NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3260 8.1233 123.5807 51.6293 20.1132 177.7155 2 I 3.5165 8.2336 121.6512 62.9248 37.2005 176.2110 3 T 5.0152 8.5066 108.1570 61.8911 69.7933 174.7768 4 D 4.5456 8.2809 123.0493 56.4735 41.2788 176.9421 5 I 4.3189 7.8697 117.5309 62.0966 39.6523 175.6845 6 L 4.6904 7.8845 119.2317 52.9507 43.8320 175.5462 7 S 4.6079 8.2923 114.5034 57.6883 64.1680 174.8363 8 A 4.0092 8.6010 130.6873 55.1121 18.2412 179.6122 9 K 3.8131 8.0408 117.5477 60.0106 32.2583 178.5470 10 D 4.3034 8.3681 119.2686 57.2217 40.5819 178.8327 11 I 3.4184 7.8568 120.3598 64.4453 37.1500 178.2318 12 E 3.9401 8.1643 119.2719 59.4036 29.1693 179.3458 13 S 4.0284 8.1818 112.8807 61.4660 62.2367 176.1980 14 A 3.8585 7.9367 122.4544 54.8244 18.3471 179.4069 15 L 4.3357 8.1813 118.0173 58.1777 41.2936 179.8826 16 S 4.2256 8.2432 114.0938 61.5891 62.5556 176.3391 17 S 4.4427 7.8073 117.1394 59.7703 62.6679 174.3327 18 C 5.5003 7.6744 115.3035 56.7411 29.9471 175.1534 19 Q 4.0679 7.9195 123.0782 59.8545 29.1101 176.9667 20 A 4.1926 7.8832 120.2703 51.1416 19.2365 176.3916 21 A 4.1775 8.5133 124.8642 53.9938 18.8278 177.1873 22 D 4.5972 8.9568 120.0714 55.2546 38.5201 174.6425 23 S 4.6233 8.0110 112.4127 57.9482 63.6795 173.4593 24 F 4.6632 8.6334 124.6606 57.8561 40.0038 174.8781 25 N 4.4356 7.3155 124.5821 50.8398 42.2159 174.3129 26 Y 3.0309 7.8869 126.6945 59.8346 37.6102 178.6050 27 K 2.7874 5.7755 120.6023 59.0444 32.2204 178.9779 28 S 3.9688 7.3276 114.7044 61.3102 62.6762 176.3929 29 F 3.9984 8.0846 123.6635 61.3497 39.2037 177.1849 30 F 4.5033 8.7449 117.9568 60.6914 38.4558 177.7198 31 S 4.0772 8.0460 112.4591 61.6916 62.0380 176.3872 32 T 3.8265 7.5918 117.3040 66.5379 68.3344 176.9304 33 V 3.6186 7.5423 119.3697 62.9155 31.4234 177.1892 34 G 3.9316 7.6779 108.3507 45.1171 0.0000 175.0290 35 L 4.0681 8.0345 123.3292 57.6413 42.2550 179.3332 36 S 4.2381 8.0984 112.6201 60.7253 63.0075 174.9860 37 S 4.4316 7.4907 112.3587 58.5913 63.4054 174.5258 38 K 4.3761 7.6397 121.2033 56.2082 32.7632 177.1008 39 T 4.3830 8.8370 111.8856 60.4649 71.3205 173.9683 40 P 4.3156 0.0000 0.0000 66.2326 30.9857 178.7235 41 D 4.4243 8.0423 117.0036 57.1900 40.8249 178.7508 42 Q 4.0370 7.8714 118.6731 59.1355 28.7563 178.5706 43 I 3.8777 8.2597 121.2562 64.4331 36.9977 178.3856 44 K 4.0201 8.3179 120.4821 59.2883 31.4577 178.8668 45 K 3.9874 7.8211 119.8135 59.4001 32.1363 178.9196 46 V 3.6464 7.8778 118.5719 65.9823 31.3445 177.6233 47 F 3.6037 8.5689 120.5956 61.1982 38.9397 177.1971 48 G 3.6542 7.7792 103.8208 47.8903 0.0000 175.4875 49 I 3.7892 7.1030 120.0112 64.2520 37.3017 178.2082 50 L 4.0924 7.3276 118.3075 56.9894 42.9651 178.4445 51 D 4.5187 7.5836 120.0375 53.0380 37.4741 176.4972 52 Q 3.8976 7.7491 121.6055 58.5360 29.4538 177.5242 53 D 4.4730 7.8996 114.5669 52.4014 40.1857 175.8531 54 K 3.8279 7.6293 119.9860 57.9626 30.5365 175.3654 55 S 4.5345 9.0470 111.6910 58.1363 64.2204 175.5986 56 G 3.8268 9.6834 110.4625 45.0880 0.0000 173.2216 57 F 5.3248 7.4873 116.0732 55.9655 43.7340 174.4676 58 I 4.3068 9.2711 123.2020 60.4278 38.2837 175.8316 59 E 4.5642 8.9355 127.5648 55.2388 31.0249 177.7061 60 E 3.8531 8.9218 121.0161 59.7569 29.4142 178.6968 61 E 3.9389 8.0944 116.8980 59.4861 29.4341 178.7383 62 E 3.9436 7.9867 117.9568 58.5643 29.8636 178.7988 63 L 3.9054 7.5416 119.1873 57.6759 41.6958 179.0417 64 Q 4.0598 8.2960 121.1438 57.8561 28.8760 177.1755 65 L 4.6386 7.8878 118.8064 54.4746 42.2930 177.9562 66 F 4.2467 8.0305 124.2027 61.9414 39.2411 177.2249 67 L 4.2452 7.9055 117.0046 57.0544 41.0525 179.1701 68 K 4.2505 8.0149 118.6759 59.1728 31.6315 178.7927 69 N 3.8616 7.5390 115.7393 55.4779 38.3123 176.4216 70 F 4.6657 7.5754 117.7169 57.7196 40.1972 176.3230 71 S 4.5249 7.2555 111.3254 57.1123 65.5599 175.5712 72 S 4.2583 8.9422 122.8281 60.2437 62.8516 174.7186 73 S 4.5726 7.6658 