NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9286 8.3393 109.7366 44.6885 0.0000 173.1330 2 S 3.8720 8.2466 113.7247 58.1109 62.9958 172.9280 3 S 4.4560 8.4610 115.9621 57.9216 66.4719 174.8368 4 G 4.2973 8.2094 121.4569 45.3388 0.0000 174.7823 5 S 4.6535 8.3826 122.6985 56.8165 66.7018 172.5352 6 S 4.6004 8.1884 117.8108 57.4163 64.7870 174.2876 7 G 4.5407 7.3012 108.8855 46.5073 0.0000 171.9486 8 V 4.3103 7.2356 116.7722 60.1844 35.3807 173.8221 9 C 4.2460 7.6650 121.2177 59.4024 31.6620 173.9260 10 T 4.3878 7.6707 116.6980 63.3331 69.8343 175.4554 11 I 4.1956 7.7096 121.3520 62.6622 38.1706 176.2458 12 C 4.5376 7.8281 111.0006 56.9831 31.4127 173.0917 13 Q 3.8752 7.9176 117.3326 56.7481 25.0711 173.3504 14 E 4.7459 7.5009 116.1434 54.6179 32.9895 177.7140 15 E 4.0483 8.8556 122.9658 58.5571 30.1206 177.1488 16 Y 4.2324 8.0647 116.6185 57.4643 38.0163 175.9325 17 S 4.4652 8.5053 117.7015 56.4066 65.4866 173.3551 18 E 4.3017 8.8798 124.7873 55.0697 30.4137 174.2255 19 A 4.3079 8.6435 129.9751 51.6851 18.8056 175.5219 20 P 4.4473 0.0000 0.0000 64.1933 31.5980 175.9147 21 N 4.7100 7.6988 117.7666 53.8568 39.2489 174.1123 22 E 4.2812 8.1367 116.4597 56.6437 31.3534 175.9354 23 M 4.9332 8.3607 119.9701 53.8701 34.9053 174.8926 24 V 4.2227 8.0135 123.8407 61.0299 34.7655 174.0797 25 I 5.0126 8.2641 128.1586 60.1471 38.8633 174.9411 26 C 4.8038 9.5045 127.9589 59.3186 32.1114 174.1510 27 D 4.3240 8.7114 125.9034 57.1238 40.4673 176.8539 28 K 4.0995 7.2820 119.8350 58.7509 32.7482 177.5636 29 C 4.1559 7.7593 118.8441 62.9153 28.6428 175.0457 30 G 4.5299 8.3457 105.5377 45.4311 0.0000 173.8700 31 Q 4.3162 8.3472 119.0779 55.7842 30.4087 175.1745 32 G 4.4269 8.2766 107.2691 45.3400 0.0000 172.6178 33 Y 4.7275 8.7396 119.0890 56.4715 42.3490 174.7626 34 H 4.8022 8.7656 121.7421 55.7227 29.4284 176.9331 35 Q 4.2165 9.1022 120.6134 58.7692 28.7500 178.7540 36 L 3.8897 7.9642 116.3792 56.2266 42.2974 177.8414 37 C 4.3561 7.9612 115.6405 62.1779 29.0957 173.6185 38 H 4.2321 8.7875 119.6915 56.9369 29.8728 173.9357 39 T 4.8495 8.0947 122.5521 60.8276 70.7821 172.3331 40 P 4.4711 0.0000 0.0000 62.1818 32.2695 175.5544 41 H 5.0306 8.2974 115.9672 55.7223 28.7451 175.9491 42 I 3.9864 7.9434 124.3002 61.7274 37.7330 175.1890 43 D 4.8898 8.5462 123.9233 53.1615 43.1142 177.5654 44 S 4.0397 8.7931 118.5270 61.7363 63.3036 176.6154 45 S 4.0767 8.2246 118.6710 61.4230 62.3660 176.8792 46 V 3.6486 7.1127 118.8634 66.1613 31.3502 177.9235 47 I 3.7818 7.6128 117.5084 64.4968 37.1966 177.3658 48 D 4.5387 8.1493 118.2786 56.7542 41.3792 177.4168 49 S 4.4206 7.2182 111.7555 58.0731 63.0268 172.4821 50 D 4.8633 8.3339 120.9243 53.4766 39.7072 176.5933 51 E 4.4052 7.9574 118.6406 56.2483 30.6521 176.3297 52 K 4.4305 8.3308 120.1903 56.5807 34.0789 175.9544 53 W 4.9039 8.8580 131.5945 55.5886 34.0989 173.6721 54 L 4.4921 7.1041 125.2168 52.1603 44.3013 176.1864 55 C 3.3728 7.4500 117.4046 57.4955 30.4771 174.5858 56 R 3.7742 8.6533 118.8333 59.8122 29.2718 177.9250 57 Q 3.9055 7.9651 115.9345 59.4756 29.0523 179.2996 58 C 4.2073 7.7726 116.6264 62.8940 28.3745 175.6456 59 V 3.4045 8.0746 120.0270 66.2104 30.7983 177.5920 60 F 3.8121 8.6090 119.7047 60.9562 39.5643 175.4966 61 A 4.4803 7.7578 119.8851 52.8651 18.6874 177.8989 62 T 4.1565 7.7190 116.5998 64.1214 68.4256 174.2280 63 T 4.3819 7.5217 116.0996 61.7953 70.2390 172.4503 64 T 4.5321 8.2488 120.3158 59.9707 69.8510 174.5694 65 K 4.3520 8.3515 130.1620 54.6158 30.9427 176.2491 66 R 4.2340 7.9095 121.1245 55.7151 30.4850 175.9317 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 8.34 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 2 S 8.25 3.87 0.00 4.06 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 3 S 8.46 4.46 0.00 3.93 3.75 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 4 G 8.21 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 0.00 0.00 0.00 0.00 5 S 8.38 4.65 0.00 3.81 3.75 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 6 S 8.19 4.60 0.00 3.84 3.79 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.30 4.54 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 0.00 8 V 7.24 4.31 2.18 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 0.83 0.00 0.00 0.94 0.00 0.00 9 C 7.66 4.25 0.00 2.86 2.81 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 10 T 7.67 4.39 3.65 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 1.18 0.00 0.00 11 I 7.71 4.20 1.88 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.49 0.95 0.00 0.00 12 C 7.83 4.54 0.00 3.09 3.05 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.92 3.88 0.00 2.21 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.66 0.00 0.00 0.00 0.00 0.00 2.22 2.24 0.00 14 E 7.50 4.75 0.00 1.83 1.71 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 