NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3503 8.2649 123.5888 51.7634 19.9802 177.0719 3 R 4.0192 7.8473 118.1030 56.8703 30.9077 176.2046 4 K 3.7193 9.2730 122.0936 60.5790 33.1634 178.2419 5 A 3.8729 8.2972 118.7062 56.0085 17.8574 178.6179 6 L 4.0922 7.5982 115.8076 55.6910 43.1523 178.1725 7 I 4.4550 7.8390 120.8827 60.6673 37.1091 175.8346 8 E 4.4613 7.7501 117.5115 56.1251 31.1563 177.8525 9 K 3.5112 8.1810 120.5151 59.5341 32.1551 177.0098 10 A 4.0544 8.1101 120.2471 55.3367 18.5138 179.0786 11 K 4.0896 8.8546 117.7298 61.8881 30.3218 182.1857 12 R 2.6881 8.0965 113.4443 55.8981 33.1613 179.3041 13 T 3.6375 6.7178 119.7838 64.7148 65.6909 172.3363 14 P 4.3651 0.0000 0.0000 63.0053 32.3283 179.8577 15 K 3.8227 8.0205 118.0168 57.2996 32.9501 175.5063 16 F 4.4203 8.5642 115.5091 56.6980 41.5627 174.9363 17 K 3.9104 8.9582 126.5693 58.9374 32.2038 178.2259 18 V 3.9249 8.5621 114.4246 64.4756 31.8477 179.9938 19 R 4.3801 8.0519 119.1639 55.6590 28.9183 176.1362 20 A 4.8241 9.3976 121.4290 50.5298 20.7411 177.1876 21 Y 4.4601 8.4638 120.9373 56.0745 38.6072 179.1340 22 T 2.6352 8.0235 112.2064 57.7223 73.0761 170.5765 23 R 4.0556 7.9831 128.3311 54.4195 30.9341 175.7010 24 C 4.5388 9.5331 122.5614 58.9326 31.9791 174.8440 25 V 3.8677 8.6848 126.7542 63.2723 31.0712 175.7667 26 R 4.3951 7.8448 118.0998 57.9199 31.8284 176.0007 27 C 4.3513 8.0057 110.3935 57.6904 30.4824 175.2262 28 G 3.9395 7.9395 108.5697 45.3818 0.0000 174.1591 29 R 3.8720 7.4417 120.3937 57.0273 30.5542 176.2242 30 A 4.5493 8.4910 126.6100 53.9059 21.0592 177.6844 31 R 4.0523 7.9037 114.9431 58.8743 30.4504 176.8712 32 S 4.7010 7.7064 112.2885 57.2510 64.0405 171.5784 33 V 4.7867 7.7461 119.3997 60.5293 33.5310 175.4328 34 Y 4.1781 8.9447 122.8873 58.3948 39.1201 177.2924 35 R 4.0455 9.0475 119.8126 59.2953 30.8301 179.2985 36 F 3.7375 7.8331 118.5381 60.5038 39.7917 175.8313 37 F 4.9149 8.5282 117.0530 58.0854 40.9647 176.6314 38 G 4.0539 8.9247 107.3055 45.2376 0.0000 172.2886 39 L 5.0474 7.7418 118.8699 52.2368 44.4821 176.0798 40 C 4.9566 8.4202 116.8391 57.8506 30.2573 174.5141 41 R 4.3338 8.3166 116.3046 58.1603 29.0424 177.5993 42 I 4.1978 7.5211 119.8474 63.5556 38.3647 176.9107 43 C 3.9147 8.0150 116.6764 63.0647 27.9653 175.7458 44 L 3.6920 8.3548 121.9162 58.3836 41.5538 179.0941 45 R 3.6810 7.8214 117.4403 59.6328 29.9499 177.9366 46 E 3.9705 8.3437 117.1163 59.1644 29.6479 178.9886 47 L 4.2675 7.9321 117.9667 57.2974 42.1711 179.0016 48 A 3.7796 7.7421 119.7295 55.4256 18.5190 179.1628 49 H 4.3819 8.1033 114.6591 58.9451 27.3994 177.8840 50 K 4.2799 8.1811 118.5733 56.6774 31.4387 178.0120 51 G 4.0512 7.3956 107.0087 46.7827 0.0000 174.2321 52 Q 4.3616 7.4692 115.7216 55.3317 28.8030 176.4100 53 L 4.5554 7.2243 119.8363 51.3239 42.4081 172.7618 54 P 4.1945 0.0000 0.0000 63.8405 31.3815 177.5653 55 G 3.8225 8.8713 109.7550 45.6311 0.0000 173.5048 56 V 3.7366 8.1058 120.3504 62.1869 30.7750 174.9229 57 R 4.4894 8.1761 127.8979 54.4339 32.3949 174.5946 58 K 4.3608 8.2873 118.2530 54.4812 32.5870 176.8730 59 A 4.2630 8.5391 127.0523 52.2814 19.1025 176.4377 60 S 4.6652 8.6421 108.9803 57.7282 65.1723 176.5197 61 W 4.6915 8.7002 124.3559 57.0862 27.3964 174.1714 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 2 A 8.26 4.35 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 3 R 7.85 4.02 0.00 2.04 1.88 0.00 3.22 0.00 0.00 3.37 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.79 0.00 4 K 9.27 3.72 0.00 1.73 1.90 0.00 1.79 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.54 7.81 5 A 8.30 3.87 1.31 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 6 L 7.60 4.09 0.00 1.57 1.86 0.97 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 7 I 7.84 4.45 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 1.35 0.96 0.88 0.00 0.00 8 E 7.75 4.46 0.00 2.16 2.44 0.00 0.00 0.00 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 2.35 0.00 9 K 8.18 3.51 0.00 1.10 1.61 0.00 1.66 0.00 0.00 1.61 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.17 0.93 7.81 10 A 8.11 4.05 1.28 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 0.00 0.00 11 K 8.85 4.09 0.00 1.92 1.84 0.00 1.73 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.42 7.81 12 R 8.10 2.69 0.00 1.87 2.13 0.00 3.39 0.00 0.00 3.22 7.