NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 M 4.4337 8.2893 120.2172 54.4027 32.5027 174.6543 1 P 5.2208 0.0000 0.0000 61.5990 33.2669 170.4006 2 V 4.9598 8.4338 119.9177 61.3154 35.8808 174.8059 3 F 5.4095 9.3162 129.4171 56.6466 42.4939 173.4755 4 T 4.9464 8.0932 115.6286 59.7105 72.3651 172.7700 5 I 4.5177 8.4820 124.0515 59.5381 40.3644 174.6220 6 R 4.8429 8.4510 126.1421 54.7409 31.9295 174.9540 7 T 5.2524 9.2432 118.6378 59.1523 71.1177 173.9056 8 N 5.3388 8.8125 121.3229 53.3778 38.5190 175.6619 9 V 3.7498 8.0927 121.1673 63.4877 32.9544 175.2430 10 C 4.8296 8.6904 123.7685 58.9733 29.2850 174.8346 11 R 3.9672 9.8070 121.0997 59.6946 28.8282 178.0578 12 D 4.4564 8.0585 115.6440 55.9973 41.3607 176.2940 13 S 4.4829 8.2411 113.7454 58.5656 63.1371 174.4223 14 V 3.8707 7.4776 121.5357 61.0174 30.5366 173.8546 15 P 4.2782 0.0000 0.0000 63.0514 31.5741 177.1203 16 D 4.7337 8.7827 120.2592 54.4739 39.5346 176.6578 17 T 4.3298 7.7930 111.2919 63.8735 70.3365 177.5908 18 L 3.8021 7.6212 121.9083 57.4976 42.0862 178.7312 19 L 4.1415 8.2076 118.2602 58.4940 41.4538 179.8338 20 S 4.1666 8.0175 114.0725 61.4489 62.8293 176.0469 21 D 4.3195 8.3648 121.0369 57.6545 41.0716 178.5989 22 L 4.0670 8.8130 119.7698 57.5776 41.5357 179.8463 23 T 3.9063 7.6525 115.8854 66.3863 68.3432 176.7386 24 K 3.9330 8.3279 121.8997 59.5466 32.1358 178.8851 25 Q 3.9704 8.0814 118.1770 59.0923 28.7317 178.5385 26 L 3.9091 7.9089 119.6772 57.6418 41.4523 179.2473 27 A 4.2114 7.8609 122.0008 54.7649 18.2691 179.5744 28 K 3.9672 7.9740 116.5050 59.7581 31.9264 179.0316 29 A 3.9368 8.3056 120.3111 56.3528 18.5518 179.1568 30 T 4.4976 8.2515 108.9415 60.9954 69.4441 174.9727 31 G 3.9943 7.9996 109.6898 46.6592 0.0000 173.4748 32 K 4.6006 7.4401 117.8180 52.9641 34.7740 174.3026 33 P 4.3838 0.0000 0.0000 63.1063 31.6096 177.3450 34 A 4.0851 8.8056 125.9612 54.9937 18.6014 179.2565 35 E 3.8896 8.0580 112.9280 59.0568 29.9181 177.1403 36 Y 4.4663 7.6294 115.5476 57.7350 37.9775 174.6268 37 I 5.2590 7.5783 120.8023 58.7719 39.3250 174.9524 38 A 4.8683 8.6309 127.5306 50.1286 21.9803 174.6962 39 I 5.1106 8.4961 122.1488 59.7038 40.4234 174.5889 40 H 4.9398 9.1079 125.3827 54.5092 32.7317 171.8842 41 I 4.7168 8.6247 126.4298 59.6115 39.3813 175.5668 42 V 4.2357 9.2052 128.3725 60.7463 32.9111 172.9675 43 P 4.6739 0.0000 0.0000 61.9777 33.8531 176.1772 44 D 4.5192 8.7562 119.1616 55.5632 39.5042 174.1014 45 Q 4.1176 7.5962 118.0512 55.8083 29.2049 175.9980 46 I 4.1350 8.0516 122.5576 60.5199 36.1800 175.0325 47 M 4.8871 8.0102 121.1427 53.5714 34.0909 174.5365 48 S 4.9791 8.3168 113.4624 56.5925 66.5722 173.1910 49 F 4.4077 8.8581 122.9386 57.6637 41.8243 174.7648 50 G 4.1081 9.7145 115.4774 46.6778 0.0000 172.6818 51 D 4.5545 8.4790 115.0426 54.5265 39.4090 173.1563 52 S 4.7340 8.0996 111.3345 56.2697 64.8138 173.9557 53 T 4.8158 8.4611 116.4066 61.7511 68.8035 174.5614 54 D 4.5506 7.6278 121.3500 53.3855 41.4249 174.3394 55 P 4.3733 0.0000 0.0000 63.7715 31.6342 175.4263 56 C 4.8966 9.1396 116.6689 57.6961 33.8774 172.2979 57 A 4.9197 8.6133 117.9608 51.0544 22.8141 175.8098 58 V 4.7598 8.9009 121.0804 61.6519 34.2757 174.5928 59 C 5.2086 9.1606 126.1161 58.2809 31.9947 173.0322 60 S 4.8725 8.0030 112.6177 57.2397 66.4034 173.1574 61 L 5.2676 9.0773 126.0135 53.6988 44.5785 174.4700 62 C 5.3717 9.1405 125.1261 58.2264 30.5418 173.1374 63 S 4.6782 9.0617 117.7981 57.0139 66.0513 173.4491 64 I 4.5247 7.7160 127.7244 60.1102 35.5858 176.1161 65 G 3.6806 8.5172 114.7739 45.1567 0.0000 172.0321 66 K 4.2663 8.5967 116.6623 56.9152 29.4588 175.3816 67 I 4.6159 7.0255 119.3949 59.6836 39.6514 175.4508 68 G 4.2833 7.6053 112.0724 44.9262 0.0000 172.3122 69 G 3.7072 8.1990 106.7863 45.9389 0.0000 173.2162 70 P 4.2762 0.0000 0.0000 65.6310 31.6406 178.3547 71 Q 3.4626 7.8893 117.1652 58.8437 28.5791 178.0049 72 N 3.5457 7.7144 116.9745 56.3475 38.5556 177.6812 73 K 3.8967 7.4202 118.1848 59.4191 32.2165 178.9880 74 S 3.9687 7.6292 113.3216 61.7715 62.0550 175.6832 75 Y 4.3713 7.6834 119.3627 61.7752 37.5540 178.6161 76 T 4.1562 8.3505 117.9289 66.1184 68.6566 176.0515 77 K 3.7707 8.2987 120.9708 59.9635 32.1702 178.1637 78 L 3.9382 8.0602 