NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 T 4.4870 8.1749 111.0786 61.7053 70.9260 172.4147 3 I 4.3141 8.5310 122.0113 58.7158 39.9609 173.1697 4 Q 5.0730 9.5939 130.1707 54.3858 30.9865 174.1893 5 L 4.8972 9.0835 126.2661 53.2832 45.6578 175.3101 6 T 4.8166 8.3178 117.8592 62.2436 70.7581 174.0683 7 V 5.1450 8.8924 126.8818 58.9706 31.2368 174.0555 8 P 4.4190 0.0000 0.0000 64.5231 31.7406 178.3345 9 T 4.1913 7.7895 107.7221 62.5427 69.3843 174.9269 10 I 3.7376 7.6492 124.5684 61.6289 37.3638 175.5219 11 A 4.6366 8.5262 126.7716 52.3499 21.4016 175.3777 12 C 4.7439 7.6342 111.7286 56.9121 33.6707 175.2124 13 E 4.0186 8.7497 119.1158 61.0606 29.0555 177.1984 14 A 4.1847 7.9359 120.0107 55.3398 18.4217 179.1904 15 C 4.0085 8.1114 114.5813 62.9682 28.2240 175.7537 16 A 3.9412 7.7643 121.8936 55.4097 17.8541 179.1935 17 E 3.8282 8.3864 117.3897 59.3764 29.6484 178.9060 18 A 3.9597 8.1960 120.8078 55.1394 18.4873 179.6692 19 V 3.5233 8.0042 117.0110 66.4790 31.5017 178.3113 20 T 3.8326 8.0548 115.4511 66.6056 68.2431 176.5172 21 K 3.8962 8.3760 121.5423 59.3918 31.8593 178.6637 22 A 3.9667 8.1949 121.1635 55.0542 18.3249 179.7924 23 V 3.5757 7.8024 116.7183 66.4115 31.3935 178.4092 24 Q 4.3401 8.3641 117.5482 58.6967 28.2432 178.3502 25 N 4.3661 8.3042 117.3954 55.8645 38.5322 176.5319 26 E 4.5512 7.4090 119.4341 57.0818 30.4459 175.8107 27 D 4.4911 8.2196 118.4291 52.0911 42.4319 175.3949 28 A 4.1762 8.4931 129.4383 54.0127 18.6024 177.9543 29 Q 4.3429 8.0458 112.8683 55.7605 29.2201 175.9325 30 A 4.3740 7.8556 121.0860 52.4424 19.3351 177.2380 31 T 4.5410 8.7834 118.1179 61.9907 70.7852 174.1336 32 V 4.8297 8.3236 125.2660 61.2907 34.4974 174.2884 33 Q 4.7615 9.2005 126.6911 53.9992 32.2261 174.6295 34 V 4.7186 8.3452 122.2736 61.1413 34.3822 173.8475 35 D 4.7847 9.0054 128.5966 52.6902 41.8696 177.2452 36 L 4.1240 8.7394 126.6284 57.5132 42.2423 178.5805 37 T 4.2297 8.2645 115.1564 65.7141 68.8630 176.3327 38 S 4.2510 8.2480 113.1592 58.5879 63.8141 174.7875 39 K 3.9808 8.1602 119.7529 56.9744 29.9236 174.8783 40 K 4.7181 7.6715 119.2380 55.7538 33.7859 175.9722 41 V 4.7489 8.9176 124.8929 61.4949 34.0033 174.1370 42 T 5.0685 9.0106 125.4198 61.9014 70.9834 173.5467 43 I 5.0381 8.7098 126.6519 59.7668 41.3941 174.4169 44 T 4.7958 8.7227 123.4321 61.9975 70.6616 173.2943 45 S 4.9961 8.3921 119.3561 57.1957 65.1829 174.1118 46 A 4.1958 9.0387 126.1425 53.7521 18.5543 178.4225 47 L 4.3582 7.8679 116.4469 54.2637 42.5121 177.7532 48 G 3.9688 9.1964 109.4628 43.5527 0.0000 174.6609 49 E 3.9360 8.6116 120.2285 59.3621 29.5135 178.7410 50 E 3.9624 8.1127 117.9695 59.5637 29.5484 179.1684 51 Q 4.0290 8.0266 117.5490 58.8364 28.7266 178.7119 52 L 3.9675 8.1296 120.0655 57.8925 41.6686 179.6455 53 R 3.9204 8.2733 118.2897 59.7290 30.0125 179.3201 54 T 3.8580 8.0596 115.1335 66.4565 68.2064 176.5931 55 A 4.0043 8.0001 121.8619 55.3774 18.8184 179.4960 56 I 3.8183 8.1261 118.3010 64.3929 37.1712 178.5264 57 A 4.3392 8.5433 123.3913 54.5596 17.9425 179.7801 58 S 4.1186 8.0295 111.8544 61.1036 63.0605 175.7328 59 A 4.4083 7.6758 121.8224 52.1589 18.6960 177.8007 60 G 3.8802 8.1275 105.8164 45.3218 0.0000 173.1261 61 H 4.8564 8.1062 117.9884 54.1614 31.7928 173.3893 62 E 4.5366 8.4502 117.4909 54.5088 30.9566 176.3331 63 V 4.5587 8.0479 122.8372 60.0373 33.1920 175.3936 64 E 4.1540 8.8162 126.0758 56.8503 29.1831 176.7298 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 T 8.17 4.49 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 3 I 8.53 4.31 1.87 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 1.11 1.02 0.91 0.00 0.00 4 Q 9.59 5.07 0.00 2.04 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.77 0.00 0.00 0.00 0.00 0.00 2.25 2.46 0.00 5 L 9.08 4.90 0.00 1.56 1.51 0.92 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 6 T 8.32 4.82 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 7 V 8.89 5.15 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 1.23 0.00 0.00 0.93 0.00 0.00 8 P 0.00 4.42 0.00 2.22 2.17 0.00 4.03 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.17 0.00 9 T 7.79 4.19 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 1.22 0.00 0.00 10 I 7.65 3.74 1.84 0.00 0.00 0.80 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 0.40 0.88 0.00 0.00 11 A 8.53 4.64 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 12 C 7.63 4.74 0.00 3.12 3.02 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 0.00 0.00 0.00 13 E 8.75 4.02 0.00 2.00 2.01 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 2.31 1.95 0.00 14 A 7.94 4.18 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 