NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 V 4.1003 7.9133 120.3107 61.9776 32.6738 175.1893 6 R 4.8133 8.3545 117.9697 55.5130 29.8242 175.7485 7 I 4.5369 7.7268 115.7324 60.6543 41.7883 175.1099 8 K 4.3829 8.1073 119.3423 57.3860 32.1604 175.9574 9 L 3.6348 6.6965 117.1720 51.3722 41.9266 175.5168 10 L 4.5347 8.4602 122.8698 55.6776 41.2324 176.1407 11 L 4.9099 8.6059 120.2777 54.2114 44.2905 174.1488 12 E 4.9781 8.5226 115.9479 55.6521 34.9870 174.2764 13 C 5.3210 8.6434 116.8611 58.3873 32.4599 173.1877 14 T 4.6470 8.2145 117.9003 58.8089 69.0159 172.7648 15 E 3.7585 8.6191 129.9134 56.6743 30.2720 176.9354 16 C 4.2289 8.3897 122.7924 60.6201 28.7590 173.0213 17 K 3.6149 8.0968 116.5382 60.8828 28.5963 176.9450 18 R 2.8784 8.8109 112.3612 57.2255 29.8968 177.2292 19 R 3.2881 8.7912 120.4415 57.3303 29.2779 171.2534 20 N 4.4405 8.8215 121.4704 53.6676 39.0140 172.5415 21 Y 5.8837 8.7674 121.4442 56.5435 40.4094 174.0655 22 A 4.5486 8.9846 119.9132 52.4624 25.6127 173.3675 23 T 3.6242 8.2311 113.2800 61.4297 69.9727 170.7361 24 E 4.6468 9.9475 125.4377 54.7626 34.3674 173.5837 25 K 4.7460 7.9933 121.4787 54.4381 34.4114 175.9066 26 N 5.0396 8.9751 131.3536 51.3363 39.2545 176.2342 27 K 5.0167 9.2710 127.1479 62.8957 34.7956 178.3719 28 R 2.7831 6.4327 114.3582 57.1944 32.7999 178.0278 29 N 4.4070 8.3076 120.6052 56.4611 38.5526 176.2817 30 T 3.9003 8.2776 114.7069 61.6978 68.1950 170.8995 31 P 4.0714 0.0000 0.0000 61.9368 29.4430 174.7861 32 N 4.4821 8.8483 114.4663 52.7581 42.1229 174.0814 33 K 4.1453 8.2963 124.9733 56.8564 33.4720 176.3836 34 L 4.3198 7.3593 129.2623 53.3164 43.5849 175.0141 35 E 4.0403 8.8095 127.5713 57.0825 30.9472 175.7655 36 L 4.5801 9.2861 121.9895 55.3531 45.1717 173.4733 37 R 4.8108 8.5610 122.0354 54.2812 32.8149 174.5768 38 K 4.5253 8.6180 122.1293 57.2066 33.0479 175.4521 39 Y 4.4370 8.9090 123.8477 57.2088 43.1271 172.5143 40 C 5.2758 8.8733 119.8744 57.5104 34.0315 172.1103 41 P 4.9087 0.0000 0.0000 61.1748 32.7026 176.1972 42 W 4.9225 8.8916 126.9649 58.8097 30.2505 175.7816 43 C 4.5458 8.2661 114.7025 60.6514 29.2517 174.0449 44 R 4.0382 8.5678 124.1892 54.9523 27.2680 174.2333 45 K 4.6117 7.9966 120.5528 56.0972 35.0168 175.4316 46 H 4.5642 8.7034 118.1648 57.4473 29.7140 173.9190 47 T 3.9195 9.0671 112.9510 63.4362 71.8743 174.2651 48 V 3.5939 9.0011 115.0423 63.2185 29.9047 178.7896 49 H 4.6236 10.3433 126.7393 58.0852 28.2414 173.7909 50 R 4.7556 8.1842 120.1108 53.6739 32.4839 174.7892 51 E 5.0884 8.9326 122.8662 56.1979 30.0967 176.1661 52 V 3.9877 8.6499 123.6089 62.0859 33.6838 171.1964 53 K 4.0557 8.8282 120.5980 56.8016 31.4095 174.8084 54 I 3.8952 8.1628 108.2603 61.2984 37.5168 175.8487 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 5 V 7.91 4.10 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 0.85 0.00 0.00 0.93 0.00 0.00 6 R 8.35 4.81 0.00 1.88 1.97 0.00 3.23 0.00 0.00 3.19 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.73 0.00 7 I 7.73 4.54 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 1.30 1.23 0.91 0.00 0.00 8 K 8.11 4.38 0.00 1.78 1.85 0.00 1.91 0.00 0.00 1.75 0.00 0.00 2.92 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.37 1.39 7.81 9 L 6.70 3.63 0.00 1.77 1.88 0.92 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 10 L 8.46 4.53 0.00 1.78 1.69 0.91 0.61 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 11 L 8.61 4.91 0.00 1.63 1.80 1.00 0.65 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 12 E 8.52 4.98 0.00 2.24 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 2.21 2.27 0.00 13 C 8.64 5.32 0.00 2.80 2.79 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 14 T 8.21 4.65 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 15 E 8.62 3.76 0.00 1.69 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 2.22 2.34 0.00 16 C 8.39 4.23 0.00 2.97 2.88 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 17 K 8.10 3.61 0.00 2.12 1.90 0.00 