114.1813 57.8729 63.2100 174.2216 74 A 4.3066 7.7518 124.4770 51.7262 18.8324 177.9953 75 R 4.1750 8.1847 116.2345 55.8205 30.4354 176.5784 76 V 3.9345 7.9899 119.4671 62.5394 32.3264 175.7981 77 L 4.4403 8.6308 127.7457 54.7308 42.4128 177.0876 78 T 4.1771 9.2457 113.0760 61.4919 70.0941 175.7696 79 S 4.1179 8.7581 117.4563 61.3658 62.8195 176.8741 80 A 4.0127 7.9335 123.1923 55.3083 18.2963 179.2722 81 E 4.0879 8.2807 117.1172 59.8715 28.9759 179.8932 82 T 3.9005 8.1846 115.7354 66.7869 68.5518 177.0052 83 K 4.0426 8.2414 120.0844 59.2935 32.0129 179.4216 84 A 4.0295 8.0947 121.0635 54.9935 18.5186 179.2398 85 F 4.1400 8.2986 119.2796 61.5734 39.3975 177.1826 86 L 4.0387 8.3620 119.7074 58.1445 41.7089 178.7338 87 A 4.0218 8.2550 119.7673 55.1612 18.3900 179.1988 88 A 4.1304 8.1410 118.4985 54.4667 18.4291 179.1226 89 G 4.1299 7.3741 101.4176 44.7168 0.0000 173.2146 90 D 4.7625 8.3337 121.1023 53.7239 40.3621 175.2406 91 T 4.3315 9.0911 118.3768 62.7662 69.9695 175.5670 92 D 4.5776 8.5221 118.8678 52.1873 40.0496 176.0223 93 G 3.9848 7.6379 107.6552 47.2358 0.0000 173.7909 94 D 4.5873 8.1280 113.3700 52.5754 40.1415 177.3756 95 G 3.8772 9.6577 108.1976 45.4346 0.0000 172.7636 96 K 4.7572 8.0204 117.6793 55.5478 36.5077 175.1104 97 I 4.8245 8.8616 120.1943 59.7239 40.0814 176.4461 98 G 4.3440 9.6852 115.5229 45.0509 0.0000 174.8624 99 V 2.4908 7.7560 119.5991 64.4957 30.9381 178.1915 100 E 3.9115 7.9786 118.7308 59.2451 29.3202 179.1474 101 E 4.0383 8.1671 117.9544 59.2291 29.4806 179.1064 102 F 4.2902 8.5627 121.0535 61.4680 39.6911 177.1592 103 Q 3.9677 8.5796 118.1651 59.0854 28.2885 178.9198 104 S 4.1003 7.9991 112.9717 61.2129 62.5066 175.6130 105 L 4.0429 7.9838 122.3789 58.2489 41.9284 178.8180 106 V 4.0311 7.7403 117.1543 65.6225 31.4819 176.3561 107 K 4.3346 7.8204 121.3827 56.5433 32.2242 176.4404 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 A 8.12 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 2 I 8.23 3.52 1.85 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.57 1.09 0.00 0.00 3 T 8.51 5.02 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 1.27 0.00 0.00 4 D 8.28 4.55 0.00 2.76 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 5 I 7.87 4.32 2.04 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 1.45 0.64 0.96 0.00 0.00 6 L 7.88 4.69 0.00 1.79 1.61 1.14 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 7 S 8.29 4.61 0.00 3.89 3.91 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 8 A 8.60 4.01 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 9 K 8.04 3.81 0.00 1.83 1.81 0.00 1.72 0.00 0.00 1.80 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.49 1.53 7.81 10 D 8.37 4.30 0.00 2.79 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 11 I 7.86 3.42 2.06 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 1.49 0.76 0.91 0.00 0.00 12 E 8.16 3.94 0.00 2.16 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 2.35 2.55 0.00 13 S 8.18 4.03 0.00 3.85 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 14 A 7.94 3.86 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 L 8.18 4.34 0.00 1.91 1.81 1.02 1.06 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 16 S 8.24 4.23 0.00 4.07 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 17 S 7.81 4.44 0.00 3.99 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 18 C 7.67 5.50 0.00 3.33 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 19 Q 7.92 4.07 0.00 2.21 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.89 0.00 0.00 0.00 0.00 0.00 2.41 2.40 0.00 20 A 7.88 4.19 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 21 A 8.51 4.18 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 22 D 8.96 4.60 0.00 2.88 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 23 S 8.01 4.62 0.00 4.06 4.13 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 24 F 8.63 4.66 0.00 3.03 3.15 