NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 21 A 4.1043 8.2601 123.5807 52.1656 18.7751 176.3786 22 A 4.2913 8.3658 126.0303 49.6675 18.8653 171.9290 23 E 4.6928 8.4862 119.6615 55.3752 33.7115 173.7148 24 C 4.6426 8.5575 118.5326 55.3879 44.2844 172.8101 25 T 4.4815 8.1701 124.2144 61.6642 69.4556 174.9170 26 V 3.5895 8.3317 126.4374 62.2933 32.0871 174.0542 27 P 4.5273 0.0000 0.0000 61.6344 32.2426 175.4519 28 I 3.8013 8.2173 119.1719 63.5876 37.1262 176.7512 29 G 4.0118 9.2518 112.5282 45.2333 0.0000 172.7019 30 W 4.7095 8.0342 118.1847 54.6873 32.1115 175.0474 31 S 4.9110 8.2970 115.2994 56.3763 65.4843 174.3205 32 E 4.0595 8.4949 122.0979 55.3794 29.8865 175.5366 33 P 4.0266 0.0000 0.0000 62.6474 31.8188 176.1169 34 V 4.0012 7.9850 120.0971 61.1592 31.6812 175.7624 35 K 3.5146 8.4948 129.2563 56.0674 32.6249 176.6965 36 G 3.9281 8.6116 115.0922 45.2414 0.0000 172.9409 37 L 4.5899 8.0779 117.2450 54.5427 42.2198 176.2386 38 C 4.6819 7.9705 112.3900 54.8261 43.0398 172.5746 39 K 4.3841 8.3886 117.8573 56.4984 32.0229 176.4742 40 A 4.5236 7.6652 120.5031 50.0673 21.4476 176.5374 41 R 4.5477 7.8832 119.9909 54.5908 32.1625 174.9199 42 F 5.1744 9.2010 125.1284 56.0922 42.8074 174.5555 43 T 5.0770 8.6633 117.3084 62.1596 70.0390 174.1499 44 R 4.8514 8.9055 125.3111 54.3966 34.5472 174.3324 45 Y 5.0475 8.8857 119.3036 56.6270 41.0613 174.1310 46 Y 5.0569 9.2958 122.8185 56.1910 41.0100 174.5352 47 C 4.7894 9.2479 124.2696 56.1861 42.3474 174.1727 48 M 3.8147 9.0059 132.1411 53.7374 29.9656 175.9024 49 G 3.2590 6.6984 114.4582 45.0414 0.0000 172.4040 50 N 5.0722 7.3121 113.4337 51.3072 39.0733 172.4733 51 C 4.8917 7.6106 112.4025 54.9872 45.4463 171.9778 52 C 5.4019 8.6812 117.9449 55.9071 40.3461 172.9833 53 K 4.8360 9.2446 124.6826 54.5099 35.0020 174.8792 54 V 4.6791 8.2684 126.4289 60.5372 33.3049 174.7875 55 Y 4.5638 8.8658 120.8078 56.0502 42.0424 173.7898 56 E 5.1282 10.1620 123.5137 53.8255 32.6020 176.5059 57 G 3.7784 8.0202 113.1233 45.4564 0.0000 171.2960 58 C 4.7999 8.0298 116.5475 55.5561 41.9849 172.3728 59 Y 5.2046 8.0412 118.7113 56.1004 40.5152 175.0233 60 T 4.4731 8.2885 116.7116 60.8996 70.8857 173.4340 61 G 3.8715 8.5513 110.8042 45.1160 0.0000 174.3731 62 G 3.2062 8.1657 105.5733 45.8927 0.0000 172.3814 63 Y 4.7599 8.2706 117.7960 56.0851 40.9724 176.7796 64 S 4.4713 8.4185 115.1934 60.0055 64.1710 175.2184 65 R 4.4297 7.7313 119.3581 53.3253 34.9350 175.3911 66 M 3.3949 7.4452 120.9973 58.5685 32.2161 178.9195 67 G 3.4865 7.7246 105.2036 47.7828 0.0000 175.2974 68 E 3.7726 7.7953 119.4724 59.1539 29.8176 179.4942 69 C 3.5315 7.6862 117.8097 59.3637 43.4968 175.4236 70 A 3.8052 7.8175 121.4740 55.1034 18.0418 179.1949 71 R 4.1502 7.6314 114.0553 57.4682 30.2169 176.8651 72 N 5.0269 7.7243 115.4071 52.5077 39.9742 173.0863 73 C 4.8775 7.9488 117.3304 53.8718 46.4797 171.8022 74 P 4.3020 0.0000 0.0000 63.2934 31.5452 176.3959 75 G 3.7203 8.5440 109.5264 45.7500 0.0000 173.4989 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 21 A 8.26 4.10 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 22 A 8.37 4.29 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 23 E 8.49 4.69 0.00 2.00 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 2.13 2.23 0.00 24 C 8.56 4.64 0.00 2.92 3.01 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 0.00 25 T 8.17 4.48 4.21 0.00 0.00 0.00 0.00 0.00 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 26 V 8.33 3.59 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 0.94 0.00 0.00 1.12 0.00 0.00 27 P 0.00 4.53 0.00 2.19 2.03 0.00 3.56 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 0.89 1.58 0.00 28 I 8.22 3.80 1.94 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.57 0.97 0.00 0.00 29 G 9.25 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 0.00 0.00 0.00 0.00 30 W 8.03 4.71 0.00 3.41 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 31 S 8.30 4.91 0.00 3.78 3.71 