NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 L 4.4949 8.0427 122.7558 54.9971 44.0685 174.7166 2 E 4.8537 9.4051 127.8652 54.3600 31.6923 172.5583 3 C 5.3135 9.7464 124.6545 55.1940 45.0712 172.9579 4 H 4.9526 9.3045 119.8736 55.8837 28.9845 175.3929 5 N 5.2358 8.9071 115.6098 51.4609 38.8883 174.6923 6 Q 4.2468 7.9137 116.6097 56.1838 29.8699 175.1917 7 Q 4.6040 8.4084 117.9163 56.1930 31.4703 178.0902 8 S 3.4143 8.1126 117.6179 59.8431 63.7017 173.1562 9 S 4.5883 8.7165 122.6174 58.9037 62.7867 174.0019 10 Q 4.1761 7.8607 120.0376 55.9706 28.9971 176.3232 11 T 3.8721 8.2896 116.2198 63.3510 68.8862 172.8132 12 P 4.5479 0.0000 0.0000 63.2521 32.1955 175.5626 13 T 4.9566 8.6777 110.9997 60.5055 72.6330 172.5038 14 T 5.2776 8.3493 111.5438 60.0039 72.4644 172.6650 15 K 4.7055 9.0252 120.4796 55.5350 36.6799 175.2924 16 T 4.7908 8.3155 118.0309 62.1604 69.2852 175.6197 17 C 4.5431 8.9845 125.0828 56.4888 41.0355 174.5053 18 S 4.6094 8.0329 114.9091 55.5678 61.9938 172.9488 19 G 3.9476 8.4064 113.0550 46.8373 0.0000 173.2930 20 E 4.1193 8.1659 118.5788 56.9315 29.9129 176.6299 21 T 4.6233 8.4367 110.4901 61.3190 69.5428 173.1917 22 N 5.4102 7.8010 117.9992 52.3707 43.5539 173.7794 23 C 5.6283 9.1974 117.8389 55.4764 38.9845 172.7007 24 Y 5.6440 8.7385 118.3433 55.4584 41.8546 174.0723 25 K 5.2067 9.5050 121.6924 54.8447 35.7677 174.9659 26 K 5.6204 9.7310 127.0027 55.1597 35.9726 175.1508 27 W 6.2949 9.3544 118.8543 55.8653 32.1905 173.3090 28 W 5.2976 8.2053 117.1958 56.3587 30.9364 172.6429 29 S 5.2550 8.9444 115.0545 57.0282 66.3307 173.7958 30 D 5.0858 8.5622 120.9140 52.0656 41.9491 175.6948 31 H 4.2905 9.0000 113.1797 58.3512 28.5016 175.9492 32 R 4.0639 8.7587 119.3917 56.4113 31.0739 175.7719 33 G 3.6898 7.1443 104.3606 44.8600 0.0000 172.0888 34 T 4.5841 8.1905 119.2246 63.3264 69.6463 174.4273 35 I 4.3062 8.4717 126.9463 59.4087 40.0244 174.7263 36 I 5.1701 8.2273 125.9598 59.5849 41.0623 174.1243 37 E 5.1400 9.5543 126.0592 54.7097 32.7155 175.3410 38 R 4.5765 8.3435 120.9282 54.4592 35.0243 175.4656 39 G 3.9529 6.6509 107.2414 46.2934 0.0000 171.5717 40 C 4.7860 8.8503 116.6116 57.0880 41.5582 174.2996 41 G 3.8243 10.2215 109.3586 45.1044 0.0000 173.1157 42 C 4.7964 7.9704 115.9308 54.4558 44.0903 172.2274 43 P 4.4267 0.0000 0.0000 61.3889 32.0187 176.8011 44 K 4.1148 8.2016 120.7182 56.1496 32.8264 176.4802 45 V 4.4058 7.7722 117.7299 58.7798 34.6461 175.3195 46 K 4.0192 8.0379 122.5136 55.3672 32.7107 174.7258 47 P 4.1150 0.0000 0.0000 64.4146 31.6561 176.8056 48 G 3.8855 8.9431 109.8835 44.8370 0.0000 173.2088 49 V 4.2668 6.7458 118.6120 61.3571 33.3352 174.9349 50 N 4.3983 8.3531 123.9834 52.2844 39.8647 174.0149 51 L 5.1403 7.8201 123.5966 53.4618 45.7538 174.5675 52 N 5.1447 9.7785 124.2647 52.0829 42.0860 172.0192 53 C 5.6425 9.1241 123.5692 55.4029 43.8544 172.0306 54 C 5.2176 9.2311 118.1470 53.4932 45.2410 174.4054 55 T 4.8479 8.4796 105.5930 61.2094 69.1717 173.4561 56 T 4.7104 7.4947 111.0145 59.5624 71.8771 172.7202 57 D 4.7145 8.7722 121.6417 56.6346 41.0692 176.9066 58 R 3.8437 8.9099 122.4326 57.2540 28.2840 175.0447 59 C 4.5318 8.1070 112.3645 56.9347 42.0918 173.5304 60 N 4.8885 7.8125 117.6222 52.5949 37.6193 174.2605 61 N 4.2578 8.1614 122.8314 54.8309 39.0365 174.2948 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 L 8.04 4.49 0.00 1.80 1.62 0.95 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 2 E 9.41 4.85 0.00 2.05 1.74 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 2.14 2.31 0.00 3 C 9.75 5.31 0.00 2.82 2.84 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 4 H 9.30 4.95 0.00 3.14 3.32 0.00 5.60 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 N 8.91 5.24 0.00 2.76 2.78 0.00 0.00 6.97 7.41 0.00 0.00 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 Q 7.91 4.25 0.00 2.16 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.61 6.87 0.00 0.00 0.00 0.00 0.00 2.27 2.57 0.00 7 Q 8.41 4.60 0.00 2.24 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.93 5.71 0.00 0.00 0.00 0.00 0.00 2.34 2.32 0.00 8 S 8.11 3.41 0.00 3.83 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 9 S 8.72 4.59 0.00 3.91 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 10 Q 7.86 4.18 0.00 2.09 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.32 6.79 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 11 T 8.29 3.87 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 12 P 0.00 4.55 0.00 2.04 1.94 0.00 3.61 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 1.98 2.01 0.00 