NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3580 8.2649 123.5820 52.1028 21.0358 177.0898 3 K 4.2908 7.9928 117.6062 57.1118 34.6398 174.3730 4 H 3.4194 9.5892 114.1259 58.4449 29.6546 174.6247 5 P 4.4355 0.0000 0.0000 63.4369 32.6294 176.0498 6 V 4.4455 7.8709 119.9895 60.7670 34.5035 172.2168 7 P 4.3633 0.0000 0.0000 62.7445 31.7903 176.4300 8 K 4.2083 8.5975 123.1920 58.3797 32.7020 177.2154 9 K 4.5824 7.6088 116.0043 54.0074 36.0351 175.5777 10 K 3.7630 8.7989 123.7182 56.9999 32.3610 176.4513 11 T 3.9074 8.4801 122.9577 63.5312 69.0843 174.5962 12 S 4.2222 8.6401 120.4175 58.2074 64.0046 175.3341 13 K 4.0469 8.7139 127.1530 59.6158 32.1354 179.3644 14 A 3.9850 8.1003 122.4418 55.2092 18.3882 179.5095 15 R 3.7993 7.9714 115.1148 59.5365 30.3084 178.1327 16 R 3.9802 8.4196 119.2733 59.5490 30.1825 178.2129 17 D 4.3930 8.0373 118.0196 57.0481 40.7147 178.8957 18 A 3.9622 8.2506 121.8927 55.1927 18.1972 179.6308 19 R 3.8918 7.7734 115.8879 59.2527 30.3313 177.9014 20 R 4.5224 7.6158 116.0897 56.0552 29.7495 177.8537 21 S 3.9649 7.7364 115.8031 61.8489 62.2006 175.3686 22 H 4.8942 7.8233 113.2110 56.0046 28.6210 175.9180 23 H 4.2757 8.2472 119.5490 58.0681 28.8323 176.2037 24 A 4.0640 7.9571 120.9495 52.5089 18.5306 176.8602 25 L 4.5224 8.1405 120.3688 53.8270 43.3764 176.1577 26 T 4.7131 7.8963 108.7994 58.8044 71.3643 172.1304 27 P 4.3540 0.0000 0.0000 61.9085 31.8790 174.4714 28 P 4.2332 0.0000 0.0000 63.0481 31.8357 176.2420 29 I 4.0534 8.2383 121.6553 60.9024 36.6485 174.8652 30 L 5.1248 8.1501 124.5412 53.1706 44.9983 176.3229 31 V 4.6041 9.0279 112.9846 59.4017 36.4419 172.9180 32 P 4.9660 0.0000 0.0000 62.7139 31.9899 175.5823 33 C 4.7807 8.2029 118.2774 55.9524 31.1420 172.1192 34 P 4.5315 0.0000 0.0000 66.1018 32.4692 178.4825 35 E 4.2459 8.1420 113.4705 56.3310 28.4711 179.9172 36 C 4.3099 8.9691 129.7552 59.9862 32.1299 171.9864 37 K 4.1085 8.3933 120.4432 56.8778 32.1059 175.9074 38 A 4.3412 7.7137 120.2188 53.1703 20.0323 175.5173 39 M 5.0327 8.4443 117.4692 53.8219 34.1008 176.2767 40 K 4.7305 9.1680 122.0882 53.8778 36.0278 174.0008 41 P 5.0191 0.0000 0.0000 60.7782 32.2762 174.7305 42 P 4.3002 0.0000 0.0000 63.5421 31.8765 175.3167 43 H 4.1890 8.5524 113.6166 56.4926 26.3670 175.6967 44 T 4.3721 7.6351 107.6774 59.7881 71.0614 173.6330 45 V 3.0949 7.8994 126.5470 63.0602 31.8324 174.5158 46 C 4.6931 8.0522 125.1589 56.6556 34.6524 171.2971 47 P 4.1215 0.0000 0.0000 64.3924 31.1001 176.2211 48 E 3.9967 8.9885 119.2977 56.4491 29.3820 173.8329 49 C 4.6470 8.4444 110.6325 59.0292 30.4565 174.1816 50 G 4.0693 5.3800 112.0359 44.1152 0.0000 173.6857 51 Y 4.0568 7.7710 125.5133 58.5485 42.6798 173.2765 52 Y 4.2907 8.3685 113.2519 56.9415 38.6596 173.9809 53 A 4.0893 8.8567 127.6810 52.7432 18.7272 176.9621 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 A 8.26 4.36 1.30 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 3 K 7.99 4.29 0.00 1.80 1.66 0.00 1.65 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.51 7.81 4 H 9.59 3.42 0.00 3.16 3.02 0.00 5.73 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 P 0.00 4.44 0.00 2.05 1.99 0.00 3.72 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.09 0.00 6 V 7.87 4.45 2.09 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 0.75 0.00 0.00 1.01 0.00 0.00 7 P 0.00 4.36 0.00 2.08 1.97 0.00 3.72 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 8 K 8.60 4.21 0.00 1.69 1.82 0.00 1.65 0.00 0.00 1.71 0.00 0.00 3.06 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.40 1.52 7.81 9 K 7.61 4.58 0.00 1.72 1.63 0.00 1.84 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.34 1.36 7.81 10 K 8.80 3.76 0.00 1.71 1.75 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.78 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.49 7.81 11 T 8.48 3.91 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 12 S 8.64 4.22 0.00 3.88 