NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.7850 8.3549 109.7327 46.0473 0.0000 172.8423 3 R 3.4935 8.2814 116.9296 56.0095 26.3745 174.0053 4 P 4.4040 0.0000 0.0000 64.9245 33.0225 176.1343 5 Y 4.7887 6.6233 112.4150 56.4002 41.2597 174.2078 6 K 4.3021 9.0778 126.5325 57.7257 31.7189 177.2168 7 L 4.5010 7.6081 114.2398 54.9248 41.5038 177.5634 8 L 4.0741 7.8747 120.3382 55.1800 42.6155 176.2198 9 N 4.0005 7.8087 115.8695 53.1519 37.3762 175.6899 10 G 3.8671 7.3998 102.6977 45.5618 0.0000 171.5985 11 I 4.4555 8.2130 126.6215 58.7670 39.7991 175.2968 12 K 4.4580 8.4491 124.3923 54.6380 33.0845 175.7090 13 L 4.7172 8.3984 125.9211 53.7002 43.0284 175.7414 14 G 3.8894 8.6859 111.5646 43.7854 0.0000 172.9007 15 V 4.2921 7.9918 124.4902 61.2209 33.5736 174.5393 16 Y 4.6677 8.4148 121.8946 56.1735 40.1302 175.0482 17 I 4.6147 8.1813 117.2164 57.8789 41.0862 173.4674 18 P 4.3760 0.0000 0.0000 62.4442 31.9381 177.7211 19 Q 4.1480 8.4963 118.4653 58.9633 28.4092 178.1301 20 E 4.0195 8.2847 120.7792 59.6632 29.4568 179.1965 21 W 4.5063 8.1530 118.1848 59.8834 29.0372 178.4347 22 H 4.2090 8.4044 115.9596 58.8976 28.0236 176.8228 23 D 4.3658 8.7760 120.2210 57.5440 41.1909 178.6551 24 R 3.9653 7.9765 118.1021 59.3143 30.2526 179.1953 25 L 3.9472 8.2992 119.1198 58.2016 41.4334 179.6350 26 M 4.1538 7.6666 117.3074 58.1157 32.2229 178.1463 27 E 4.0869 8.0057 119.9704 59.3194 29.7518 178.9496 28 I 3.7421 7.7998 119.5333 64.1558 37.1278 178.0915 29 A 4.1099 8.3700 121.5810 54.1606 17.9617 179.8932 30 K 3.8871 7.7877 117.4253 59.5342 32.1159 178.9524 31 E 3.9346 8.1295 117.5634 58.9532 29.6823 178.0959 32 K 4.1485 8.3422 116.6424 55.4958 33.5698 175.7455 33 N 4.1620 7.7526 116.4525 54.5946 37.2183 172.0897 34 L 4.8829 8.2421 117.3505 52.7490 46.6502 177.0126 35 T 4.6233 8.6121 110.6317 60.0215 72.1080 175.6965 36 L 3.9943 8.3149 122.7586 59.0951 40.3237 179.5494 37 S 4.1221 8.0671 115.6608 61.6179 62.7861 176.2307 38 D 4.3078 7.7008 121.2018 57.4457 40.5295 179.0286 39 V 3.6191 7.6839 118.7585 65.8872 31.2332 177.6275 40 C 3.9929 8.2554 118.0208 62.4065 31.7829 174.9719 41 R 4.0305 7.6853 119.8042 59.7760 29.6989 178.4711 42 L 4.0195 8.4918 118.5220 57.6268 41.5797 179.2945 43 A 4.1248 8.2777 120.8489 54.5672 18.2651 179.8249 44 I 3.7139 7.6113 119.0252 64.4593 37.3263 178.3663 45 K 4.0845 8.0703 120.0109 59.3776 31.9626 178.3376 46 E 3.9420 8.0460 119.3019 59.3643 29.6164 178.0672 47 Y 4.0629 8.4282 119.9936 60.5921 38.7255 178.1526 48 L 4.0974 8.5791 120.2925 58.0125 41.6178 179.0261 49 D 4.2929 7.6726 117.4273 56.8699 41.1975 177.6525 50 N 4.4525 8.0213 116.0456 55.4563 38.6029 176.5578 51 H 4.3901 7.4901 115.2979 56.3171 29.6581 174.7738 52 D 4.9540 8.4555 120.7326 52.4909 42.8975 176.3080 53 K 4.5359 8.4815 124.2849 56.4822 32.6308 177.3114 54 Q 4.1430 8.5293 120.6042 56.2278 29.0184 176.3094 55 K 3.8643 8.0185 115.3694 57.2799 29.6337 175.3932 56 K 4.1793 8.1575 122.5777 56.6957 32.1554 176.9952 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 G 8.35 3.78 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 R 8.28 3.49 0.00 2.02 1.94 0.00 3.47 0.00 0.00 3.20 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.67 0.00 4 P 0.00 4.40 0.00 1.88 2.13 0.00 3.29 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.96 0.00 5 Y 6.62 4.79 0.00 2.99 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 6 K 9.08 4.30 0.00 2.24 2.01 0.00 1.65 0.00 0.00 1.89 0.00 0.00 3.02 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.44 1.54 7.81 7 L 7.61 4.50 0.00 1.59 1.62 0.84 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 8 L 7.87 4.07 0.00 1.65 1.73 0.94 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 9 N 7.81 4.00 0.00 2.79 2.79 0.00 0.00 6.97 7.91 0.00 0.00 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 G 7.40 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 0.00 0.00 0.00 11 I 8.21 4.46 1.88 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 1.31 0.97 0.92 0.00 0.00 12 K 8.45 4.46 0.00 1.68 1.71 0.00 1.59 0.00 0.00 1.75 0.00 0.00 3.12 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.34 1.46 7.81 13 L 8.40 4.72 0.00 1.72 1.58 0.91 