NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.5298 8.2993 120.0852 56.8944 33.8319 174.0406 2 T 4.6988 8.2201 109.7159 60.3019 71.8324 172.4289 3 C 5.0562 9.9374 121.7780 55.3140 43.9086 173.7802 4 E 5.3220 8.6390 121.4729 55.0594 31.3984 175.1165 5 H 4.9201 9.5499 121.1548 53.8687 32.8901 172.1101 6 L 4.3757 8.2348 124.9460 53.5986 42.6646 175.7634 7 A 4.2918 8.2389 129.8213 51.0361 18.2602 177.5364 8 D 4.5086 8.7139 122.8898 57.0100 41.5706 177.4386 9 T 4.5079 7.3599 110.4248 60.7947 68.1891 172.4559 10 Y 4.4864 7.5123 123.5408 56.4139 41.7433 174.0647 11 R 4.3992 6.1038 119.0105 54.4237 30.2699 177.2003 12 G 3.6345 8.1660 116.3850 46.7300 0.0000 171.8819 13 V 4.2971 8.4771 122.4616 62.2069 32.5971 176.1057 14 C 5.5257 8.5202 124.9953 55.0276 44.2668 172.3998 15 F 4.4076 9.3644 125.1999 58.7890 40.4398 176.0410 16 T 4.6700 7.6375 110.0355 59.7119 70.7697 175.0377 17 N 4.3213 8.8665 121.1180 56.6558 38.5188 177.3670 18 A 4.0574 8.1054 121.9034 55.1872 18.5792 179.6053 19 S 4.2451 8.3095 112.7831 61.5225 62.7395 176.0501 20 C 4.4615 8.1222 119.3823 59.6847 38.3491 174.5555 21 D 4.3128 8.2302 119.3078 57.6771 40.5906 177.6465 22 D 4.4200 8.1993 117.3031 57.9381 41.2221 177.9833 23 H 4.2205 7.8505 117.3501 59.8670 29.8942 176.0855 24 C 4.2990 9.6659 117.7850 60.1432 39.8955 176.4733 25 K 3.9405 8.3509 118.6499 59.6253 31.7298 178.8614 26 N 4.5687 8.7869 115.8715 55.3546 38.6376 177.1565 27 K 4.4172 8.8241 119.8387 57.1479 34.0155 177.7347 28 A 4.5695 7.2155 125.8344 49.9312 18.8857 173.2323 29 H 3.9702 7.5408 125.1752 56.1193 29.6838 172.4812 30 L 4.8591 8.2400 122.6655 52.0629 45.6469 177.3376 31 I 3.8422 7.7958 112.4895 63.9272 37.8707 175.6218 32 S 4.6369 6.2849 113.3481 60.5434 64.7524 173.1494 33 G 4.0967 7.7769 105.9148 45.6120 0.0000 172.1352 34 T 4.5351 7.6882 115.7221 59.4753 70.4647 173.6875 35 C 4.7204 8.5532 121.1500 57.1810 40.2328 173.1536 36 H 4.6013 8.7880 129.4609 55.2240 28.3557 177.4491 37 N 5.0638 8.5714 113.0268 55.5041 35.7120 174.7929 38 W 3.6321 8.7193 115.8096 57.1687 27.2496 174.0007 39 K 4.7082 7.6465 117.7328 55.3780 36.2295 174.0672 40 C 5.3650 8.3711 116.0481 55.5910 42.2783 173.3326 41 F 5.1714 8.6158 122.2735 55.8642 41.0070 174.5164 42 C 5.2212 9.8045 122.0796 55.5020 41.6416 172.6451 43 T 5.2067 8.1680 111.8283 60.2217 70.8463 173.2221 44 Q 4.8529 9.1919 125.3687 54.0035 33.1799 173.7883 45 N 4.8705 8.7607 122.1090 53.3171 39.3452 174.1835 46 C 4.3971 8.5354 117.3752 55.9520 42.4277 173.6456 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 K 8.30 4.53 0.00 1.66 1.85 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.45 7.81 2 T 8.22 4.70 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 3 C 9.94 5.06 0.00 2.83 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 E 8.64 5.32 0.00 1.89 2.01 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 2.27 2.33 0.00 5 H 9.55 4.92 0.00 2.95 3.05 0.00 5.60 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.23 4.38 0.00 0.27 0.92 0.77 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 7 A 8.24 4.29 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 8 D 8.71 4.51 0.00 2.66 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 9 T 7.36 4.51 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 1.24 0.00 0.00 10 Y 7.51 4.49 0.00 3.17 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 11 R 6.10 4.40 0.00 1.65 1.67 0.00 3.12 0.00 0.00 3.07 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.87 0.00 12 G 8.17 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.48 4.30 2.24 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 -0.23 0.00 0.00 1.21 0.00 0.00 14 C 8.52 5.53 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 15 F 9.36 4.41 0.00 2.92 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 16 T 7.64 4.67 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 1.26 0.00 0.00 17 N 8.87 4.32 0.00 2.84 2.94 0.00 0.00 6.96 7.06 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 18 A 8.11 4.06 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 19 S 8.31 4.25 0.00 4.33 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 20 C 8.12 4.46 0.00 3.15 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 21 D 8.23 4.31 0.00 2.91 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 8.20 4.42 0.00 2.88 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 23 H 7.85 4.22 0.00 3.72 3.57 0.00 5.85 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 C 9.67 4.30 0.00 3.24 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 K 8.35 3.94 0.00 1.83 1.90 0.00 1.71 0.00 0.00 1.72 0.00 0.00 3.33 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.63 1.70 7.81 26 N 8.79 4.57 0.00 2.79 2.90 0.00 0.00 7.27 8.41 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 27 K 8.82 4.42 0.00 1.63 1.84 0.00 1.73 0.00 0.00 1.75 0.00 0.00 3.09 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.64 1.77 7.81 28 A 7.22 4.57 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 29 H 7.54 3.97 0.00 3.08 3.26 0.00 5.87 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 L 8.24 4.86 0.00 1.68 1.66 0.94 1.09 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 31 I 7.80 3.84 1.86 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 1.38 0.52 0.89 0.00 0.00 32 S 6.28 4.64 0.00 3.83 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 33 G 7.78 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 0.00 0.00 0.00 34 T 7.69 4.54 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 1.14 0.00 0.00 35 C 8.55 4.72 0.00 2.93 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 36 H 8.79 4.60 0.00 3.01 2.80 0.00 5.86 0.00 0.00 0.00 0.00 7.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 N 8.57 5.06 0.00 2.85 2.84 0.00 0.00 6.84 7.62 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 38 W 8.72 3.63 0.00 3.44 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 39 K 7.65 4.71 0.00 2.40 1.79 0.00 1.89 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.83 7.81 40 C 8.37 5.37 0.00 2.45 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 41 F 8.62 5.17 0.00 2.39 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 42 C 9.80 5.22 0.00 2.74 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 43 T 8.17 5.21 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 1.24 0.00 0.00 44 Q 9.19 4.85 0.00 2.09 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 7.05 0.00 0.00 0.00 0.00 0.00 2.26 2.31 0.00 45 N 8.76 4.87 0.00 2.65 2.75 0.00 0.00 6.76 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 46 C 8.54 4.40 0.00 3.04 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00