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 25 N 7.32 4.44 0.00 2.48 2.19 0.00 0.00 6.92 7.56 0.00 0.00 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 7.89 3.03 0.00 1.52 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 K 5.78 2.79 0.00 0.79 1.19 0.00 1.21 0.00 0.00 1.34 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.13 1.20 7.81 28 S 7.33 3.97 0.00 3.77 3.76 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 29 F 8.08 4.00 0.00 2.93 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 30 F 8.74 4.50 0.00 3.19 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 31 S 8.05 4.08 0.00 3.88 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 32 T 7.59 3.83 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 1.08 0.00 0.00 33 V 7.54 3.62 1.49 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 0.85 0.00 0.00 0.70 0.00 0.00 34 G 7.68 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 0.00 0.00 0.00 35 L 8.03 4.07 0.00 1.70 1.48 0.97 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 36 S 8.10 4.24 0.00 4.06 4.08 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 0.00 0.00 0.00 37 S 7.49 4.43 0.00 4.05 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 38 K 7.64 4.38 0.00 1.90 1.93 0.00 1.73 0.00 0.00 1.77 0.00 0.00 3.22 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.75 1.54 7.81 39 T 8.84 4.38 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 40 P 0.00 4.32 0.00 2.18 2.17 0.00 3.61 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 2.12 2.20 0.00 41 D 8.04 4.42 0.00 2.70 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 42 Q 7.87 4.04 0.00 2.25 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.77 0.00 0.00 0.00 0.00 0.00 2.40 2.42 0.00 43 I 8.26 3.88 2.10 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 1.44 0.75 1.16 0.00 0.00 44 K 8.32 4.02 0.00 2.07 2.02 0.00 1.60 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.41 7.81 45 K 7.82 3.99 0.00 1.90 1.94 0.00 1.72 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.45 1.46 7.81 46 V 7.88 3.65 2.49 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 1.14 0.00 0.00 1.04 0.00 0.00 47 F 8.57 3.60 0.00 2.99 3.15 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 48 G 7.78 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 0.00 0.00 0.00 49 I 7.10 3.79 1.89 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.68 0.74 0.00 0.00 50 L 7.33 4.09 0.00 1.30 1.57 1.13 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 51 D 7.58 4.52 0.00 1.99 2.23 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 52 Q 7.75 3.90 0.00 1.99 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.86 0.00 0.00 0.00 0.00 0.00 2.44 2.22 0.00 53 D 7.90 4.47 0.00 2.72 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 54 K 7.63 3.83 0.00 1.87 1.85 0.00 1.76 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.34 1.33 7.81 55 S 9.05 4.53 0.00 4.09 4.12 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 0.00 0.00 0.00 56 G 9.68 3.83 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 0.00 0.00 0.00 57 F 7.49 5.32 0.00 3.09 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 58 I 9.27 4.31 1.86 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.02 0.80 0.00 0.00 59 E 8.94 4.56 0.00 1.96 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 2.30 2.30 0.00 60 E 8.92 3.85 0.00 1.99 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 2.35 2.35 0.00 61 E 8.09 3.94 0.00 2.24 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 2.33 2.43 0.00 62 E 7.99 3.94 0.00 2.04 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 2.23 2.33 0.00 63 L 7.54 3.91 0.00 1.74 1.30 0.69 -0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 64 Q 8.30 4.06 0.00 2.06 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.88 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 65 L 7.89 4.64 0.00 1.87 1.60 0.92 