NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.1953 8.2649 123.5822 51.9963 20.6680 173.2493 2 T 3.0134 8.3495 118.2990 62.8532 68.5138 165.0000 3 V 3.2575 8.4170 129.7712 62.8956 30.1295 170.7770 4 V 4.3402 7.8927 122.1274 61.7675 34.3144 176.5132 5 S 4.5971 7.2145 110.5803 56.7649 64.5254 176.0904 6 G 4.2635 8.3017 113.2622 46.4000 0.0000 171.1615 7 Q 4.6075 8.8842 122.3931 56.6256 36.9800 174.7113 8 K 3.7478 7.9793 118.3750 56.5908 28.6848 172.9832 9 Q 4.5764 7.8306 119.7687 53.6774 31.5198 174.7414 10 D 4.4816 8.5673 124.5003 54.1162 41.9945 176.0198 11 R 4.5603 7.6319 118.7778 55.9729 32.1169 173.3133 12 Q 4.4968 8.7193 120.0400 53.9963 31.9775 175.0220 13 G 3.9529 8.4001 107.1222 45.8279 0.0000 174.1182 14 G 4.0232 7.9978 116.9553 43.7486 0.0000 170.1074 15 E 4.4918 7.8906 118.2653 54.8272 30.6315 174.9670 16 R 4.7005 8.1361 124.0174 54.8624 34.2547 174.6668 17 R 4.7274 8.3152 118.8140 54.7383 34.4190 176.1345 18 R 4.5004 8.0077 116.9931 55.8608 29.5439 176.4442 19 S 3.8364 8.5006 111.0918 59.7845 60.9801 172.5992 20 Q 3.4458 8.2251 113.3237 56.1244 26.1996 173.9770 21 L 3.7954 7.4320 117.9010 55.6894 42.8577 175.5737 22 D 4.9389 8.0359 122.5773 52.0616 43.9074 176.5239 23 R 4.1455 8.4611 122.6650 58.0894 30.3963 175.9259 24 D 5.1638 7.7650 116.3985 54.9140 42.7841 173.9366 25 Q 4.8733 7.8457 116.6453 53.7716 32.7177 173.5003 26 C 4.5297 8.6329 121.9186 57.0911 33.5835 173.6048 27 A 4.5392 8.3692 128.6934 52.6816 19.1853 176.6986 28 Y 4.3740 8.0253 118.7324 60.4595 40.5686 175.8345 29 C 4.5479 8.3125 111.1051 57.4233 30.8734 174.0629 30 K 4.7397 8.0184 117.6671 57.7444 28.8396 175.3053 31 E 4.3847 7.8987 118.4686 55.1681 30.5712 175.4363 32 K 4.6418 9.6116 122.2392 54.8529 34.1849 174.7893 33 G 3.6512 7.5716 118.8877 45.4100 0.0000 172.5153 34 H 5.0984 7.5886 114.3727 53.1115 31.5417 172.4730 35 W 4.8448 8.4066 118.1109 54.4737 31.7448 177.2084 36 A 4.1518 8.6327 122.3958 55.6207 17.8171 179.7335 37 K 4.3439 8.2722 111.9728 58.0040 32.2099 176.7736 38 D 4.8582 8.4668 117.8112 53.6173 42.4256 174.6745 39 C 4.2286 8.0467 119.1637 58.3205 31.7803 172.3310 40 P 4.4902 0.0000 0.0000 63.6712 31.2001 176.8987 41 K 4.0504 7.4226 118.1353 57.6730 32.6895 175.9527 42 K 3.6012 7.0707 117.7891 55.8594 31.7168 174.8936 43 P 4.5057 0.0000 0.0000 62.1891 32.2887 175.7572 44 R 4.3236 7.8444 117.4893 55.6608 32.2242 174.0075 45 G 3.8277 8.6522 113.1401 44.6766 0.0000 171.0351 46 P 4.5589 0.0000 0.0000 61.5506 32.7532 176.0134 47 R 4.3294 8.2278 114.6487 55.7878 31.8710 177.9021 48 G 3.5924 8.8311 112.2525 46.2093 0.0000 174.9470 49 P 4.5852 0.0000 0.0000 62.0194 33.0372 175.9010 50 R 4.5205 8.0057 117.6246 53.8717 32.6503 172.7892 51 P 4.5386 0.0000 0.0000 62.2534 32.4365 175.2025 52 Q 4.4667 7.5919 115.5084 55.9169 31.4223 172.5591 53 T 4.6888 8.4050 114.5179 60.0380 72.0009 173.7209 54 S 4.0708 8.5315 115.5572 57.9280 63.8793 171.4098 55 L 3.4392 8.6330 132.9594 55.2237 41.4108 174.1067 56 L 4.0893 8.2465 124.2658 55.5536 42.5178 174.7669 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 8.26 4.20 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 2 T 8.35 3.01 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 V 8.42 3.26 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 0.86 0.00 0.00 0.93 0.00 0.00 4 V 7.89 4.34 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 0.93 0.00 0.00 0.93 0.00 0.00 5 S 7.21 4.60 0.00 3.94 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 6 G 8.30 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 0.00 0.00 0.00 0.00 7 Q 8.88 4.61 0.00 2.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.57 0.00 0.00 0.00 0.00 0.00 2.24 2.34 0.00 8 K 7.98 3.75 0.00 1.89 1.83 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.75 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.40 7.81 9 Q 7.83 4.58 0.00 1.97 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.01 0.00 0.00 0.00 0.00 0.00 2.22 2.30 0.00 10 D 8.57 4.48 0.00 2.68 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 7.63 4.56 0.00 1.79 1.83 0.00 3.37 0.00 0.00 3.27 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.38 0.00 12 Q 8.72 4.50 0.00 2.07 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.69 0.00 0.00 0.00 0.00 0.00 2.21 