NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.3448 8.1744 110.9385 61.9972 69.4822 171.5928 2 K 4.4812 8.4495 127.2938 54.7332 39.8865 173.6402 3 S 4.5179 7.7204 109.3750 58.6681 66.1268 171.3284 4 T 4.4689 7.8106 113.1760 61.9432 69.4360 174.0118 5 T 4.2083 8.1325 110.3541 61.0060 67.0966 174.0877 6 T 4.0607 7.5940 120.0447 61.0749 70.5989 174.4062 7 A 3.7477 8.4012 124.4803 52.8346 18.0478 175.1562 8 C 5.1758 7.3419 118.4024 55.4459 42.2305 172.5633 9 C 4.6233 7.9124 117.6323 56.9254 45.8791 172.2625 10 D 4.3910 7.7445 118.0940 54.2093 43.3235 174.3828 11 F 4.8340 7.3051 117.8082 56.5308 40.5249 173.8242 12 C 6.2181 8.8572 120.0031 52.2212 41.4543 171.7611 13 P 4.7532 0.0000 0.0000 63.7572 33.1674 176.8603 14 C 5.5341 8.3635 116.6410 55.3310 44.4384 174.0765 15 T 4.2993 8.7112 111.6400 61.2371 69.6824 174.5600 16 R 4.5778 8.2515 120.0216 56.0252 30.8216 176.8232 17 S 4.4431 7.8420 112.9945 57.2470 64.8279 172.7784 18 I 4.3302 7.8656 119.7557 58.2898 38.7366 173.0330 19 P 4.5362 0.0000 0.0000 61.3979 32.1272 174.4284 20 P 4.4285 0.0000 0.0000 62.7300 32.2282 175.3963 21 Q 4.6090 8.8293 120.1411 54.4781 31.2033 174.0720 22 C 5.3518 9.0458 121.9396 55.5575 37.6408 172.8321 23 Q 5.2167 8.5882 118.3323 54.5347 32.4082 172.3228 24 C 5.5112 8.7399 115.8010 55.0429 42.7122 174.5313 25 T 4.8086 8.5246 113.0793 61.5391 68.4184 173.7864 26 D 4.8298 8.3175 121.0530 55.1156 43.1027 175.2229 27 V 4.8151 8.0649 122.6633 61.7284 35.1197 174.2465 28 R 4.3939 8.3937 127.4532 55.9934 35.3035 173.0956 29 E 4.6342 8.5624 126.8777 56.8362 31.5973 178.2805 30 K 4.3923 8.6652 118.6700 56.0753 33.0304 175.8785 31 C 4.6808 8.5705 117.0514 55.4407 37.2698 172.9688 32 H 4.5271 8.3816 115.9542 54.8448 29.5348 175.3867 33 S 4.5267 8.4350 110.7049 58.4107 62.1568 174.8736 34 A 4.7173 7.3979 118.4411 51.1964 19.8185 176.1201 35 C 4.9525 7.7510 117.8879 54.4943 43.7168 174.7366 36 K 4.1180 8.7810 123.1779 57.0706 33.3054 176.2387 37 S 4.7633 7.8805 114.3284 56.6997 64.0239 173.5532 38 C 5.4328 8.6145 126.8132 54.9285 41.8638 172.5201 39 L 4.6876 8.8220 125.9761 54.4255 45.7150 172.8501 40 C 5.4990 8.5963 119.4792 55.2386 43.9958 173.4269 41 T 4.4316 8.4561 115.1717 61.2732 67.7956 174.8804 42 R 4.2353 8.3598 121.8401 56.7556 30.0208 176.6607 43 S 4.3904 7.4527 114.9379 58.3863 63.7155 172.7383 44 F 4.6980 8.4634 123.1475 55.7971 40.3073 173.0432 45 P 3.8702 0.0000 0.0000 61.3425 31.9117 174.5427 46 P 4.5134 0.0000 0.0000 62.8973 31.2219 175.2977 47 Q 4.6747 8.4544 122.6208 54.3349 31.4011 175.5729 48 C 5.2627 8.6547 119.9638 55.6226 44.5652 173.1127 49 R 5.2331 8.6288 119.1885 54.9073 34.6503 173.0776 50 C 5.2385 8.3617 122.5784 54.5139 45.6946 172.9888 51 Y 5.1811 8.7716 128.9884 56.9070 38.8212 175.1815 52 D 4.5414 8.4582 116.4908 53.6062 41.0101 175.2524 53 I 4.7067 8.1853 120.6401 59.9407 39.0099 174.8801 54 T 4.4315 8.4170 116.8447 59.3306 71.9205 174.7872 55 D 4.2422 8.3154 121.2184 56.0605 41.5095 175.0345 56 F 4.9697 6.4357 111.7540 55.0619 41.0952 173.7729 57 C 4.9563 8.6540 119.2327 55.0937 45.6144 172.3732 58 Y 4.9562 8.2829 122.5270 55.7480 39.9005 173.4797 59 P 4.6697 0.0000 0.0000 62.4794 32.9509 175.5998 60 S 4.5602 8.5338 115.3004 59.0418 63.6138 174.6508 61 C 4.6793 8.3398 123.3364 55.6712 45.8072 173.4235 62 S 4.0987 8.1220 113.3562 58.6516 62.1261 173.4541 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 T 8.17 4.34 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 1.21 0.00 0.00 2 K 8.45 4.48 0.00 1.75 1.78 0.00 1.70 0.00 0.00 1.73 0.00 0.00 3.08 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.33 1.55 7.81 3 S 7.72 4.52 0.00 3.96 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 4 T 7.81 4.47 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 T 8.13 4.21 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 1.19 0.00 0.00 6 T 7.59 4.06 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 1.27 0.00 0.00 7 A 8.40 3.75 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 C 7.34 5.18 0.00 3.08 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 9 C 7.91 4.62 0.00 3.09 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 10 D 7.74 4.39 0.00 2.29 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 0.00 0.00 0.00 11 F 7.31 4.83 0.00 3.07 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 12 C 8.86 6.22 0.00 3.07 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 13 P 0.00 4.75 0.00 2.16 2.25 0.00 3.90 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.05 0.00 14 C 8.36 5.53 0.00 2.80 