NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 L 4.2759 8.1693 120.6258 53.5449 43.0850 175.8522 2 P 4.2458 0.0000 0.0000 62.4029 31.5420 174.9995 3 A 4.2608 9.2048 122.7334 54.0640 19.8080 179.2455 4 S 4.7697 7.6106 110.2072 57.0614 66.9481 173.3774 5 F 4.5582 8.3495 123.8017 57.2703 42.2058 172.7768 6 D 4.4311 7.5525 126.3222 51.4250 43.3348 175.4493 7 A 3.9875 8.5968 129.2444 55.7099 18.0126 179.1999 8 R 4.0473 8.3635 115.4085 58.4893 30.1262 178.0603 9 E 4.2906 7.5653 117.3412 58.0691 30.5297 177.6115 10 Q 3.7294 7.4895 118.0520 57.3896 30.5592 176.4516 11 W 5.1002 7.9303 118.1806 52.8585 29.1311 174.1726 12 P 4.3081 0.0000 0.0000 65.5448 31.4436 178.2538 13 Q 4.2541 8.1875 115.1552 57.1493 29.1905 175.8162 14 C 5.0982 8.1279 118.3512 53.8167 35.6964 172.1068 15 P 4.0917 0.0000 0.0000 65.7329 31.2853 179.6616 16 T 3.9375 7.9081 108.6454 64.1993 69.0607 176.2748 17 I 3.9417 7.3394 122.5991 63.9547 37.1504 176.6906 18 K 4.3288 7.6874 117.2331 56.0209 32.2211 175.6495 19 E 4.3384 8.4738 121.7881 54.8198 30.1989 175.1981 20 I 4.2430 8.2757 127.4266 59.9917 38.0134 175.8014 21 R 4.4087 8.3396 124.8782 54.7498 31.9244 175.1539 22 D 4.4789 8.1056 117.4196 52.4348 42.4493 175.1320 23 Q 3.1024 8.1826 124.2049 55.8134 29.0401 178.0317 24 G 3.8232 8.1897 108.5729 46.0073 0.0000 174.1803 25 S 4.5010 8.2520 111.4148 56.1155 61.4074 172.4562 26 C 4.6024 7.4803 118.8972 58.4431 35.1148 174.7794 27 G 4.0353 8.6897 118.3734 44.8871 0.0000 174.0458 28 S 4.7110 7.6119 110.6137 58.6043 64.4645 175.9446 29 C 4.2882 8.1848 120.6567 61.4172 29.5754 175.1832 30 W 4.2421 8.3857 119.1146 59.1840 27.6034 177.9267 31 A 3.4979 6.5767 120.8648 54.4062 18.0883 179.3351 32 F 3.6383 8.1618 116.4896 60.3501 38.9135 178.2227 33 G 3.6999 8.2312 105.3761 47.5244 0.0000 175.6555 34 A 3.9675 7.5349 122.2263 55.1875 18.4726 180.2698 35 V 3.4828 7.8800 110.4082 63.9549 31.3783 178.5873 36 E 4.0127 7.7660 117.0614 58.8281 29.6444 178.6958 37 A 4.0360 7.8736 120.4308 54.9348 18.4676 179.7321 38 I 3.6029 8.0375 118.7966 64.5248 37.0353 178.6100 39 S 4.0558 8.1722 116.0649 61.8292 62.7442 176.4815 40 D 4.3277 7.7607 121.0704 57.6883 40.6011 179.3367 41 R 3.9026 7.8613 118.0310 58.9558 29.7813 179.1103 42 I 3.6879 7.4338 119.1785 64.3327 37.1954 177.3569 43 C 4.3814 7.9098 119.4445 59.7886 43.3201 175.6428 44 I 3.3585 7.3812 120.0322 64.0420 36.5764 177.1651 45 H 4.6223 7.8289 114.3130 54.8027 29.1201 174.8488 46 T 4.5893 6.7827 111.3362 59.4207 70.7431 174.4809 47 N 4.4128 8.8489 119.1857 54.1679 38.5553 174.8701 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 L 8.17 4.28 0.00 1.63 1.65 0.90 0.64 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 2 P 0.00 4.25 0.00 2.58 2.09 0.00 3.70 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 2.04 2.07 0.00 3 A 9.20 4.26 1.31 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 0.00 0.00 0.00 4 S 7.61 4.77 0.00 3.82 3.72 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 5 F 8.35 4.56 0.00 2.92 2.95 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 6 D 7.55 4.43 0.00 2.58 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 7 A 8.60 3.99 1.64 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 0.00 0.00 8 R 8.36 4.05 0.00 2.07 1.99 0.00 3.15 0.00 0.00 3.23 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.73 0.00 9 E 7.57 4.29 0.00 1.83 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 0.00 2.18 2.36 0.00 10 Q 7.49 3.73 0.00 1.26 