NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 R 4.2997 8.1127 121.1235 56.2719 31.9343 173.6932 5 E 4.7400 8.4711 124.2294 53.2041 31.8099 173.7934 6 C 4.3872 9.9245 127.7622 59.3661 32.5999 173.5731 7 D 4.4937 8.6616 127.0686 56.1301 40.2862 175.7534 8 Y 4.4500 7.6456 118.2214 58.8541 40.7708 176.3141 9 C 4.0490 8.1421 113.7294 58.6310 30.6922 175.2657 10 G 3.8919 8.3807 108.3210 44.9985 0.0000 173.5005 11 T 4.4912 7.5067 109.5529 60.6894 70.6468 173.4391 12 D 4.9452 8.4942 122.2638 54.2674 41.8035 176.3380 13 I 4.1145 8.8237 125.0313 60.1698 37.7024 175.7247 14 E 3.8780 9.0521 128.4611 55.7337 29.7980 174.9258 15 P 4.2930 0.0000 0.0000 64.2437 31.7591 175.9204 16 G 3.8289 9.6892 107.7333 46.6012 0.0000 172.8873 17 T 4.4594 7.7005 114.2025 62.8209 72.6933 174.0986 18 G 4.1027 8.7567 110.5138 45.6477 0.0000 172.5745 19 T 4.8373 8.6152 113.7669 61.8221 73.0952 173.0788 20 M 4.9861 8.7189 123.5412 53.8799 34.3920 174.4710 21 F 4.7070 9.4942 129.7876 57.0179 41.2502 174.6047 22 V 4.3105 7.6396 126.9033 61.4513 31.8134 175.2480 23 H 4.2107 8.7675 126.0862 55.2146 29.3654 176.8959 24 K 3.8942 8.6777 122.1896 59.6185 32.0098 177.1771 25 D 4.5822 8.0650 115.2821 53.3712 39.5027 177.0371 26 G 3.8587 8.0404 108.9222 45.1015 0.0000 173.9132 27 A 4.3253 8.4660 122.0443 52.3831 19.8894 176.5581 28 T 5.0110 8.3293 114.7308 62.1287 72.3420 173.9366 29 T 4.5775 8.9133 122.1750 62.0365 72.0203 172.8863 30 H 4.9805 9.8464 125.6695 55.1435 30.0352 174.5997 31 F 5.3823 9.5833 123.3872 55.9806 40.9256 176.7853 32 C 4.4202 9.0476 116.7617 59.4065 30.7835 173.6654 33 S 4.5980 7.5039 114.2411 56.5173 65.8849 176.4688 34 S 4.2024 8.2147 118.9867 60.7620 62.6932 176.0934 35 K 3.8010 8.0663 122.8411 59.6980 31.7732 178.2498 36 C 4.1703 7.6754 115.9816 62.7462 27.8043 175.8179 37 E 2.6030 7.5109 119.6096 59.2117 28.7462 179.2331 38 N 4.1707 8.3586 115.6029 56.4251 38.9416 176.9734 39 N 4.5123 8.1781 117.6385 56.1259 38.6724 177.3952 40 A 4.1428 7.6930 122.3239 55.2206 18.2134 179.4062 41 D 4.3212 7.8997 116.6182 56.8651 40.9442 178.1008 42 L 4.3003 7.4634 117.2471 55.0600 41.8180 177.7419 43 G 3.9521 7.8970 107.3020 45.5520 0.0000 173.8179 44 R 4.3059 7.7661 117.6174 55.3637 31.1833 175.5597 45 E 4.5568 8.4972 120.5111 54.3250 31.5602 176.7214 46 A 3.3538 8.2157 126.8486 55.3384 18.4219 179.7738 47 R 3.8052 7.6720 113.0324 59.1770 30.1773 177.3781 48 N 4.4445 8.2430 113.2406 53.6045 39.0658 174.8584 49 L 4.4411 7.3107 120.0253 52.6704 42.0936 176.6183 50 E 3.9009 8.9869 124.7667 59.2492 29.4670 179.3808 51 W 4.3979 7.9831 113.4892 58.8383 28.6621 176.5649 52 T 3.8420 7.0649 117.2113 63.0043 68.6993 175.1998 53 D 4.3404 8.7717 125.3291 57.9420 41.2932 178.7479 54 T 3.8254 7.9751 114.7590 66.8023 68.6014 175.4288 55 A 3.9792 7.6965 121.7721 55.2119 18.6846 177.4161 56 R 4.0772 8.0263 118.2666 56.6860 30.0354 176.8040 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 4 R 8.11 4.30 0.00 1.89 1.84 0.00 3.03 0.00 0.00 3.08 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.57 0.00 5 E 8.47 4.74 0.00 2.02 1.78 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 2.21 2.35 0.00 6 C 9.92 4.39 0.00 3.04 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 7 D 8.66 4.49 0.00 2.63 2.63 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 8 Y 7.65 4.45 0.00 2.97 3.07 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 9 C 8.14 4.05 0.00 3.16 3.40 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 10 G 8.38 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 11 T 7.51 4.49 4.30 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 1.37 0.00 0.00 12 D 8.49 4.95 0.00 2.61 2.66 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 0.00 0.00 0.00 0.00 13 I 8.82 4.11 1.90 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.60 0.96 0.00 0.00 14 E 9.05 3.88 0.00 1.92 