3.04 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 0.00 0.00 0.00 0.00 15 T 8.71 4.30 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 1.19 0.00 0.00 16 R 8.25 4.58 0.00 1.80 1.96 0.00 3.20 0.00 0.00 3.28 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 17 S 7.84 4.44 0.00 3.97 3.89 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 0.00 0.00 0.00 18 I 7.87 4.33 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 1.23 0.91 0.00 0.00 19 P 0.00 4.54 0.00 2.21 2.03 0.00 3.81 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 1.97 1.94 0.00 20 P 0.00 4.43 0.00 2.18 2.08 0.00 3.71 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.98 0.00 21 Q 8.83 4.61 0.00 1.98 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.73 0.00 0.00 0.00 0.00 0.00 2.21 2.29 0.00 22 C 9.05 5.35 0.00 2.93 2.89 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 0.00 0.00 0.00 23 Q 8.59 5.22 0.00 1.79 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 6.52 0.00 0.00 0.00 0.00 0.00 2.21 2.11 0.00 24 C 8.74 5.51 0.00 3.07 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 25 T 8.52 4.81 4.37 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 1.37 0.00 0.00 26 D 8.32 4.83 0.00 2.75 2.59 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 27 V 8.06 4.82 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 0.86 0.00 0.00 1.06 0.00 0.00 28 R 8.39 4.39 0.00 2.01 1.67 0.00 3.11 0.00 0.00 3.19 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.50 0.00 29 E 8.56 4.63 0.00 1.96 1.70 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 2.27 2.32 0.00 30 K 8.67 4.39 0.00 1.67 1.71 0.00 1.79 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.43 1.43 7.81 31 C 8.57 4.68 0.00 2.91 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 32 H 8.38 4.53 0.00 3.25 3.41 0.00 5.65 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 S 8.43 4.53 0.00 3.83 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 34 A 7.40 4.72 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 35 C 7.75 4.95 0.00 2.82 3.06 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 36 K 8.78 4.12 0.00 1.73 1.85 0.00 1.74 0.00 0.00 1.64 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.37 1.34 7.81 37 S 7.88 4.76 0.00 4.00 3.95 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 0.00 0.00 0.00 38 C 8.61 5.43 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 39 L 8.82 4.69 0.00 1.77 1.40 0.91 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 40 C 8.60 5.50 0.00 2.84 3.08 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 41 T 8.46 4.43 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 1.30 0.00 0.00 42 R 8.36 4.24 0.00 1.97 2.03 0.00 3.09 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.66 0.00 43 S 7.45 4.39 0.00 3.93 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 44 F 8.46 4.70 0.00 2.93 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 45 P 0.00 3.87 0.00 2.02 1.63 0.00 3.71 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 1.86 1.77 0.00 46 P 0.00 4.51 0.00 2.20 2.22 0.00 3.61 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.00 0.00 47 Q 8.45 4.67 0.00 2.01 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.85 6.88 0.00 0.00 0.00 0.00 0.00 2.32 2.48 0.00 48 C 8.65 5.26 0.00 3.08 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 49 R 8.63 5.23 0.00 1.86 1.92 0.00 3.09 0.00 0.00 3.10 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.76 0.00 50 C 8.36 5.24 0.00 2.75 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 51 Y 8.77 5.18 0.00 2.89 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 52 D 8.46 4.54 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 53 I 8.19 4.71 1.79 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.85 0.81 0.00 0.00 54 T 8.42 4.43 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 1.06 0.00 0.00 55 D 8.32 4.24 0.00 2.64 2.84 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 56 F 6.44 4.97 0.00 2.96 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 57 C 8.65 4.96 0.00 2.95 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 58 Y 8.28 4.96 0.00 2.91 2.93 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 59 P 0.00 4.67 0.00 2.13 2.21 0.00 3.93 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.02 0.00 60 S 8.53 4.56 0.00 3.86 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 61 C 8.34 4.68 0.00 3.14 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 62 S 8.12 4.10 0.00 3.78 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