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.49 4.06 0.00 1.92 1.81 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 2.35 2.29 0.00 33 P 0.00 4.03 0.00 1.86 0.90 0.00 2.84 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.44 0.00 34 V 7.98 4.00 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 0.77 0.00 0.00 0.90 0.00 0.00 35 K 8.49 3.51 0.00 1.50 1.50 0.00 1.52 0.00 0.00 1.38 0.00 0.00 2.97 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.03 0.21 7.81 36 G 8.61 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 L 8.08 4.59 0.00 1.62 1.66 0.90 0.87 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 38 C 7.97 4.68 0.00 3.10 3.11 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.39 4.38 0.00 1.73 1.82 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.36 1.40 7.81 40 A 7.67 4.52 0.77 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 0.00 0.00 41 R 7.88 4.55 0.00 1.68 1.68 0.00 3.17 0.00 0.00 3.24 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.70 0.00 42 F 9.20 5.17 0.00 3.10 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 43 T 8.66 5.08 4.31 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 0.94 0.00 0.00 44 R 8.91 4.85 0.00 1.60 1.37 0.00 3.25 0.00 0.00 3.15 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.89 0.00 45 Y 8.89 5.05 0.00 2.89 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 46 Y 9.30 5.06 0.00 2.98 2.97 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 47 C 9.25 4.79 0.00 3.13 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 48 M 9.01 3.81 0.00 1.88 2.01 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.92 0.00 49 G 6.70 3.26 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 50 N 7.31 5.07 0.00 2.69 2.74 0.00 0.00 5.80 7.68 0.00 0.00 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 C 7.61 4.89 0.00 2.92 3.12 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.68 5.40 0.00 2.92 3.17 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 0.00 53 K 9.24 4.84 0.00 1.85 1.82 0.00 1.74 0.00 0.00 1.85 0.00 0.00 2.87 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.01 1.23 7.81 54 V 8.27 4.68 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 0.66 0.00 0.00 0.34 0.00 0.00 55 Y 8.87 4.56 0.00 2.44 1.89 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 56 E 10.16 5.13 0.00 1.96 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 0.00 2.23 2.32 0.00 57 G 8.02 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 58 C 8.03 4.80 0.00 3.17 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 59 Y 8.04 5.20 0.00 3.19 2.97 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 60 T 8.29 4.47 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 1.24 0.00 0.00 61 G 8.55 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 62 G 8.17 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 Y 8.27 4.76 0.00 3.07 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 64 S 8.42 4.47 0.00 4.10 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 R 7.73 4.43 0.00 1.69 1.61 0.00 3.09 0.00 0.00 3.26 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 66 M 7.45 3.39 0.00 1.82 1.54 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.59 0.00 67 G 7.72 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 E 7.80 3.77 0.00 1.97 1.85 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 2.29 2.30 0.00 69 C 7.69 3.53 0.00 3.02 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 A 7.82 3.81 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 71 R 7.63 4.15 0.00 1.81 1.91 0.00 3.11 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 72 N 7.72 5.03 0.00 2.36 2.78 0.00 0.00 6.61 7.23 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 73 C 7.95 4.88 0.00 2.99 2.86 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 74 P 0.00 4.30 0.00 2.05 1.99 0.00 3.82 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.12 0.00 75 G 8.54 3.72 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 0.00 0.00 0.00