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 14 G 8.69 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 0.00 0.00 0.00 15 V 7.99 4.29 2.06 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 0.91 0.00 0.00 0.92 0.00 0.00 16 Y 8.41 4.67 0.00 2.99 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 I 8.18 4.61 1.87 0.00 0.00 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 1.57 0.88 1.14 0.00 0.00 18 P 0.00 4.38 0.00 1.85 1.81 0.00 2.63 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.76 0.00 19 Q 8.50 4.15 0.00 2.33 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.86 0.00 0.00 0.00 0.00 0.00 2.40 2.50 0.00 20 E 8.28 4.02 0.00 1.99 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 2.35 2.32 0.00 21 W 8.15 4.51 0.00 3.59 3.14 0.00 0.00 0.00 0.00 0.00 0.00 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 8.40 4.21 0.00 3.29 3.42 0.00 5.63 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 D 8.78 4.37 0.00 2.71 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 24 R 7.98 3.97 0.00 1.83 1.97 0.00 3.38 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.89 0.00 25 L 8.30 3.95 0.00 1.85 1.66 0.75 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 26 M 7.67 4.15 0.00 1.95 2.39 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.69 0.00 27 E 8.01 4.09 0.00 2.25 2.04 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 2.31 2.40 0.00 28 I 7.80 3.74 2.00 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 1.44 0.73 0.89 0.00 0.00 29 A 8.37 4.11 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 30 K 7.79 3.89 0.00 1.88 1.86 0.00 1.70 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.70 1.82 7.81 31 E 8.13 3.93 0.00 1.95 2.13 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 2.29 2.40 0.00 32 K 8.34 4.15 0.00 1.86 1.83 0.00 1.78 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.41 1.46 7.81 33 N 7.75 4.16 0.00 2.80 2.84 0.00 0.00 6.92 9.02 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 34 L 8.24 4.88 0.00 1.56 1.49 0.90 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 35 T 8.61 4.62 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 1.20 0.00 0.00 36 L 8.31 3.99 0.00 1.85 1.92 0.73 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 37 S 8.07 4.12 0.00 3.87 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 38 D 7.70 4.31 0.00 2.84 2.70 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 39 V 7.68 3.62 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.98 0.00 0.00 40 C 8.26 3.99 0.00 3.15 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 41 R 7.69 4.03 0.00 1.87 2.19 0.00 3.30 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.83 0.00 42 L 8.49 4.02 0.00 1.79 1.69 0.90 1.01 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 43 A 8.28 4.12 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 44 I 7.61 3.71 2.03 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.75 0.93 0.00 0.00 45 K 8.07 4.08 0.00 1.88 1.97 0.00 1.62 0.00 0.00 1.76 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.51 1.57 7.81 46 E 8.05 3.94 0.00 2.15 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 0.00 2.31 2.38 0.00 47 Y 8.43 4.06 0.00 3.20 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 48 L 8.58 4.10 0.00 1.87 1.73 0.96 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 49 D 7.67 4.29 0.00 2.77 2.82 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 50 N 8.02 4.45 0.00 2.64 2.72 0.00 0.00 7.33 8.57 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 51 H 7.49 4.39 0.00 2.98 3.22 0.00 5.61 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 D 8.46 4.95 0.00 2.68 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.48 4.54 0.00 1.75 1.76 0.00 1.94 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.32 1.35 7.81 54 Q 8.53 4.14 0.00 2.23 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.60 6.84 0.00 0.00 0.00 0.00 0.00 2.37 2.42 0.00 55 K 8.02 3.86 0.00 1.90 1.89 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.50 1.60 7.81 56 K 8.16 4.18 0.00 1.75 1.72 0.00 1.78 0.00 0.00 1.75 0.00 0.00 3.04 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.40 1.59 7.81