NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0657 8.0431 114.0659 61.0011 33.0307 175.1928 2 G 3.3096 8.4381 109.2312 45.7576 0.0000 170.3571 3 E 4.9568 8.1605 116.9741 54.6163 32.6930 174.0926 4 C 4.5375 8.9779 119.6467 57.0998 40.8227 175.0964 5 V 3.7891 8.6657 122.0559 63.2409 29.6315 175.9111 6 R 3.6159 8.8895 122.4998 57.1843 27.8968 176.8888 7 G 3.9212 8.4897 98.0280 46.2367 0.0000 173.0837 8 R 4.6725 7.6727 116.0160 54.1886 33.8273 174.0314 9 C 5.2546 8.4542 117.8359 54.2485 41.5102 171.7877 10 P 4.4732 0.0000 0.0000 62.1666 32.2831 175.5340 11 S 3.7004 9.4102 110.0424 60.5366 60.7962 171.2848 12 G 4.0450 8.0701 102.2487 46.4673 0.0000 173.8832 13 M 4.2984 8.1658 117.4881 54.9771 33.3318 176.8790 14 C 4.5780 8.3559 119.9767 56.5636 42.0323 172.3503 15 C 5.0557 8.7544 121.6250 56.3218 40.6610 173.9367 16 S 4.5765 9.5855 119.5234 57.2592 63.0388 175.4520 17 Q 3.7336 7.9002 118.4888 58.7748 28.0229 177.4021 18 F 4.4646 7.4110 115.1615 56.9243 39.3646 176.3587 19 G 3.9467 8.3662 109.6967 46.1833 0.0000 173.4912 20 Y 4.9885 7.8763 118.5702 57.6215 40.7394 173.2734 21 C 5.0725 8.1421 117.8581 55.7251 44.7431 173.8929 22 G 3.3995 7.2882 111.7717 45.2109 0.0000 173.1696 23 K 4.5436 8.2364 125.0153 53.2085 30.9281 175.4146 24 G 4.1236 7.4370 109.5780 44.2301 0.0000 170.6517 25 P 4.3891 0.0000 0.0000 65.4652 31.6018 178.9724 26 K 3.8052 8.4041 116.5747 59.7160 32.0547 177.2267 27 Y 4.3118 8.0855 115.1906 60.3476 38.6240 178.4362 28 C 4.2517 8.7962 119.6280 59.1479 43.9840 174.5254 29 G 3.7777 7.8181 107.9178 46.2632 0.0000 173.5542 30 R 4.1436 8.4075 117.6722 56.5700 30.0727 176.5326 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 V 8.04 4.07 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 0.86 0.00 0.00 0.99 0.00 0.00 2 G 8.44 3.31 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 0.00 0.00 0.00 0.00 3 E 8.16 4.96 0.00 2.17 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 0.00 2.14 2.31 0.00 4 C 8.98 4.54 0.00 3.01 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 5 V 8.67 3.79 2.19 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 0.92 0.00 0.00 0.93 0.00 0.00 6 R 8.89 3.62 0.00 1.96 1.95 0.00 3.48 0.00 0.00 3.25 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.56 0.00 7 G 8.49 3.92 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 0.00 0.00 0.00 8 R 7.67 4.67 0.00 2.00 1.76 0.00 3.07 0.00 0.00 3.17 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 9 C 8.45 5.25 0.00 2.96 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 10 P 0.00 4.47 0.00 2.20 2.18 0.00 3.78 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 2.03 1.92 0.00 11 S 9.41 3.70 0.00 3.90 3.90 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 12 G 8.07 4.04 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 0.00 0.00 0.00 13 M 8.17 4.30 0.00 1.73 1.92 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.47 0.00 14 C 8.36 4.58 0.00 3.06 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 15 C 8.75 5.06 0.00 2.87 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 16 S 9.59 4.58 0.00 3.61 4.40 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.90 3.73 0.00 1.93 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 7.00 0.00 0.00 0.00 0.00 0.00 1.16 1.66 0.00 18 F 7.41 4.46 0.00 2.63 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 8.37 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 Y 7.88 4.99 0.00 3.27 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 21 C 8.14 5.07 0.00 2.98 2.89 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 22 G 7.29 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.24 4.54 0.00 1.68 1.74 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.58 7.81 24 G 7.44 4.12 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 0.00 0.00 0.00 25 P 0.00 4.39 0.00 2.22 2.16 0.00 3.68 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.16 0.00 26 K 8.40 3.81 0.00 1.79 1.73 0.00 1.80 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.54 7.81 27 Y 8.09 4.31 0.00 3.31 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 C 8.80 4.25 0.00 3.09 3.15 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.82 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 30 R 8.41 4.14 0.00 1.99 1.87 0.00 3.30 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.64 0.00