 0.00 0.00 3.11 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.36 1.41 7.81 43 S 8.25 4.50 0.00 3.73 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 44 P 0.00 4.65 0.00 1.67 1.85 0.00 3.48 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.89 0.00 45 Q 9.30 4.65 0.00 2.09 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.99 0.00 0.00 0.00 0.00 0.00 2.30 2.32 0.00 46 L 9.07 4.41 0.00 1.93 1.68 0.85 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 47 L 9.17 4.58 0.00 1.65 1.43 0.79 0.11 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 48 V 7.59 5.06 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 1.12 0.00 0.00 0.92 0.00 0.00 49 Y 8.34 4.99 0.00 2.86 2.91 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 50 S 9.42 4.12 0.00 4.14 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 51 T 8.55 4.02 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 1.49 0.00 0.00 52 T 7.54 4.56 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 1.27 0.00 0.00 53 T 7.57 4.14 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 0.92 0.00 0.00 54 L 8.33 4.65 0.00 1.51 1.59 1.02 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 55 A 9.22 4.57 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 56 D 8.67 4.47 0.00 2.71 2.65 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 0.00 0.00 0.00 0.00 57 G 8.78 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 58 V 7.38 3.82 2.26 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 0.73 0.00 0.00 0.92 0.00 0.00 59 P 0.00 4.50 0.00 2.36 2.26 0.00 3.85 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.18 0.00 60 S 8.63 4.33 0.00 3.89 3.97 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 61 R 7.99 4.02 0.00 1.89 2.07 0.00 2.91 0.00 0.00 3.21 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.06 0.00 62 F 8.05 5.08 0.00 2.97 2.96 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 63 S 9.12 4.68 0.00 3.81 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 64 G 8.88 4.75 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 65 S 9.15 4.68 0.00 3.85 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 66 G 7.97 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 67 S 7.42 4.67 0.00 3.67 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 G 9.09 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 69 T 8.50 4.83 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 1.24 0.00 0.00 70 Q 7.74 4.93 0.00 2.07 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 6.78 0.00 0.00 0.00 0.00 0.00 2.20 2.33 0.00 71 Y 9.23 5.19 0.00 3.12 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 72 S 9.77 5.36 0.00 3.68 3.65 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 0.00 0.00 0.00 0.00 73 L 8.36 4.55 0.00 0.27 0.34 0.50 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 74 K 8.99 4.81 0.00 1.67 1.48 0.00 1.54 0.00 0.00 1.56 0.00 0.00 2.77 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.17 1.34 7.81 75 I 8.42 4.40 1.50 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 0.70 0.41 0.20 0.00 0.00 76 N 8.57 4.93 0.00 2.44 2.64 0.00 0.00 7.04 8.24 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 77 S 8.60 3.82 0.00 3.90 3.81 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 78 L 8.60 3.94 0.00 1.39 1.22 0.56 0.66 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 79 Q 8.91 4.94 0.00 2.02 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 6.73 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 80 P 0.00 4.73 0.00 2.28 2.23 0.00 3.66 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 2.19 2.23 0.00 81 E 8.22 4.49 0.00 2.16 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 0.00 2.36 2.36 0.00 82 D 8.10 4.82 0.00 2.53 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 83 F 7.87 4.56 0.00 3.11 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 84 G 7.45 3.92 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 0.00 0.00 0.00 85 S 7.83 5.37 0.00 3.83 3.59 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 86 Y 8.60 5.33 0.00 3.00 3.05 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 87 Y 9.44 5.61 0.00 3.27 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 88 C 9.14 4.96 0.00 1.88 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 89 Q 8.53 4.77 0.00 1.75 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.81 0.00 0.00 0.00 0.00 0.00 1.43 1.16 0.00 90 H 8.23 5.30 0.00 3.16 3.17 0.00 5.55 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 F 9.25 4.67 0.00 3.05 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 92 W 8.89 4.39 0.00 3.57 3.05 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 93 S 7.76 3.19 0.00 3.32 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 T 7.88 4.66 4.17 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 1.12 0.00 0.00 95 P 0.00 4.41 0.00 2.15 2.05 0.00 3.75 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.16 0.00 96 R 7.95 4.15 0.00 1.34 1.26 0.00 3.02 0.00 0.00 3.07 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 1.29 0.00 97 T 7.43 4.64 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 1.23 0.00 0.00 98 F 8.69 5.05 0.00 2.99 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 99 G 8.81 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 0.00 0.00 0.00 0.00 100 G 8.58 3.42 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 0.00 101 G 8.80 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 0.00 0.00 0.00 0.00 102 T 7.75 4.85 4.35 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 1.30 0.00 0.00 103 K 9.35 4.73 0.00 1.86 1.79 0.00 1.67 0.00 0.00 1.62 0.00 0.00 2.83 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.61 7.81 104 L 9.18 5.19 0.00 1.85 2.00 0.89 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 105 E 9.43 5.25 0.00 1.98 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 2.41 2.43 0.00 106 I 7.89 4.27 1.56 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.27 -0.36 0.55 0.00 0.00 107 K 9.24 4.21 0.00 1.87 1.72 0.00 1.84 0.00 0.00 1.77 0.00 0.00 3.02 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.41 7.81