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.35 0.00 0.00 0.00 0.00 0.00 1.47 1.16 0.00 11 W 7.93 5.10 0.00 3.61 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 12 P 0.00 4.31 0.00 2.18 2.19 0.00 3.84 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.95 0.00 13 Q 8.19 4.25 0.00 2.27 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 6.94 0.00 0.00 0.00 0.00 0.00 2.52 2.41 0.00 14 C 8.13 5.10 0.00 3.24 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 15 P 0.00 4.09 0.00 2.22 2.35 0.00 3.73 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.99 0.00 16 T 7.91 3.94 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 1.25 0.00 0.00 17 I 7.34 3.94 2.03 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.72 1.04 0.00 0.00 18 K 7.69 4.33 0.00 1.87 1.84 0.00 1.70 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.38 7.81 19 E 8.47 4.34 0.00 1.88 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 2.29 2.28 0.00 20 I 8.28 4.24 1.87 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 1.42 0.99 0.90 0.00 0.00 21 R 8.34 4.41 0.00 2.25 2.22 0.00 3.19 0.00 0.00 3.41 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 22 D 8.11 4.48 0.00 2.50 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 Q 8.18 3.10 0.00 1.84 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.86 0.00 0.00 0.00 0.00 0.00 2.08 2.19 0.00 24 G 8.19 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 25 S 8.25 4.50 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 26 C 7.48 4.60 0.00 2.91 2.95 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 27 G 8.69 4.04 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 0.00 0.00 0.00 28 S 7.61 4.71 0.00 4.10 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 29 C 8.18 4.29 0.00 3.23 3.43 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 30 W 8.39 4.24 0.00 3.64 3.38 0.00 0.00 0.00 0.00 0.00 0.00 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 A 6.58 3.50 0.30 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 32 F 8.16 3.64 0.00 3.15 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 33 G 8.23 3.70 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 0.00 0.00 0.00 34 A 7.53 3.97 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.88 3.48 1.78 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 0.57 0.00 0.00 0.54 0.00 0.00 36 E 7.77 4.01 0.00 2.14 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 2.36 2.38 0.00 37 A 7.87 4.04 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 38 I 8.04 3.60 1.91 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 1.48 0.83 0.86 0.00 0.00 39 S 8.17 4.06 0.00 4.01 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 40 D 7.76 4.33 0.00 2.70 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 41 R 7.86 3.90 0.00 1.81 1.86 0.00 3.07 0.00 0.00 3.07 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.74 0.00 42 I 7.43 3.69 1.98 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 1.37 0.42 0.88 0.00 0.00 43 C 7.91 4.38 0.00 2.90 3.20 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 44 I 7.38 3.36 1.44 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.14 0.26 0.08 0.00 0.00 45 H 7.83 4.62 0.00 3.19 3.32 0.00 5.82 0.00 0.00 0.00 0.00 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 T 6.78 4.59 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 1.26 0.00 0.00 47 N 8.85 4.41 0.00 2.72 2.83 0.00 0.00 6.81 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