2.50 2.46 0.00 15 E 8.86 4.05 0.00 1.97 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.27 0.00 16 Y 8.06 4.23 0.00 3.00 3.04 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 0.00 0.00 0.00 17 S 8.51 4.47 0.00 3.92 3.80 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 0.00 0.00 0.00 0.00 18 E 8.88 4.30 0.00 1.95 1.95 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 2.20 2.36 0.00 19 A 8.64 4.31 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 20 P 0.00 4.45 0.00 2.18 2.18 0.00 3.76 0.00 0.00 3.58 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 21 N 7.70 4.71 0.00 2.70 3.00 0.00 0.00 7.20 7.69 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 22 E 8.14 4.28 0.00 2.14 1.82 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 2.38 2.43 0.00 23 M 8.36 4.93 0.00 1.89 1.79 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.33 0.00 24 V 8.01 4.22 0.81 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 0.03 0.00 0.00 0.46 0.00 0.00 25 I 8.26 5.01 1.95 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 1.22 0.99 1.07 0.00 0.00 26 C 9.50 4.80 0.00 3.24 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 27 D 8.71 4.32 0.00 2.76 2.67 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.28 4.10 0.00 1.70 1.64 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.40 1.44 7.81 29 C 7.76 4.16 0.00 3.13 3.05 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.35 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.35 4.32 0.00 2.26 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.76 0.00 0.00 0.00 0.00 0.00 2.52 2.38 0.00 32 G 8.28 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.74 4.73 0.00 2.80 2.95 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 34 H 8.77 4.80 0.00 3.08 3.39 0.00 5.64 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 Q 9.10 4.22 0.00 2.19 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.77 0.00 0.00 0.00 0.00 0.00 2.28 2.46 0.00 36 L 7.96 3.89 0.00 1.81 1.71 0.94 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 37 C 7.96 4.36 0.00 3.19 3.06 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 0.00 0.00 0.00 0.00 38 H 8.79 4.23 0.00 3.34 3.30 0.00 5.52 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 T 8.09 4.85 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 40 P 0.00 4.47 0.00 2.21 2.07 0.00 3.86 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.03 0.00 41 H 8.30 5.03 0.00 3.10 3.45 0.00 5.78 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 7.94 3.99 1.74 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.47 0.72 0.00 0.00 43 D 8.55 4.89 0.00 2.84 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.79 4.04 0.00 4.08 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 45 S 8.22 4.08 0.00 4.03 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 46 V 7.11 3.65 2.24 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 1.08 0.00 0.00 1.06 0.00 0.00 47 I 7.61 3.78 1.93 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.53 0.92 0.00 0.00 48 D 8.15 4.54 0.00 2.61 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 49 S 7.22 4.42 0.00 4.02 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 50 D 8.33 4.86 0.00 2.81 2.74 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.96 4.41 0.00 2.02 1.96 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 2.31 2.31 0.00 52 K 8.33 4.43 0.00 1.90 1.84 0.00 1.39 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.41 1.51 7.81 53 W 8.86 4.90 0.00 3.39 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 54 L 7.10 4.49 0.00 1.08 1.10 0.79 0.80 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 55 C 7.45 3.37 0.00 2.55 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 8.65 3.77 0.00 1.85 1.87 0.00 3.24 0.00 0.00 3.47 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.78 0.00 57 Q 7.97 3.91 0.00 1.99 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.79 0.00 0.00 0.00 0.00 0.00 2.32 2.42 0.00 58 C 7.77 4.21 0.00 2.89 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 59 V 8.07 3.40 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 0.88 0.00 0.00 0.66 0.00 0.00 60 F 8.61 3.81 0.00 3.07 3.06 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 0.00 0.00 0.00 0.00 61 A 7.76 4.48 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.72 4.16 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 1.10 0.00 0.00 63 T 7.52 4.38 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 1.14 0.00 0.00 64 T 8.25 4.53 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 65 K 8.35 4.35 0.00 1.72 1.70 0.00 1.76 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.33 1.42 7.81 66 R 7.91 4.23 0.00 1.79 1.77 0.00 3.29 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.57 0.00