120.2579 58.3027 41.9752 178.8835 79 L 3.9653 9.0500 119.6596 58.0927 41.5261 179.5726 80 C 4.2020 9.1636 117.9124 62.6031 28.1360 175.9001 81 D 4.3365 8.2068 120.6888 57.4743 40.3834 178.8405 82 I 3.7523 7.8159 120.2874 64.4079 37.0758 178.5875 83 L 4.0472 8.2945 120.3572 57.7303 41.4196 179.6280 84 T 4.3156 7.7438 111.0441 63.7483 68.7581 176.9099 85 K 3.8861 7.6938 121.1882 59.3918 32.3844 178.5423 86 Q 4.1658 8.1219 116.8192 58.2370 28.9970 177.0724 87 L 4.4145 7.7106 116.2491 53.7305 42.5185 175.8713 88 N 4.8058 7.8667 115.0624 54.1989 37.1145 173.4290 89 I 4.2826 7.5240 117.7543 58.1395 38.4802 173.8007 90 P 4.2494 0.0000 0.0000 62.6069 31.5890 177.2205 91 A 3.9901 8.5840 123.8862 55.3201 18.4138 178.6623 92 N 4.4271 7.9827 111.3046 54.7283 38.1096 175.3619 93 R 3.3064 7.2985 119.1018 54.8082 30.4095 176.1848 94 V 4.9180 7.0686 117.4030 61.7356 34.8686 173.6639 95 Y 5.3685 9.1708 125.1905 56.5259 41.3131 174.9964 96 I 4.9115 8.2592 121.9882 59.8641 40.9355 174.3458 97 N 4.4640 8.9465 126.0228 52.1925 39.5841 173.9000 98 Y 4.9281 8.1358 121.6929 56.8648 40.3828 174.3061 99 Y 5.0447 9.0879 120.8155 56.4246 42.2691 174.0115 100 D 5.2001 8.9883 124.2376 52.7881 41.5760 175.6410 101 L 4.3685 8.7401 126.6271 54.2389 43.5418 175.7519 102 N 4.7501 8.5817 119.7580 51.8821 40.4091 175.4111 103 A 3.9627 8.9730 128.5535 55.6053 18.4438 179.2509 104 A 4.1938 8.0761 116.2080 54.4869 18.5710 177.6165 105 N 4.8682 8.6573 113.0295 52.8145 39.1063 175.4335 106 V 4.3512 7.7817 119.1428 60.6480 32.4595 174.8223 107 G 4.0335 8.5569 115.6491 45.1822 0.0000 171.2090 108 W 4.7658 10.5861 130.5714 57.5036 34.0936 173.9091 109 N 3.3860 9.1902 123.3525 54.5803 36.6574 174.3295 110 G 4.0182 8.6687 105.0207 45.1202 0.0000 173.8720 111 S 4.3626 7.9363 113.2880 57.2952 64.7190 171.4296 112 T 5.3868 8.1069 108.1965 59.4382 71.1935 173.4404 113 F 4.3867 8.8165 117.8001 57.6727 39.0938 176.0427 114 A 4.3277 7.8597 129.7667 52.3390 18.6871 177.5085 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 4.43 0.00 1.53 1.25 0.00 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.43 0.00 1 P 0.00 5.22 0.00 2.18 2.13 0.00 3.74 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.82 0.00 2 V 8.43 4.96 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 1.13 0.00 0.00 0.97 0.00 0.00 3 F 9.32 5.41 0.00 3.13 2.87 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 4 T 8.09 4.95 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 1.17 0.00 0.00 5 I 8.48 4.52 1.82 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.71 0.91 0.00 0.00 6 R 8.45 4.84 0.00 1.81 1.79 0.00 3.20 0.00 0.00 3.06 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.42 0.00 7 T 9.24 5.25 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 1.25 0.00 0.00 8 N 8.81 5.34 0.00 2.74 3.02 0.00 0.00 6.32 7.68 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 9 V 8.09 3.75 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 0.92 0.00 0.00 0.93 0.00 0.00 10 C 8.69 4.83 0.00 3.03 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 11 R 9.81 3.97 0.00 1.94 2.55 0.00 3.23 0.00 0.00 3.10 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 12 D 8.06 4.46 0.00 2.64 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 13 S 8.24 4.48 0.00 3.92 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 14 V 7.48 3.87 2.21 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 0.78 0.00 0.00 1.00 0.00 0.00 15 P 0.00 4.28 0.00 2.23 1.99 0.00 3.67 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.12 0.00 16 D 8.78 4.73 0.00 2.79 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 17 T 7.79 4.33 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 18 L 7.62 3.80 0.00 1.94 1.78 0.97 0.70 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 19 L 8.21 4.14 0.00 1.75 1.76 0.97 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 20 S 8.02 4.17 0.00 3.87 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 21 D 8.36 4.32 0.00 2.83 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 22 L 8.81 4.07 0.00 1.75 1.71 1.12 0.29 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 23 T 7.65 3.91 4.43 0.00 0.00 0.00 0.00 0.00 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 