NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -2 R 4.2997 8.2544 119.7066 56.0548 30.5639 173.9736 -1 K 4.5005 7.9663 123.3614 53.9394 36.5880 176.6480 0 L 3.4467 8.9441 123.8697 55.4937 41.9440 178.9728 1 C 4.3175 8.8717 122.8815 60.9552 40.0191 175.8351 2 S 3.8896 8.1484 114.8130 59.9874 62.7877 173.8401 3 L 4.2659 8.0942 123.2473 53.7395 41.7337 175.5517 4 D 4.1093 9.0677 129.4251 56.3309 39.6435 173.0684 5 N 4.2910 8.4461 110.2473 52.9354 37.9736 174.1298 6 G 3.5637 8.5798 101.0068 45.8790 0.0000 174.7486 7 D 4.5203 8.6164 116.4578 54.2366 40.5668 173.4882 8 C 4.5599 7.8321 114.9655 57.2328 40.8810 173.7282 9 D 4.5019 8.6974 123.6834 56.8954 42.1764 177.3594 10 Q 4.4059 7.5243 111.9705 55.6415 30.7506 179.3448 11 F 4.6464 6.2136 127.5983 58.6888 40.1397 172.7741 12 C 5.5817 8.9393 123.0819 55.0628 40.5794 172.5355 13 H 5.1839 8.9068 120.3224 54.1375 32.2036 171.7336 14 E 5.3147 9.0652 119.2198 54.0015 31.3708 175.7739 15 E 4.1720 8.3475 121.6819 55.2183 31.2190 171.3400 16 Q 3.3194 7.7036 132.9297 56.6405 27.8807 174.6326 17 N 4.0566 7.1926 125.8897 52.9797 34.8608 173.9748 18 S 4.5060 7.8960 110.8232 57.3681 66.6026 174.7782 19 V 4.1084 8.2880 125.5991 62.3152 32.7996 175.4308 20 V 4.3500 8.3108 125.7994 61.5666 34.3321 173.5633 21 C 5.4232 8.8645 125.3399 55.9637 41.2987 172.7686 22 S 4.7969 8.8606 115.1393 57.6411 66.8118 171.6365 23 C 4.7924 8.5947 115.8922 54.7181 38.9831 174.0237 24 A 4.6228 8.6415 124.0252 51.2572 18.9429 177.4304 25 R 4.1838 8.4255 118.6206 58.2272 30.6032 177.9034 26 G 3.9655 9.4185 109.7986 45.2135 0.0000 172.0468 27 Y 5.3206 7.6986 115.7590 56.2165 41.8967 175.0860 28 T 4.7447 8.9687 111.2145 59.4701 72.2384 173.0916 29 L 4.4690 8.7399 126.7641 55.5024 42.9650 176.5467 30 A 4.3352 9.0949 128.3597 51.0395 19.9213 177.7089 31 D 4.2610 8.8426 118.0119 57.7056 41.0838 177.0906 32 N 4.4659 8.1956 113.0038 52.9508 37.4265 174.9323 33 G 4.0456 8.3283 107.1033 46.7284 0.0000 174.4563 34 K 4.4866 8.8637 118.0880 57.5802 35.8793 177.0795 35 A 4.6609 8.3111 120.5201 51.9103 20.1393 176.8188 36 C 5.3625 8.8913 116.9649 55.3709 41.4075 173.7846 37 I 4.6008 8.6997 125.7185 58.9917 38.7433 174.2276 38 P 4.2294 0.0000 0.0000 63.0965 31.6030 176.0141 39 T 4.4075 8.2655 116.3093 63.5389 71.0559 174.0369 40 G 4.2262 7.5491 108.0802 43.0121 0.0000 170.3054 41 P 4.1665 0.0000 0.0000 64.5353 32.0184 176.5136 42 Y 4.8207 7.3282 114.5261 55.5825 38.1087 173.2071 43 P 4.3331 0.0000 0.0000 62.1945 32.6351 176.6611 44 C 4.3831 8.4989 114.9350 59.7147 30.0423 173.9362 45 G 3.9412 8.9059 109.0857 45.9109 0.0000 172.9826 46 K 4.5948 7.4769 118.6954 54.4028 33.7872 176.2699 47 Q 4.3958 8.5130 122.6570 55.5097 29.7648 175.9052 48 T 4.4544 8.1036 115.2897 60.1750 67.6046 173.8101 49 L 4.2568 8.1813 125.3114 54.4448 41.8176 176.9078 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 -2 R 8.25 4.30 0.00 1.82 2.00 0.00 3.11 0.00 0.00 3.22 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.63 0.00 -1 K 7.97 4.50 0.00 1.81 1.60 0.00 1.86 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.38 1.52 7.81 0 L 8.94 3.45 0.00 1.99 1.04 0.98 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 1 C 8.87 4.32 0.00 3.19 3.16 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 2 S 8.15 3.89 0.00 4.10 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 3 L 8.09 4.27 0.00 1.75 1.70 0.92 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 4 D 9.07 4.11 0.00 2.91 2.61 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 5 N 8.45 4.29 0.00 2.95 2.76 0.00 0.00 7.59 7.92 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 6 G 8.58 3.56 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 D 8.62 4.52 0.00 2.76 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 8 C 7.83 4.56 0.00 3.09 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 9 D 8.70 4.50 