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 13 K 8.71 4.05 0.00 2.01 2.06 0.00 1.55 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.49 1.51 7.81 14 A 8.10 3.99 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.97 3.80 0.00 1.81 2.11 0.00 3.25 0.00 0.00 3.15 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.70 0.00 16 R 8.42 3.98 0.00 1.88 2.12 0.00 3.13 0.00 0.00 3.15 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 17 D 8.04 4.39 0.00 2.72 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 0.00 18 A 8.25 3.96 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.77 3.89 0.00 1.85 2.18 0.00 3.28 0.00 0.00 3.25 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.71 0.00 20 R 7.62 4.52 0.00 2.03 1.86 0.00 3.17 0.00 0.00 3.01 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.56 0.00 21 S 7.74 3.96 0.00 3.86 3.57 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 22 H 7.82 4.89 0.00 3.13 3.28 0.00 5.94 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 H 8.25 4.28 0.00 3.36 3.36 0.00 5.68 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 7.96 4.06 1.26 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 25 L 8.14 4.52 0.00 1.65 1.64 0.93 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 26 T 7.90 4.71 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 1.22 0.00 0.00 27 P 0.00 4.35 0.00 2.20 2.10 0.00 3.78 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 28 P 0.00 4.23 0.00 2.20 2.10 0.00 3.76 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 29 I 8.24 4.05 1.88 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 1.41 0.92 0.00 0.00 30 L 8.15 5.12 0.00 1.49 1.55 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 31 V 9.03 4.60 2.09 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 0.70 0.00 0.00 0.97 0.00 0.00 32 P 0.00 4.97 0.00 1.95 1.98 0.00 3.67 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 33 C 8.20 4.78 0.00 3.27 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 34 P 0.00 4.53 0.00 2.31 2.32 0.00 3.85 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 2.10 2.16 0.00 35 E 8.14 4.25 0.00 1.96 1.25 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 2.28 2.36 0.00 36 C 8.97 4.31 0.00 3.14 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 37 K 8.39 4.11 0.00 1.76 1.80 0.00 1.84 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.44 7.81 38 A 7.71 4.34 1.26 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 39 M 8.44 5.03 0.00 1.88 1.97 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.48 0.00 40 K 9.17 4.73 0.00 1.61 1.64 0.00 1.64 0.00 0.00 1.93 0.00 0.00 2.80 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.30 1.35 7.81 41 P 0.00 5.02 0.00 1.93 1.97 0.00 3.71 0.00 0.00 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.94 0.00 42 P 0.00 4.30 0.00 2.10 1.90 0.00 3.84 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 43 H 8.55 4.19 0.00 3.27 3.39 0.00 5.68 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 44 T 7.64 4.37 4.17 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 0.00 0.00 0.00 1.19 0.00 0.00 45 V 7.90 3.09 1.80 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 0.59 0.00 0.00 0.07 0.00 0.00 46 C 8.05 4.69 0.00 2.86 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 47 P 0.00 4.12 0.00 2.19 2.02 0.00 3.82 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.94 0.00 48 E 8.99 4.00 0.00 2.11 2.15 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 2.15 2.36 0.00 49 C 8.44 4.65 0.00 2.99 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 50 G 5.38 4.07 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 0.00 0.00 0.00 51 Y 7.77 4.06 0.00 2.64 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 52 Y 8.37 4.29 0.00 2.86 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 53 A 8.86 4.09 1.37 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 0.00 0.00 0.00