NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.3135 8.1631 117.3743 63.2154 69.9024 173.4833 2 G 3.5674 8.4730 115.3510 44.7755 0.0000 172.1469 3 A 4.2826 8.6449 124.3160 53.5379 21.3019 176.4404 4 G 4.3422 7.5155 109.0403 45.0236 0.0000 175.7270 5 T 3.8757 9.1612 122.5942 66.0231 67.7324 173.2884 6 P 4.3964 0.0000 0.0000 65.1653 31.3427 177.6307 7 S 4.3082 7.6419 112.6693 59.4232 63.4351 175.3267 8 Q 4.3347 8.0116 121.1759 57.5526 28.4978 177.9939 9 G 3.6894 7.4840 108.0413 47.7651 0.0000 174.4921 10 K 4.2965 7.8691 117.1344 56.8493 32.6230 178.0531 11 K 4.3773 7.5574 120.2092 55.3281 30.0553 176.0230 12 N 5.0409 7.9717 115.9128 52.3827 38.4287 175.0307 13 T 4.3826 7.9146 114.8521 63.2379 69.8068 174.2299 14 T 4.4293 8.3592 122.8104 62.4907 69.1693 172.6675 15 T 4.3075 7.5576 115.0990 63.0889 71.3709 172.8684 16 H 4.9377 8.0453 121.5168 55.0156 29.8120 174.4838 17 T 4.8077 9.2098 113.4798 58.9051 72.8363 173.1241 18 K 4.3773 8.6798 123.2671 57.1149 32.6451 175.6480 19 C 4.2305 9.1628 128.9441 58.8829 32.2270 174.5976 20 R 3.7270 8.2962 125.8594 59.0395 30.1878 177.6167 21 R 3.7413 7.2706 117.0185 58.1788 30.3037 176.4910 22 C 4.3647 7.9768 109.5816 57.6024 31.0419 174.6757 23 G 3.9132 7.9706 107.6957 44.8562 0.0000 173.1244 24 E 4.3336 7.6773 119.0469 54.7689 31.3245 176.3613 25 K 4.4194 8.1204 124.5385 56.0387 29.7779 176.6111 26 S 4.7974 7.8242 113.7861 58.0761 66.6847 174.5018 27 Y 4.6175 8.7662 123.8920 56.9899 39.4753 174.2744 28 H 4.5247 8.7312 128.8835 56.0651 30.1623 175.5626 29 T 3.9592 8.8775 121.7027 63.6632 66.8745 174.7530 30 K 4.3715 8.0258 118.8266 58.4523 33.6677 177.5978 31 K 4.0133 7.9294 116.2879 56.5865 32.3408 176.8882 32 K 3.3409 8.4063 117.8041 57.0445 30.2265 175.0150 33 V 4.5838 6.9074 116.2241 61.0642 34.6590 173.3777 34 C 5.1392 9.3876 127.6891 58.6001 32.2443 174.4908 35 S 4.3640 8.9677 121.8511 60.2556 63.3498 175.3565 36 S 4.4438 8.2548 115.3735 60.3103 62.7201 174.3208 37 C 4.4315 8.1170 112.6545 57.4803 30.4779 174.8548 38 G 3.9847 8.2533 109.5706 45.7866 0.0000 173.0878 39 F 4.5859 8.0995 122.4886 59.4780 39.8184 175.4120 40 G 4.0509 8.6474 115.1867 46.1540 0.0000 173.8414 41 K 4.3140 7.8942 118.4348 57.3465 33.3691 176.0260 42 S 4.7874 8.0873 111.0591 56.0652 65.9328 173.9140 43 A 4.1874 8.6099 124.7103 54.9887 18.5533 178.8460 44 K 4.2428 7.7420 113.9544 55.9546 32.9210 176.9447 45 R 4.2562 8.2896 121.9529 55.8941 30.7916 176.4424 46 R 3.8176 8.5992 125.5247 56.6461 30.4186 175.2132 47 D 4.6490 7.6651 124.5337 53.3770 44.4531 173.8000 48 Y 4.5352 8.7066 121.0471 56.0936 42.2492 176.4350 49 E 4.0603 8.6274 121.8642 58.5736 29.8486 178.6321 50 W 4.6679 7.6532 113.9429 57.5858 28.6046 176.9351 51 Q 4.3586 7.5632 117.9698 57.5183 28.3121 175.6412 52 S 4.7682 7.4708 110.2379 55.9750 66.5398 173.9583 53 K 4.1070 8.5518 120.1447 56.1557 32.4925 178.0128 54 A 4.0072 8.8424 126.2800 55.2969 18.2181 178.8818 55 G 4.1743 7.8315 102.2905 44.9360 0.0000 173.2034 56 E 4.1925 8.1541 126.6166 56.2561 29.8774 174.3630 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 T 8.16 4.31 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 2 G 8.47 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.64 4.28 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.52 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 9.16 3.88 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 6 P 0.00 4.40 0.00 2.26 2.30 0.00 3.61 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.05 0.00 7 S 7.64 4.31 0.00 4.14 3.94 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 8 Q 8.01 4.33 0.00 2.17 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.58 2.51 0.00 9 G 7.48 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 10 K 7.87 4.30 0.00 1.76 1.86 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.45 7.81 11 K 7.56 4.38 0.00 1.87 1.78 0.00 1.65 0.00 0.00 1.76 0.00 0.00 3.06 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.45 7.81 12 N 7.97 5.04 0.00 2.77 2.83 0.00 0.00 6.32 7.71 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 13 T 7.91 4.38 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 1.20 0.00 0.00 14 T 8.36 4.43 