2.38 0.00 13 G 8.40 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 0.00 0.00 0.00 14 G 8.00 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 0.00 0.00 0.00 15 E 7.89 4.49 0.00 1.91 1.87 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 2.19 2.29 0.00 16 R 8.14 4.70 0.00 1.77 1.74 0.00 3.35 0.00 0.00 3.21 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.58 0.00 17 R 8.32 4.73 0.00 1.70 1.77 0.00 3.19 0.00 0.00 3.21 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.65 0.00 18 R 8.01 4.50 0.00 1.78 1.79 0.00 3.24 0.00 0.00 3.30 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.58 0.00 19 S 8.50 3.84 0.00 3.95 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 20 Q 8.23 3.45 0.00 2.16 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.24 2.30 0.00 21 L 7.43 3.80 0.00 1.69 1.49 0.79 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 22 D 8.04 4.94 0.00 2.67 2.50 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.46 4.15 0.00 1.85 2.05 0.00 3.64 0.00 0.00 3.23 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 2.04 0.00 24 D 7.77 5.16 0.00 2.86 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.85 4.87 0.00 1.98 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.34 0.00 0.00 0.00 0.00 0.00 2.33 2.19 0.00 26 C 8.63 4.53 0.00 2.87 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 27 A 8.37 4.54 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.03 4.37 0.00 2.92 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 29 C 8.31 4.55 0.00 3.29 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 30 K 8.02 4.74 0.00 1.93 1.99 0.00 1.65 0.00 0.00 2.33 0.00 0.00 3.23 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.29 1.55 7.81 31 E 7.90 4.38 0.00 2.04 1.88 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 2.40 2.33 0.00 32 K 9.61 4.64 0.00 1.84 1.79 0.00 1.57 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.35 1.42 7.81 33 G 7.57 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 34 H 7.59 5.10 0.00 3.32 3.35 0.00 5.50 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 35 W 8.41 4.84 0.00 3.34 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 36 A 8.63 4.15 1.44 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 0.00 0.00 37 K 8.27 4.34 0.00 1.87 1.94 0.00 1.78 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.66 1.51 7.81 38 D 8.47 4.86 0.00 2.64 2.76 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 39 C 8.05 4.23 0.00 3.00 2.32 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 0.00 40 P 0.00 4.49 0.00 2.15 2.04 0.00 3.69 0.00 0.00 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.79 0.00 41 K 7.42 4.05 0.00 1.46 1.89 0.00 1.83 0.00 0.00 1.81 0.00 0.00 3.18 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.49 1.45 7.81 42 K 7.07 3.60 0.00 1.85 1.74 0.00 1.66 0.00 0.00 1.75 0.00 0.00 3.20 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.39 1.18 7.81 43 P 0.00 4.51 0.00 2.19 2.07 0.00 3.86 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 2.03 2.00 0.00 44 R 7.84 4.32 0.00 1.75 1.79 0.00 3.24 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.43 0.00 45 G 8.65 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 46 P 0.00 4.56 0.00 2.19 2.11 0.00 3.76 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 1.98 1.95 0.00 47 R 8.23 4.33 0.00 1.94 1.98 0.00 3.19 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.57 0.00 48 G 8.83 3.59 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 0.00 0.00 0.00 49 P 0.00 4.59 0.00 2.19 2.09 0.00 3.72 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 50 R 8.01 4.52 0.00 1.72 1.78 0.00 3.23 0.00 0.00 3.28 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.60 0.00 51 P 0.00 4.54 0.00 2.22 2.05 0.00 3.88 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 52 Q 7.59 4.47 0.00 1.98 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.83 0.00 0.00 0.00 0.00 0.00 2.09 2.17 0.00 53 T 8.40 4.69 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 54 S 8.53 4.07 0.00 3.95 3.87 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 55 L 8.63 3.44 0.00 1.78 1.70 0.92 0.99 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 56 L 8.25 4.09 0.00 1.61 1.48 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00