24 K 8.33 3.93 0.00 1.94 1.95 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.48 7.81 25 Q 8.08 3.97 0.00 2.15 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.55 0.00 0.00 0.00 0.00 0.00 2.52 2.53 0.00 26 L 7.91 3.91 0.00 1.76 1.65 0.73 0.57 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 27 A 7.86 4.21 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.97 3.97 0.00 1.93 1.85 0.00 1.71 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.64 7.81 29 A 8.31 3.94 1.55 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 0.00 0.00 30 T 8.25 4.50 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 1.02 0.00 0.00 31 G 8.00 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 32 K 7.44 4.60 0.00 1.76 1.67 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.86 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.31 1.50 7.81 33 P 0.00 4.38 0.00 2.53 2.17 0.00 3.62 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.19 0.00 34 A 8.81 4.09 1.30 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 0.00 0.00 0.00 35 E 8.06 3.89 0.00 1.82 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 2.06 1.47 0.00 36 Y 7.63 4.47 0.00 3.09 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 37 I 7.58 5.26 2.01 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 1.12 1.82 0.95 0.00 0.00 38 A 8.63 4.87 1.26 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 0.00 0.00 0.00 39 I 8.50 5.11 1.95 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 1.37 0.83 1.02 0.00 0.00 40 H 9.11 4.94 0.00 3.14 3.04 0.00 5.55 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 I 8.62 4.72 1.90 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.82 0.92 0.00 0.00 42 V 9.21 4.24 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 1.03 0.00 0.00 0.67 0.00 0.00 43 P 0.00 4.67 0.00 2.40 2.20 0.00 4.06 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 2.01 1.93 0.00 44 D 8.76 4.52 0.00 2.78 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 45 Q 7.60 4.12 0.00 2.15 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.91 0.00 0.00 0.00 0.00 0.00 2.58 2.50 0.00 46 I 8.05 4.13 1.87 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 1.47 0.50 0.91 0.00 0.00 47 M 8.01 4.89 0.00 2.07 2.00 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.54 0.00 48 S 8.32 4.98 0.00 3.96 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 49 F 8.86 4.41 0.00 2.97 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 50 G 9.71 4.11 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 0.00 0.00 0.00 51 D 8.48 4.55 0.00 2.85 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 S 8.10 4.73 0.00 3.87 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 53 T 8.46 4.82 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 54 D 7.63 4.55 0.00 2.69 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.37 0.00 2.00 2.03 0.00 3.65 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 2.02 2.10 0.00 56 C 9.14 4.90 0.00 3.16 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 57 A 8.61 4.92 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 58 V 8.90 4.76 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 1.03 0.00 0.00 1.05 0.00 0.00 59 C 9.16 5.21 0.00 2.85 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.00 4.87 0.00 4.02 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 61 L 9.08 5.27 0.00 1.91 1.51 1.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 62 C 9.14 5.37 0.00 2.94 2.88 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 63 S 9.06 4.68 0.00 3.81 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 64 I 7.72 4.52 1.64 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.44 0.87 0.00 0.00 65 G 8.52 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 0.00 0.00 0.00 66 K 8.60 4.27 0.00 1.94 2.04 0.00 1.87 0.00 0.00 1.74 0.00 0.00 2.96 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.47 7.81 67 I 7.03 4.62 2.11 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.06 0.97 0.00 0.00 68 G 7.61 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 69 G 8.20 3.71 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 0.00 0.00 0.00 0.00 0.00 0.00 70 P 0.00 4.28 0.00 2.17 2.27 0.00 