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 13 T 6.72 3.64 4.31 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 1.18 0.00 0.00 14 P 0.00 4.37 0.00 2.53 2.35 0.00 3.78 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.97 0.00 15 K 8.02 3.82 0.00 1.98 1.93 0.00 1.89 0.00 0.00 1.92 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 0.77 1.20 7.81 16 F 8.56 4.42 0.00 3.13 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 17 K 8.96 3.91 0.00 1.86 2.01 0.00 1.49 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.63 7.81 18 V 8.56 3.92 2.11 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 0.82 0.00 0.00 1.03 0.00 0.00 19 R 8.05 4.38 0.00 1.92 2.05 0.00 3.59 0.00 0.00 3.32 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.75 0.00 20 A 9.40 4.82 1.28 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 0.00 0.00 21 Y 8.46 4.46 0.00 3.08 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 T 8.02 2.64 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 23 R 7.98 4.06 0.00 1.85 1.92 0.00 3.39 0.00 0.00 3.24 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.11 0.00 24 C 9.53 4.54 0.00 2.87 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 25 V 8.68 3.87 2.10 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 0.82 0.00 0.00 0.94 0.00 0.00 26 R 7.84 4.40 0.00 1.77 1.95 0.00 3.22 0.00 0.00 3.28 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.57 0.00 27 C 8.01 4.35 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 28 G 7.94 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 0.00 0.00 0.00 29 R 7.44 3.87 0.00 1.90 1.87 0.00 3.13 0.00 0.00 3.20 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.68 0.00 30 A 8.49 4.55 1.40 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 31 R 7.90 4.05 0.00 1.79 2.01 0.00 3.32 0.00 0.00 3.30 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.75 0.00 32 S 7.71 4.70 0.00 3.80 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 33 V 7.75 4.79 2.17 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 0.83 0.00 0.00 1.00 0.00 0.00 34 Y 8.94 4.18 0.00 3.16 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 9.05 4.05 0.00 1.94 1.98 0.00 3.19 0.00 0.00 3.28 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.64 0.00 36 F 7.83 3.74 0.00 2.82 2.44 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.53 4.91 0.00 3.21 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 G 8.92 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 39 L 7.74 5.05 0.00 1.75 1.58 0.88 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 40 C 8.42 4.96 0.00 3.16 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 41 R 8.32 4.33 0.00 2.11 2.30 0.00 3.15 0.00 0.00 3.29 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.78 0.00 42 I 7.52 4.20 1.90 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.63 0.92 0.00 0.00 43 C 8.01 3.91 0.00 2.98 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 44 L 8.35 3.69 0.00 1.64 1.76 0.47 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 45 R 7.82 3.68 0.00 1.85 2.07 0.00 3.26 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.62 0.00 46 E 8.34 3.97 0.00 2.05 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.49 0.00 47 L 7.93 4.27 0.00 1.55 1.59 0.85 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 48 A 7.74 3.78 1.17 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 49 H 8.10 4.38 0.00 3.19 3.30 0.00 5.63 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 K 8.18 4.28 0.00 1.89 1.84 0.00 1.77 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.63 7.81 51 G 7.40 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 52 Q 7.47 4.36 0.00 2.09 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.03 6.89 0.00 0.00 0.00 0.00 0.00 2.34 2.45 0.00 53 L 7.22 4.56 0.00 1.48 1.39 0.05 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.19 0.00 2.23 2.13 0.00 3.90 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.08 0.00 55 G 8.87 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 56 V 8.11 3.74 2.09 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 0.61 0.00 0.00 0.94 0.00 0.00 57 R 8.18 4.49 0.00 1.78 1.82 0.00 3.28 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.62 0.00 58 K 8.29 4.36 0.00 1.80 1.78 0.00 1.85 0.00 0.00 1.78 0.00 0.00 3.05 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.39 7.81 59 A 8.54 4.26 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.64 4.67 0.00 3.86 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 61 W 8.70 4.69 0.00 3.35 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