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 1.22 0.00 0.00 15 T 7.56 4.31 3.62 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 1.13 0.00 0.00 16 H 8.05 4.94 0.00 3.08 3.53 0.00 5.64 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 T 9.21 4.81 4.33 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 1.33 0.00 0.00 18 K 8.68 4.38 0.00 1.79 1.80 0.00 1.79 0.00 0.00 1.64 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.50 7.81 19 C 9.16 4.23 0.00 3.16 2.78 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 20 R 8.30 3.73 0.00 1.55 1.48 0.00 3.24 0.00 0.00 3.13 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.51 0.00 21 R 7.27 3.74 0.00 0.67 1.43 0.00 3.21 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.25 0.00 22 C 7.98 4.36 0.00 3.07 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 23 G 7.97 3.91 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 0.00 0.00 0.00 24 E 7.68 4.33 0.00 1.94 1.90 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 2.38 2.26 0.00 25 K 8.12 4.42 0.00 1.80 1.78 0.00 1.74 0.00 0.00 1.73 0.00 0.00 3.09 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.57 1.51 7.81 26 S 7.82 4.80 0.00 3.87 3.88 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 27 Y 8.77 4.62 0.00 3.14 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 28 H 8.73 4.52 0.00 3.18 2.97 0.00 5.84 0.00 0.00 0.00 0.00 6.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 T 8.88 3.96 4.29 0.00 0.00 0.00 0.00 0.00 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 30 K 8.03 4.37 0.00 1.83 1.82 0.00 1.81 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.35 1.42 7.81 31 K 7.93 4.01 0.00 1.54 1.72 0.00 1.62 0.00 0.00 1.56 0.00 0.00 2.52 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.25 1.06 7.81 32 K 8.41 3.34 0.00 1.81 1.86 0.00 1.75 0.00 0.00 1.48 0.00 0.00 2.87 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.30 1.50 7.81 33 V 6.91 4.58 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 1.02 0.00 0.00 0.93 0.00 0.00 34 C 9.39 5.14 0.00 3.39 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 35 S 8.97 4.36 0.00 4.10 4.11 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 36 S 8.25 4.44 0.00 3.91 3.98 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 37 C 8.12 4.43 0.00 3.15 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 38 G 8.25 3.98 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 0.00 0.00 0.00 39 F 8.10 4.59 0.00 3.08 3.14 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 0.00 0.00 0.00 0.00 40 G 8.65 4.05 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 0.00 0.00 0.00 41 K 7.89 4.31 0.00 1.73 2.02 0.00 1.78 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.42 7.81 42 S 8.09 4.79 0.00 3.95 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 43 A 8.61 4.19 1.32 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 0.00 0.00 44 K 7.74 4.24 0.00 1.74 1.71 0.00 1.73 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.43 1.45 7.81 45 R 8.29 4.26 0.00 1.65 1.82 0.00 3.35 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.54 0.00 46 R 8.60 3.82 0.00 1.80 1.96 0.00 3.42 0.00 0.00 3.37 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.63 0.00 47 D 7.67 4.65 0.00 2.50 2.20 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.71 4.54 0.00 1.52 1.43 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 49 E 8.63 4.06 0.00 2.05 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 0.00 2.39 2.26 0.00 50 W 7.65 4.67 0.00 3.43 3.19 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 51 Q 7.56 4.36 0.00 2.02 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.74 0.00 0.00 0.00 0.00 0.00 2.16 1.59 0.00 52 S 7.47 4.77 0.00 3.99 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 53 K 8.55 4.11 0.00 1.83 1.80 0.00 1.75 0.00 0.00 1.86 0.00 0.00 2.95 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.56 1.41 7.81 54 A 8.84 4.01 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 55 G 7.83 4.17 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 0.00 0.00 0.00 56 E 8.15 4.19 0.00 1.92 1.86 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 2.23 2.26 0.00