NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.0104 8.3549 109.7384 46.1383 0.0000 173.8607 2 D 4.5261 8.4989 116.6825 53.3733 46.2660 173.7232 3 D 4.8664 7.9495 118.7286 52.9512 40.6610 176.3288 4 V 3.9399 7.6506 119.0206 62.1303 32.1959 175.6669 5 K 4.5030 8.3289 121.4127 56.6398 32.6021 178.3358 6 S 4.1120 8.1714 117.0021 61.2897 62.8993 174.7911 7 A 3.9979 6.6017 119.0527 50.6638 21.6396 175.6838 8 C 5.2281 8.0506 116.8821 55.5571 43.7847 174.6148 9 C 4.8177 8.9170 120.5164 56.2918 46.3929 173.6826 10 D 4.4701 8.8868 126.0003 55.2986 41.4281 177.0606 11 T 4.4423 7.2439 115.8120 63.1825 71.1590 173.7776 12 C 5.0273 8.6034 123.7917 56.6087 38.2047 173.6358 13 L 4.3119 8.7495 122.9589 54.8175 44.3364 173.3004 14 C 5.0336 8.6793 124.7374 55.8909 41.5154 174.1026 15 T 4.2930 8.6769 114.3106 61.3053 69.7934 175.1599 16 R 4.0873 8.4515 122.7532 56.5537 29.5121 175.6217 17 S 4.4216 8.0234 116.3301 58.6167 65.1586 175.4977 18 Q 4.2945 8.3736 122.7804 54.3184 30.1426 172.1022 19 P 4.4415 0.0000 0.0000 61.6926 32.0130 174.1009 20 P 4.6265 0.0000 0.0000 63.1911 32.5649 175.2877 21 T 4.6724 8.0626 112.7741 62.9517 73.2644 172.4845 22 C 5.3793 8.7431 124.4470 55.6422 49.2952 172.5210 23 R 4.7244 8.1506 117.8779 55.8749 35.0064 173.7341 24 C 5.0036 8.9389 120.1412 55.7948 39.8751 174.1687 25 V 3.3668 8.4887 118.7447 64.0368 31.4092 176.1433 26 D 4.5320 7.7758 118.9198 54.1162 40.7058 176.5104 27 V 4.2714 8.2554 119.3957 61.0305 33.2161 175.6362 28 R 4.4815 8.4021 120.7894 54.1933 34.2366 175.5002 29 E 3.8944 9.1800 118.4712 60.3172 29.8397 177.7147 30 S 4.1844 7.7408 114.7985 58.3672 63.7076 174.2533 31 C 4.7807 8.5719 125.1567 55.0202 43.4630 172.8891 32 H 4.7535 8.4228 123.7601 54.8528 29.8528 175.4851 33 S 4.5449 8.4626 114.1659 58.5936 62.4767 174.8237 34 A 4.1740 7.5816 123.2216 55.4809 18.2747 176.0813 35 C 4.8026 7.8813 108.9480 54.4136 43.2238 173.3391 36 D 4.2046 8.9701 122.4335 56.1739 41.1873 175.6251 37 K 4.4262 7.8800 120.9587 54.7096 33.6726 175.1914 38 C 5.0757 8.6326 124.9322 56.1308 40.7134 173.3685 39 V 4.5238 8.4551 123.8754 61.3779 34.5627 173.7647 40 C 5.3508 8.3747 121.0799 55.2410 42.0669 173.8055 41 A 4.1133 8.6980 126.4957 51.5640 19.1489 177.1422 42 Y 4.2960 7.5824 120.4270 57.2888 38.6309 176.7185 43 S 4.2373 7.3155 118.2587 59.6909 63.3021 173.4123 44 N 4.7014 8.2586 120.5825 52.1394 39.8501 172.8685 45 P 4.4606 0.0000 0.0000 61.7081 32.1475 174.4455 46 P 4.5923 0.0000 0.0000 63.0910 32.5875 175.2287 47 Q 4.9083 8.3165 118.1675 54.7183 33.1179 175.3904 48 C 5.2975 8.4380 117.0583 56.2061 42.5410 172.9652 49 Q 4.9773 9.1971 122.7276 54.3658 31.8891 174.7294 50 C 4.9924 8.9077 120.9182 56.2828 38.8290 172.5834 51 Y 4.1232 8.8893 121.3985 61.1544 38.0839 177.0323 52 D 4.7357 8.1978 117.3215 54.0648 42.0675 176.2593 53 T 4.2707 8.4529 114.8135 61.8738 70.0779 172.5139 54 H 4.9572 9.0174 121.5219 55.0196 33.5390 172.6588 55 K 4.7230 8.3193 118.2054 55.4481 32.4645 175.0535 56 F 4.6653 7.9478 118.3885 58.3343 42.6916 173.0135 57 C 4.9228 7.4026 122.4849 54.8932 46.2347 172.5054 58 Y 4.7691 8.4973 123.9047 56.0878 39.5520 175.6129 59 K 4.0962 8.8850 121.3433 56.9029 33.7250 175.5478 60 A 4.6244 8.4251 123.6237 51.8614 19.4298 177.9773 61 C 4.5772 8.6187 118.9898 55.0984 42.7856 173.8860 62 H 4.5943 8.6125 123.3698 55.1668 27.4301 175.0490 63 N 4.3859 8.2781 123.9778 53.9470 37.8961 174.8042 64 S 4.8357 8.1267 113.5238 55.3255 66.7001 173.8396 65 E 4.5809 8.4298 122.5611 56.2322 27.5056 175.2550 66 I 4.6637 7.3344 119.5840 61.8153 45.9680 173.8988 67 E 4.2321 7.9626 122.9282 56.6561 30.5301 174.9266 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 G 8.35 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 2 D 8.50 4.53 0.00 2.76 2.71 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 3 D 7.95 4.87 0.00 2.78 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 4 V 7.65 3.94 2.12 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 0.86 0.00 0.00 0.96 0.00 0.00 5 K 8.33 4.50 0.00 1.74 1.83 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.39 1.38 7.81 6 S 8.17 4.11 0.00 3.67 3.77 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 7 A 6.60 4.00 0.35 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 8 C 8.05 5.23 0.00 2.91 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 9 C 8.92 4.82 0.00 2.95 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 10 D 8.89 4.47 0.00 2.92 2.72 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 11 T 7.24 4.44 4.25 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 1.21 0.00 0.00 12 C 8.60 5.03 0.00 2.84 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 13 L 8.75 4.31 0.00 1.68 1.49 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 14 C 8.68 5.03 0.00 2.87 2.98 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.68 4.29 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 1.24 0.00 0.00 16 R 8.45 4.09 0.00 1.82 1.94 0.00 3.25 0.00 0.00 3.14 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.60 0.00 17 S 8.02 4.42 0.00 3.76 3.81 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 0.00 0.00 0.00 18 Q 8.37 4.29 0.00 2.