NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.2135 8.2644 123.5821 52.7578 19.0030 176.1292 3 R 4.0279 7.9750 117.6257 56.2163 32.4881 171.8336 4 A 4.7353 8.8117 128.3945 50.5780 22.1221 175.4521 5 R 4.5111 8.0628 119.6020 54.5869 32.7791 175.2656 6 K 4.2508 8.7322 125.0390 56.2161 33.1299 177.4275 7 G 3.9137 7.4047 106.9183 45.7401 0.0000 171.2617 8 A 4.7066 7.9025 121.0950 49.9603 21.8729 175.6437 9 L 4.7908 8.6334 125.2178 54.0138 43.2382 175.6565 10 V 4.3082 9.1944 127.7810 61.3572 33.4371 174.0874 11 Q 5.0696 8.5520 128.9437 54.4371 30.6914 173.8842 12 C 4.7222 8.7829 119.9392 56.8406 33.7796 173.0799 13 D 4.4217 8.6479 118.7372 53.7463 41.7026 175.4792 14 P 4.5395 0.0000 0.0000 64.8510 31.1891 179.1848 15 S 4.2061 8.5005 113.5978 61.2652 63.0218 176.6463 16 I 3.6933 7.8473 122.9917 63.7610 36.8995 177.7667 17 K 3.7855 8.1671 120.4285 59.7328 31.9629 178.4832 18 A 3.9893 7.8530 120.2384 55.2428 18.2730 179.4489 19 L 3.9564 8.3238 117.8383 58.1882 41.6574 179.9385 20 I 3.7980 8.0406 119.9925 64.1609 36.8399 178.3829 21 L 4.1397 7.9761 119.0029 57.2901 41.3343 179.2313 22 Q 4.1506 8.0028 118.5811 59.0847 28.4563 178.7284 23 I 3.7839 7.6932 119.6175 64.3045 37.4199 177.6428 24 D 4.5045 8.3537 117.7677 56.0118 40.7834 177.3391 25 A 3.9969 7.4529 120.6451 55.6515 18.4478 178.3047 26 K 4.2674 7.8131 113.0667 57.5958 33.4369 176.3591 27 M 4.3565 7.7594 116.2472 57.0308 34.1964 176.7902 28 S 4.2772 8.5506 110.3750 58.5828 61.7620 169.2984 29 D 4.8378 7.9757 115.5303 53.6357 39.7819 176.3073 30 I 4.2576 7.9149 120.4993 63.4599 38.7767 175.5732 31 V 4.2008 7.8443 121.4414 62.8538 31.2998 175.2811 32 L 4.3539 8.8073 128.7515 57.0238 42.6055 176.9220 33 E 4.7468 7.6851 115.6103 55.5226 32.9182 174.7186 34 E 4.5460 8.9226 125.9638 55.8187 30.2709 175.9179 35 L 4.3628 8.3856 125.3908 56.0462 42.9882 177.1702 36 D 4.5566 7.2524 116.1062 52.8156 41.2367 175.3967 37 D 4.5808 8.7662 119.0190 56.1412 41.1031 177.6971 38 T 4.9350 8.3973 111.2629 62.8839 72.4262 173.0065 39 H 5.5088 8.6702 118.9250 54.1391 33.5848 172.4006 40 L 5.2237 8.8964 121.5129 52.7723 45.8876 175.3609 41 L 4.6781 8.8838 125.6435 54.6798 43.4722 175.6962 42 V 4.8658 8.9849 125.5641 60.5969 35.7600 173.9370 43 N 4.6445 9.2882 125.4106 53.3185 39.1585 173.7795 44 P 4.3049 0.0000 0.0000 65.7869 31.5837 177.8303 45 S 4.5396 7.9945 109.1774 58.8721 63.6220 174.3684 46 K 4.5841 8.3125 120.7360 56.4814 32.8309 178.1952 47 V 3.6559 7.7886 121.3098 65.9808 31.2891 177.9590 48 E 3.9509 8.1502 117.8786 59.3421 29.3600 178.7116 49 F 4.1242 8.3176 120.1537 61.3888 39.3845 176.8012 50 V 3.3078 7.9247 117.5626 66.0508 31.3396 177.6735 51 K 3.7719 7.8785 117.8667 60.0297 31.9987 178.3945 52 H 3.9641 8.3184 118.1415 59.3446 29.6415 176.7576 53 E 3.7139 8.0984 121.0639 59.2076 29.3252 178.3991 54 L 3.9014 7.7783 119.0742 58.2975 41.3900 179.4647 55 N 4.2980 8.0102 115.7162 56.2079 38.3029 177.8308 56 R 3.7966 7.8982 119.4439 59.4001 30.4182 178.9726 57 L 3.9628 8.2519 118.9741 57.7113 41.2722 179.8283 58 L 3.9772 7.3987 118.5231 57.9953 41.6815 179.3035 59 S 4.3409 7.4372 113.1579 60.8533 62.8866 176.6497 60 K 4.1310 8.0831 121.0527 58.9352 33.0159 177.9448 61 N 4.6336 7.8007 116.4454 52.4262 37.4899 176.9733 62 I 4.2703 7.1521 118.6318 59.2826 37.8839 175.6514 63 Y 4.2250 8.5280 126.4832 57.9296 39.0303 175.5346 64 N 4.4203 7.7767 123.8970 50.9353 40.7041 172.2613 65 P 4.1029 0.0000 0.0000 64.2487 31.8300 176.3759 66 M 4.1544 7.8286 124.1069 55.5297 32.0487 175.5513 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 4.21 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 3 R 7.98 4.03 0.00 1.81 1.79 0.00 3.38 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.63 0.00 4 A 8.81 4.74 1.23 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 0.00 0.00 5 R 8.06 4.51 0.00 1.72 1.77 0.00 3.24 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.64 0.00 6 K 8.73 4.25 0.00 1.79 1.73 0.00 1.88 0.00 0.00 1.71 0.00 0.00 2.80 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.44 7.81 7 G 7.40 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 8 A 7.90 4.71 1.26 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 0.00 0.00 0.00 9 L 8.63 4.79 0.00 1.67 1.61 0.97 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 10 V 9.19 4.31 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 0.93 0.00 0.00 0.94 0.00 0.00 11 Q 8.55 5.07 0.00 1.98 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.52 0.00 0.00 0.00 0.00 0.00 2.15 2.13 0.00 12 C 8.78 4.72 0.00 2.98 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 13 D 8.65 4.42 0.00 2.68 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 14 P 0.00 4.54 0.00 2.19 2.08 0.00 3.91 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 2.11 2.11 0.00 15 S 8.50 4.21 0.00 4.04 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 16 I 7.85 3.69 2.