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 2.32 2.41 0.00 15 P 0.00 4.29 0.00 2.23 2.05 0.00 3.89 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 16 G 9.69 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 17 T 7.70 4.46 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 18 G 8.76 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 19 T 8.62 4.84 4.37 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 1.30 0.00 0.00 20 M 8.72 4.99 0.00 1.97 1.85 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.40 0.00 21 F 9.49 4.71 0.00 3.35 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 22 V 7.64 4.31 1.83 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 0.73 0.00 0.00 0.83 0.00 0.00 23 H 8.77 4.21 0.00 3.49 3.27 0.00 5.68 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.68 3.89 0.00 1.75 1.88 0.00 1.79 0.00 0.00 1.78 0.00 0.00 3.03 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.43 1.44 7.81 25 D 8.07 4.58 0.00 2.83 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 26 G 8.04 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 A 8.47 4.33 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 0.00 0.00 0.00 0.00 0.00 28 T 8.33 5.01 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 1.15 0.00 0.00 29 T 8.91 4.58 4.30 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 0.50 0.00 0.00 30 H 9.85 4.98 0.00 3.16 3.26 0.00 5.78 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 F 9.58 5.38 0.00 3.14 2.89 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 32 C 9.05 4.42 0.00 3.16 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 33 S 7.50 4.60 0.00 4.01 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.21 4.20 0.00 3.98 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 35 K 8.07 3.80 0.00 1.75 1.83 0.00 1.38 0.00 0.00 1.36 0.00 0.00 2.13 0.00 0.00 2.50 0.00 0.00 0.00 0.00 1.47 1.41 7.81 36 C 7.68 4.17 0.00 3.45 3.08 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 0.00 0.00 0.00 0.00 37 E 7.51 2.60 0.00 1.76 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 1.47 1.55 0.00 38 N 8.36 4.17 0.00 2.72 2.80 0.00 0.00 7.16 5.83 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 39 N 8.18 4.51 0.00 2.99 3.08 0.00 0.00 6.89 7.37 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 40 A 7.69 4.14 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 41 D 7.90 4.32 0.00 2.68 2.65 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 42 L 7.46 4.30 0.00 1.85 1.73 0.94 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 43 G 7.90 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 44 R 7.77 4.31 0.00 2.14 1.98 0.00 3.28 0.00 0.00 3.36 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.71 0.00 45 E 8.50 4.56 0.00 1.97 1.78 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 2.33 2.29 0.00 46 A 8.22 3.35 0.54 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 0.00 0.00 47 R 7.67 3.81 0.00 1.72 1.91 0.00 3.13 0.00 0.00 3.16 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.55 0.00 48 N 8.24 4.44 0.00 2.72 2.82 0.00 0.00 6.90 7.45 0.00 0.00 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 L 7.31 4.44 0.00 1.28 0.98 1.06 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 50 E 8.99 3.90 0.00 2.01 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 2.32 2.33 0.00 51 W 7.98 4.40 0.00 3.55 3.24 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 0.00 52 T 7.06 3.84 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 53 D 8.77 4.34 0.00 2.93 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 54 T 7.98 3.83 4.01 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 0.00 0.00 1.07 0.00 0.00 55 A 7.70 3.98 1.24 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 0.00 0.00 0.00 56 R 8.03 4.08 0.00 1.77 1.86 0.00 3.23 0.00 0.00 3.29 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.82 0.00