15 C 8.11 4.01 0.00 3.15 2.90 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 16 A 7.76 3.94 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.39 3.83 0.00 2.13 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 0.00 2.31 2.21 0.00 18 A 8.20 3.96 1.38 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 0.00 0.00 0.00 19 V 8.00 3.52 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 1.00 0.00 0.00 0.90 0.00 0.00 20 T 8.05 3.83 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 1.24 0.00 0.00 21 K 8.38 3.90 0.00 1.86 1.99 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.46 7.81 22 A 8.19 3.97 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 23 V 7.80 3.58 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 1.02 0.00 0.00 0.99 0.00 0.00 24 Q 8.36 4.34 0.00 2.21 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.57 0.00 0.00 0.00 0.00 0.00 2.38 2.47 0.00 25 N 8.30 4.37 0.00 2.85 2.88 0.00 0.00 6.98 8.41 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 26 E 7.41 4.55 0.00 2.16 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 0.00 2.47 2.45 0.00 27 D 8.22 4.49 0.00 2.69 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.49 4.18 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 29 Q 8.05 4.34 0.00 2.21 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.80 0.00 0.00 0.00 0.00 0.00 2.34 2.33 0.00 30 A 7.86 4.37 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.78 4.54 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 32 V 8.32 4.83 2.08 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 0.81 0.00 0.00 0.93 0.00 0.00 33 Q 9.20 4.76 0.00 1.99 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.53 0.00 0.00 0.00 0.00 0.00 2.25 2.25 0.00 34 V 8.35 4.72 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 0.76 0.00 0.00 0.91 0.00 0.00 35 D 9.01 4.78 0.00 2.81 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 36 L 8.74 4.12 0.00 1.67 1.71 0.91 0.95 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 37 T 8.26 4.23 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 1.21 0.00 0.00 38 S 8.25 4.25 0.00 3.97 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 39 K 8.16 3.98 0.00 2.00 2.07 0.00 1.77 0.00 0.00 1.77 0.00 0.00 2.87 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.34 1.54 7.81 40 K 7.67 4.72 0.00 1.62 1.71 0.00 1.62 0.00 0.00 1.57 0.00 0.00 2.82 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.52 7.81 41 V 8.92 4.75 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 0.94 0.00 0.00 0.91 0.00 0.00 42 T 9.01 5.07 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 43 I 8.71 5.04 1.87 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 1.22 0.73 0.91 0.00 0.00 44 T 8.72 4.80 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 45 S 8.39 5.00 0.00 3.83 3.67 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 46 A 9.04 4.20 1.34 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 47 L 7.87 4.36 0.00 1.64 1.61 0.92 0.98 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 48 G 9.20 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 0.00 0.00 0.00 49 E 8.61 3.94 0.00 2.04 1.97 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 2.38 2.41 0.00 50 E 8.11 3.96 0.00 2.09 1.98 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 2.40 2.46 0.00 51 Q 8.03 4.03 0.00 2.26 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.91 0.00 0.00 0.00 0.00 0.00 2.45 2.45 0.00 52 L 8.13 3.97 0.00 1.84 1.71 0.92 0.80 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 53 R 8.27 3.92 0.00 1.98 1.99 0.00 3.13 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.81 0.00 54 T 8.06 3.86 4.37 0.00 0.00 0.00 0.00 0.00 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 55 A 8.00 4.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.13 3.82 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 1.46 1.21 0.93 0.00 0.00 57 A 8.54 4.34 1.38 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 0.00 0.00 0.00 58 S 8.03 4.12 0.00 4.06 4.14 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 59 A 7.68 4.41 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.13 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 0.00 0.00 0.00 61 H 8.11 4.86 0.00 3.18 3.19 0.00 5.61 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 E 8.45 4.54 0.00 1.92 1.81 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 2.18 2.10 0.00 63 V 8.05 4.56 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 1.05 0.00 0.00 0.94 0.00 0.00 64 E 8.82 4.15 0.00 2.00 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 2.35 2.26 0.00