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.07 6.81 0.00 0.00 0.00 0.00 0.00 2.24 2.28 0.00 19 P 0.00 4.44 0.00 2.22 2.05 0.00 3.82 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 20 P 0.00 4.63 0.00 2.20 2.12 0.00 3.80 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 21 T 8.06 4.67 4.25 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 1.23 0.00 0.00 22 C 8.74 5.38 0.00 2.99 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 23 R 8.15 4.72 0.00 1.72 1.75 0.00 3.16 0.00 0.00 3.15 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.51 0.00 24 C 8.94 5.00 0.00 2.90 3.10 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 25 V 8.49 3.37 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 0.65 0.00 0.00 0.97 0.00 0.00 26 D 7.78 4.53 0.00 2.79 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.26 4.27 2.31 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 0.92 0.00 0.00 0.96 0.00 0.00 28 R 8.40 4.48 0.00 1.86 1.78 0.00 3.32 0.00 0.00 3.18 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.74 0.00 29 E 9.18 3.89 0.00 1.94 1.94 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 2.32 2.36 0.00 30 S 7.74 4.18 0.00 3.74 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 31 C 8.57 4.78 0.00 2.89 2.93 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 32 H 8.42 4.75 0.00 3.22 3.15 0.00 5.86 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 S 8.46 4.54 0.00 3.83 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 34 A 7.58 4.17 1.23 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 0.00 0.00 0.00 35 C 7.88 4.80 0.00 3.18 3.18 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.97 4.20 0.00 2.72 2.83 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 37 K 7.88 4.43 0.00 1.93 1.76 0.00 1.63 0.00 0.00 1.81 0.00 0.00 2.81 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.38 1.41 7.81 38 C 8.63 5.08 0.00 2.89 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 39 V 8.46 4.52 1.69 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 0.72 0.00 0.00 0.09 0.00 0.00 40 C 8.37 5.35 0.00 2.85 2.99 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 0.00 41 A 8.70 4.11 1.10 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 42 Y 7.58 4.30 0.00 3.08 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 43 S 7.32 4.24 0.00 4.02 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 N 8.26 4.70 0.00 2.64 2.69 0.00 0.00 6.89 7.70 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 45 P 0.00 4.46 0.00 2.22 2.04 0.00 3.82 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 1.98 1.95 0.00 46 P 0.00 4.59 0.00 2.11 2.12 0.00 3.71 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 1.99 2.01 0.00 47 Q 8.32 4.91 0.00 1.92 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.83 0.00 0.00 0.00 0.00 0.00 2.30 2.26 0.00 48 C 8.44 5.30 0.00 3.10 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 49 Q 9.20 4.98 0.00 2.29 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 7.09 0.00 0.00 0.00 0.00 0.00 2.32 2.40 0.00 50 C 8.91 4.99 0.00 2.92 3.30 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 51 Y 8.89 4.12 0.00 2.94 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 52 D 8.20 4.74 0.00 2.79 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 53 T 8.45 4.27 4.28 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 1.23 0.00 0.00 54 H 9.02 4.96 0.00 3.18 3.23 0.00 5.52 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 K 8.32 4.72 0.00 1.90 1.84 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.75 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.30 1.47 7.81 56 F 7.95 4.67 0.00 2.97 2.91 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 0.00 0.00 0.00 0.00 57 C 7.40 4.92 0.00 2.77 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.50 4.77 0.00 2.94 3.03 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 59 K 8.89 4.10 0.00 1.81 1.78 0.00 1.67 0.00 0.00 1.89 0.00 0.00 2.96 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.56 1.56 7.81 60 A 8.43 4.62 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 61 C 8.62 4.58 0.00 2.90 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 62 H 8.61 4.59 0.00 3.17 3.39 0.00 5.71 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 N 8.28 4.39 0.00 2.82 2.85 0.00 0.00 6.19 7.66 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 64 S 8.13 4.84 0.00 3.88 3.77 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 65 E 8.43 4.58 0.00 1.93 1.94 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 2.32 2.37 0.00 66 I 7.33 4.66 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.53 0.94 0.00 0.00 67 E 7.96 4.23 0.00 1.91 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 2.24 2.24 0.00