13 T 8.68 4.96 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 1.27 0.00 0.00 14 T 8.35 5.28 4.22 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 0.98 0.00 0.00 15 K 9.03 4.71 0.00 1.76 1.88 0.00 1.29 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.38 7.81 16 T 8.32 4.79 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 1.21 0.00 0.00 17 C 8.98 4.54 0.00 2.86 3.32 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.03 4.61 0.00 3.89 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 19 G 8.41 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 20 E 8.17 4.12 0.00 1.99 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 2.45 2.40 0.00 21 T 8.44 4.62 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 1.27 0.00 0.00 22 N 7.80 5.41 0.00 2.74 2.83 0.00 0.00 6.82 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 23 C 9.20 5.63 0.00 2.87 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 24 Y 8.74 5.64 0.00 3.08 3.28 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 25 K 9.50 5.21 0.00 1.86 1.89 0.00 1.70 0.00 0.00 1.48 0.00 0.00 2.20 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.50 1.38 7.81 26 K 9.73 5.62 0.00 2.05 2.10 0.00 1.50 0.00 0.00 2.17 0.00 0.00 3.21 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.96 1.79 7.81 27 W 9.35 6.29 0.00 3.46 3.23 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 28 W 8.21 5.30 0.00 3.38 3.28 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 29 S 8.94 5.26 0.00 3.80 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 30 D 8.56 5.09 0.00 2.87 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 31 H 9.00 4.29 0.00 3.31 3.50 0.00 5.51 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 R 8.76 4.06 0.00 1.61 1.87 0.00 3.21 0.00 0.00 3.07 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.46 0.00 33 G 7.14 3.69 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 0.00 0.00 0.00 34 T 8.19 4.58 4.18 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 1.23 0.00 0.00 35 I 8.47 4.31 0.56 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.40 0.33 0.00 0.00 36 I 8.23 5.17 1.87 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.70 0.96 0.00 0.00 37 E 9.55 5.14 0.00 2.21 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 0.00 2.35 2.47 0.00 38 R 8.34 4.58 0.00 1.59 1.72 0.00 3.26 0.00 0.00 3.38 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.55 0.00 39 G 6.65 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 40 C 8.85 4.79 0.00 3.05 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 41 G 10.22 3.82 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 0.00 0.00 0.00 42 C 7.97 4.80 0.00 2.94 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 43 P 0.00 4.43 0.00 1.97 1.73 0.00 3.37 0.00 0.00 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.80 0.00 44 K 8.20 4.11 0.00 1.66 1.67 0.00 1.55 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.37 1.45 7.81 45 V 7.77 4.41 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 0.73 0.00 0.00 0.84 0.00 0.00 46 K 8.04 4.02 0.00 1.65 1.43 0.00 1.53 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.33 1.38 7.81 47 P 0.00 4.12 0.00 2.01 1.92 0.00 3.62 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 1.97 2.03 0.00 48 G 8.94 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 49 V 6.75 4.27 2.03 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 0.80 0.00 0.00 0.57 0.00 0.00 50 N 8.35 4.40 0.00 1.44 1.42 0.00 0.00 6.39 6.36 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 51 L 7.82 5.14 0.00 1.50 1.39 1.02 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 52 N 9.78 5.14 0.00 3.14 2.92 0.00 0.00 6.77 7.28 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 53 C 9.12 5.64 0.00 2.91 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 54 C 9.23 5.22 0.00 3.00 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 55 T 8.48 4.85 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 1.24 0.00 0.00 56 T 7.49 4.71 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 1.22 0.00 0.00 57 D 8.77 4.71 0.00 2.68 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 58 R 8.91 3.84 0.00 1.88 2.00 0.00 3.13 0.00 0.00 3.37 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.48 0.00 59 C 8.11 4.53 0.00 3.14 3.28 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 60 N 7.81 4.89 0.00 2.82 2.94 0.00 0.00 6.03 8.04 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 61 N 8.16 4.26 0.00 2.49 2.62 0.00 0.00 7.05 7.56 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