3.65 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.02 0.00 71 Q 7.89 3.46 0.00 2.11 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.83 0.00 0.00 0.00 0.00 0.00 2.41 2.36 0.00 72 N 7.71 3.55 0.00 2.50 2.11 0.00 0.00 7.17 8.53 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 73 K 7.42 3.90 0.00 1.93 1.80 0.00 1.64 0.00 0.00 1.54 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.37 7.81 74 S 7.63 3.97 0.00 3.77 3.49 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.68 4.37 0.00 3.12 3.10 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 76 T 8.35 4.16 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 77 K 8.30 3.77 0.00 1.83 1.97 0.00 1.62 0.00 0.00 1.56 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.47 7.81 78 L 8.06 3.94 0.00 1.91 1.85 0.92 0.63 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 L 9.05 3.97 0.00 1.76 1.73 0.32 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 80 C 9.16 4.20 0.00 3.02 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 81 D 8.21 4.34 0.00 2.93 2.71 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 0.00 0.00 0.00 82 I 7.82 3.75 1.98 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.75 0.92 0.00 0.00 83 L 8.29 4.05 0.00 1.80 1.75 1.12 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 84 T 7.74 4.32 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 1.31 0.00 0.00 85 K 7.69 3.89 0.00 1.86 1.97 0.00 1.80 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.46 1.48 7.81 86 Q 8.12 4.17 0.00 2.15 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.50 0.00 0.00 0.00 0.00 0.00 2.55 2.55 0.00 87 L 7.71 4.41 0.00 1.83 1.70 0.95 1.16 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 88 N 7.87 4.81 0.00 2.84 2.88 0.00 0.00 7.28 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 89 I 7.52 4.28 1.86 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.73 0.86 0.00 0.00 90 P 0.00 4.25 0.00 2.37 2.13 0.00 3.64 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 1.95 1.90 0.00 91 A 8.58 3.99 1.28 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 92 N 7.98 4.43 0.00 2.73 2.88 0.00 0.00 5.87 7.66 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 93 R 7.30 3.31 0.00 1.45 1.41 0.00 2.96 0.00 0.00 2.95 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 1.22 0.00 94 V 7.07 4.92 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 0.85 0.00 0.00 0.93 0.00 0.00 95 Y 9.17 5.37 0.00 3.02 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 96 I 8.26 4.91 1.69 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.68 0.36 0.00 0.00 97 N 8.95 4.46 0.00 2.37 2.16 0.00 0.00 6.51 7.45 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 98 Y 8.14 4.93 0.00 2.85 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 99 Y 9.09 5.04 0.00 2.88 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 0.00 100 D 8.99 5.20 0.00 2.74 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 0.00 101 L 8.74 4.37 0.00 1.62 1.56 0.92 0.55 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 0.00 102 N 8.58 4.75 0.00 2.73 2.69 0.00 0.00 6.84 8.15 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 0.00 103 A 8.97 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 0.00 104 A 8.08 4.19 1.32 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 0.00 105 N 8.66 4.87 0.00 2.81 2.84 0.00 0.00 6.65 8.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 V 7.78 4.35 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 1.28 0.00 0.00 0.97 0.00 0.00 107 G 8.56 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 0.00 108 W 10.59 4.77 0.00 3.58 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 0.00 109 N 9.19 3.39 0.00 1.44 1.42 0.00 0.00 7.38 7.98 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 0.00 110 G 8.67 4.02 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 0.00 0.00 0.00 111 S 7.94 4.36 0.00 3.75 3.61 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.11 5.39 4.53 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 0.00 0.00 0.00 1.24 0.00 0.00 113 F 8.82 4.39 0.00 3.23 3.10 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 0.00 114 A 7.86 4.33 1.28 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