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.68 0.89 0.00 0.00 17 K 8.17 3.79 0.00 1.81 2.01 0.00 1.74 0.00 0.00 1.88 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.48 7.81 18 A 7.85 3.99 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 19 L 8.32 3.96 0.00 1.76 1.72 0.91 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 20 I 8.04 3.80 2.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.87 0.92 0.00 0.00 21 L 7.98 4.14 0.00 1.63 1.74 0.99 0.83 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 22 Q 8.00 4.15 0.00 2.31 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.54 0.00 23 I 7.69 3.78 2.01 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.63 1.00 0.00 0.00 24 D 8.35 4.50 0.00 2.91 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 25 A 7.45 4.00 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 26 K 7.81 4.27 0.00 1.89 1.95 0.00 1.58 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.40 1.42 7.81 27 M 7.76 4.36 0.00 2.44 2.12 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.42 0.00 28 S 8.55 4.28 0.00 4.02 4.03 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 29 D 7.98 4.84 0.00 2.76 2.71 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 0.00 0.00 0.00 30 I 7.91 4.26 2.10 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.67 0.98 0.00 0.00 31 V 7.84 4.20 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 0.85 0.00 0.00 0.95 0.00 0.00 32 L 8.81 4.35 0.00 1.57 1.71 0.96 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 33 E 7.69 4.75 0.00 1.99 1.72 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 2.19 2.24 0.00 34 E 8.92 4.55 0.00 2.00 1.88 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 2.29 2.33 0.00 35 L 8.39 4.36 0.00 1.71 1.67 0.93 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 36 D 7.25 4.56 0.00 2.86 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 D 8.77 4.58 0.00 2.71 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.40 4.94 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 39 H 8.67 5.51 0.00 3.10 3.14 0.00 5.75 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 L 8.90 5.22 0.00 1.55 1.51 0.93 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 41 L 8.88 4.68 0.00 1.77 1.65 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 42 V 8.98 4.87 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 0.97 0.00 0.00 0.95 0.00 0.00 43 N 9.29 4.64 0.00 2.88 2.71 0.00 0.00 7.31 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 P 0.00 4.30 0.00 2.22 2.12 0.00 3.65 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.01 0.00 45 S 7.99 4.54 0.00 3.98 3.97 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.31 4.58 0.00 1.91 1.96 0.00 1.60 0.00 0.00 1.52 0.00 0.00 2.78 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.50 1.50 7.81 47 V 7.79 3.66 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 1.05 0.00 0.00 1.04 0.00 0.00 48 E 8.15 3.95 0.00 2.08 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 2.43 2.34 0.00 49 F 8.32 4.12 0.00 3.13 3.10 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 50 V 7.92 3.31 2.29 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 0.94 0.00 0.00 1.03 0.00 0.00 51 K 7.88 3.77 0.00 1.98 1.84 0.00 1.74 0.00 0.00 1.56 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.59 7.81 52 H 8.32 3.96 0.00 3.23 3.31 0.00 5.59 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 E 8.10 3.71 0.00 1.30 1.69 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 2.06 2.24 0.00 54 L 7.78 3.90 0.00 1.83 1.68 0.88 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 55 N 8.01 4.30 0.00 3.01 2.78 0.00 0.00 7.10 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 56 R 7.90 3.80 0.00 2.11 1.96 0.00 3.19 0.00 0.00 3.21 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 57 L 8.25 3.96 0.00 1.62 1.72 0.90 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 58 L 7.40 3.98 0.00 1.71 1.71 0.91 0.89 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 59 S 7.44 4.34 0.00 3.84 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 60 K 8.08 4.13 0.00 1.72 1.88 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.48 1.63 7.81 61 N 7.80 4.63 0.00 2.81 2.81 0.00 0.00 6.99 7.16 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 62 I 7.15 4.27 1.88 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 1.32 0.57 0.92 0.00 0.00 63 Y 8.53 4.22 0.00 2.83 2.92 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 64 N 7.78 4.42 0.00 2.52 2.48 0.00 0.00 7.10 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 65 P 0.00 4.10 0.00 2.15 2.12 0.00 3.46 0.00 0.00 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.91 0.00 66 M 7.83 4.15 0.00 2.00 1.92 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.54 0.00