1.66 0.00 0.00 1.69 0.00 0.00 3.06 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.49 7.81 18 R 8.81 2.88 0.00 1.82 2.09 0.00 3.38 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.65 0.00 19 R 8.79 3.29 0.00 1.90 2.00 0.00 3.39 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 1.60 1.83 0.00 20 N 8.82 4.44 0.00 2.90 2.90 0.00 0.00 6.62 7.48 0.00 0.00 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 8.77 5.88 0.00 2.76 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 22 A 8.98 4.55 1.11 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 0.00 0.00 23 T 8.23 3.62 4.21 0.00 0.00 0.00 0.00 0.00 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 24 E 9.95 4.65 0.00 1.82 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.29 0.00 25 K 7.99 4.75 0.00 1.84 1.66 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.69 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.33 1.34 7.81 26 N 8.98 5.04 0.00 2.78 1.92 0.00 0.00 7.13 6.35 0.00 0.00 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 K 9.27 5.02 0.00 1.81 1.86 0.00 1.80 0.00 0.00 1.56 0.00 0.00 3.14 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.23 1.24 7.81 28 R 6.43 2.78 0.00 1.95 2.05 0.00 3.26 0.00 0.00 3.28 7.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.80 0.00 29 N 8.31 4.41 0.00 2.81 2.95 0.00 0.00 5.88 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 30 T 8.28 3.90 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 1.28 0.00 0.00 31 P 0.00 4.07 0.00 2.10 1.97 0.00 3.77 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.17 0.00 32 N 8.85 4.48 0.00 2.87 2.78 0.00 0.00 6.72 8.19 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 33 K 8.30 4.15 0.00 1.71 1.74 0.00 1.77 0.00 0.00 1.63 0.00 0.00 2.75 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.35 1.41 7.81 34 L 7.36 4.32 0.00 1.59 1.52 0.93 0.92 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 35 E 8.81 4.04 0.00 2.21 1.89 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 2.39 2.41 0.00 36 L 9.29 4.58 0.00 1.59 1.52 0.97 1.07 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 37 R 8.56 4.81 0.00 1.89 1.89 0.00 3.18 0.00 0.00 3.35 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.81 0.00 38 K 8.62 4.53 0.00 1.79 1.69 0.00 1.76 0.00 0.00 1.65 0.00 0.00 2.71 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.33 1.48 7.81 39 Y 8.91 4.44 0.00 2.53 2.66 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.87 5.28 0.00 2.81 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 P 0.00 4.91 0.00 2.36 2.24 0.00 4.06 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.06 0.00 42 W 8.89 4.92 0.00 3.20 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 43 C 8.27 4.55 0.00 2.98 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 44 R 8.57 4.04 0.00 1.90 2.21 0.00 3.19 0.00 0.00 3.21 7.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.57 0.00 45 K 8.00 4.61 0.00 1.64 1.78 0.00 1.77 0.00 0.00 1.72 0.00 0.00 2.74 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.36 1.45 7.81 46 H 8.70 4.56 0.00 3.06 3.32 0.00 5.76 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 T 9.07 3.92 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 1.32 0.00 0.00 48 V 9.00 3.59 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 0.78 0.00 0.00 0.93 0.00 0.00 49 H 10.34 4.62 0.00 3.60 3.73 0.00 6.03 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 R 8.18 4.76 0.00 1.84 1.98 0.00 2.96 0.00 0.00 3.24 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.56 0.00 51 E 8.93 5.09 0.00 2.03 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 2.34 2.13 0.00 52 V 8.65 3.99 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 0.75 0.00 0.00 0.99 0.00 0.00 53 K 8.83 4.06 0.00 2.04 1.90 0.00 1.71 0.00 0.00 1.86 0.00 0.00 3.02 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.25 1.44 7.81 54 I 8.16 3.90 1.84 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.62 0.88 0.00 0.00