0.96 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 66 F 8.03 4.25 0.00 3.21 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 67 L 7.91 4.25 0.00 1.88 1.78 0.96 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 68 K 8.01 4.25 0.00 1.88 1.81 0.00 1.67 0.00 0.00 1.73 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.60 7.81 69 N 7.54 3.86 0.00 1.82 2.19 0.00 0.00 6.94 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 70 F 7.58 4.67 0.00 3.18 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 71 S 7.26 4.52 0.00 3.71 3.73 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 72 S 8.94 4.26 0.00 4.01 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 73 S 7.67 4.57 0.00 3.99 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 74 A 7.75 4.31 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 75 R 8.18 4.17 0.00 1.95 1.97 0.00 3.06 0.00 0.00 3.29 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 76 V 7.99 3.93 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 0.78 0.00 0.00 0.92 0.00 0.00 77 L 8.63 4.44 0.00 1.54 1.50 0.45 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 78 T 9.25 4.18 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 1.26 0.00 0.00 79 S 8.76 4.12 0.00 3.90 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 80 A 7.93 4.01 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 81 E 8.28 4.09 0.00 2.32 2.18 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 0.00 2.68 2.61 0.00 82 T 8.18 3.90 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 1.19 0.00 0.00 83 K 8.24 4.04 0.00 2.02 1.89 0.00 1.70 0.00 0.00 1.95 0.00 0.00 3.04 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.52 7.81 84 A 8.09 4.03 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 85 F 8.30 4.14 0.00 3.38 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 86 L 8.36 4.04 0.00 1.85 1.84 0.92 1.31 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 87 A 8.25 4.02 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 88 A 8.14 4.13 1.16 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 0.00 0.00 89 G 7.37 4.13 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 0.00 0.00 0.00 90 D 8.33 4.76 0.00 2.64 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 91 T 9.09 4.33 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 1.23 0.00 0.00 92 D 8.52 4.58 0.00 2.79 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 93 G 7.64 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 94 D 8.13 4.59 0.00 2.72 2.69 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 95 G 9.66 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 0.00 0.00 0.00 96 K 8.02 4.76 0.00 1.92 1.74 0.00 1.22 0.00 0.00 1.48 0.00 0.00 2.36 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.37 1.22 7.81 97 I 8.86 4.82 2.05 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.03 1.25 0.00 0.00 98 G 9.69 4.34 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 0.00 99 V 7.76 2.49 1.06 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 0.74 0.00 0.00 0.55 0.00 0.00 100 E 7.98 3.91 0.00 2.07 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 2.39 2.43 0.00 101 E 8.17 4.04 0.00 2.30 2.28 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 2.45 2.43 0.00 102 F 8.56 4.29 0.00 3.39 3.28 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 0.00 103 Q 8.58 3.97 0.00 2.33 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.58 0.00 0.00 0.00 0.00 0.00 2.43 2.47 0.00 104 S 8.00 4.10 0.00 3.94 4.08 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 0.00 0.00 0.00 105 L 7.98 4.04 0.00 1.71 1.81 0.15 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 106 V 7.74 4.03 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 0.83 0.00 0.00 0.29 0.00 0.00 107 K 7.82 4.33 0.00 1.82 1.72 0.00 1.82 0.00 0.00 1.76 0.00 0.00 3.08 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.62 1.60 7.81