0.00 2.71 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.52 4.41 0.00 1.49 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.82 6.92 0.00 0.00 0.00 0.00 0.00 1.83 1.96 0.00 11 F 6.21 4.65 0.00 3.05 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 12 C 8.94 5.58 0.00 3.02 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 13 H 8.91 5.18 0.00 3.19 3.32 0.00 5.29 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 14 E 9.07 5.31 0.00 1.88 1.92 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 2.23 2.13 0.00 15 E 8.35 4.17 0.00 2.01 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 2.36 0.00 16 Q 7.70 3.32 0.00 2.29 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.39 6.72 0.00 0.00 0.00 0.00 0.00 2.31 2.37 0.00 17 N 7.19 4.06 0.00 2.80 2.90 0.00 0.00 6.95 7.57 0.00 0.00 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 S 7.90 4.51 0.00 3.83 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 19 V 8.29 4.11 2.07 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 0.78 0.00 0.00 0.93 0.00 0.00 20 V 8.31 4.35 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 0.89 0.00 0.00 0.97 0.00 0.00 21 C 8.86 5.42 0.00 3.00 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 22 S 8.86 4.80 0.00 4.03 4.05 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 0.00 0.00 0.00 23 C 8.59 4.79 0.00 2.84 2.85 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 0.00 0.00 0.00 24 A 8.64 4.62 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 25 R 8.43 4.18 0.00 1.90 1.96 0.00 3.26 0.00 0.00 3.27 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.74 0.00 26 G 9.42 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 0.00 0.00 0.00 27 Y 7.70 5.32 0.00 2.94 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 28 T 8.97 4.74 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 1.23 0.00 0.00 29 L 8.74 4.47 0.00 1.68 1.63 1.02 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 30 A 9.09 4.34 1.34 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 31 D 8.84 4.26 0.00 2.65 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 32 N 8.20 4.47 0.00 2.85 2.92 0.00 0.00 5.96 7.00 0.00 0.00 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 8.33 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 34 K 8.86 4.49 0.00 1.75 1.93 0.00 1.66 0.00 0.00 1.79 0.00 0.00 2.88 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.33 1.58 7.81 35 A 8.31 4.66 1.27 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 0.00 0.00 0.00 36 C 8.89 5.36 0.00 2.66 2.92 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 37 I 8.70 4.60 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.06 0.91 0.00 0.00 38 P 0.00 4.23 0.00 1.75 1.60 0.00 3.58 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.99 0.00 39 T 8.27 4.41 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 1.18 0.00 0.00 40 G 7.55 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 0.00 0.00 0.00 0.00 41 P 0.00 4.17 0.00 1.80 1.84 0.00 3.62 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.01 0.00 42 Y 7.33 4.82 0.00 2.92 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 43 P 0.00 4.33 0.00 1.65 1.64 0.00 3.61 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.76 0.00 44 C 8.50 4.38 0.00 3.20 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 G 8.91 3.94 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 0.00 0.00 0.00 46 K 7.48 4.59 0.00 1.75 1.79 0.00 1.77 0.00 0.00 1.78 0.00 0.00 3.07 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.55 1.60 7.81 47 Q 8.51 4.40 0.00 2.06 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.11 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 48 T 8.10 4.45 4.32 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 1.31 0.00 0.00 49 L 8.18 4.26 0.00 1.68 1.57 0.93 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00