NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.6276 8.3644 120.4603 53.9466 41.1660 174.3337 2 H 4.9598 8.0580 119.9553 54.3885 33.0536 168.5438 3 V 5.2381 8.5120 114.1912 62.5679 32.4259 172.1369 4 C 4.1652 9.3101 124.8070 58.9207 41.1350 172.7736 5 D 4.3656 9.3951 121.2186 54.8285 40.8784 173.3719 6 D 4.8335 8.4657 116.4070 55.3898 47.3800 176.8406 7 N 4.6952 8.3417 121.9169 51.9328 35.8280 174.2248 8 F 4.4741 7.4072 125.8444 58.6139 43.1709 172.1523 9 S 5.0530 7.1552 114.2977 58.9710 65.3146 176.2511 10 C 4.7968 8.2961 117.9702 54.7768 39.0652 173.4168 11 P 4.4512 0.0000 0.0000 63.9674 29.3205 176.0557 12 A 4.0535 7.8004 114.1874 53.7322 16.7593 177.7151 13 G 4.0949 7.4980 103.8727 46.5029 0.0000 174.6549 14 S 4.7789 7.1983 114.8660 58.6012 66.8949 174.1267 15 T 5.0051 8.8867 110.7051 60.9128 72.5516 173.1562 16 C 4.8715 8.8726 120.5765 56.6989 39.4989 173.2562 17 S 4.1018 9.2813 122.1108 60.4718 63.2101 172.3528 18 S 2.7900 8.2226 119.9778 57.2221 62.2537 170.1075 19 A 4.6735 7.2224 128.8370 51.4392 23.1874 174.5505 20 F 3.7091 8.9466 112.7712 59.3445 35.7562 176.5493 21 G 4.3784 8.0365 103.7778 45.3061 0.0000 172.0799 22 F 4.7276 8.0049 112.1885 55.3179 38.2448 176.1814 23 R 4.7666 7.1620 131.4278 56.0284 31.8153 172.5052 24 N 4.2037 6.8213 114.6364 53.2972 35.3472 173.2608 25 L 4.7586 7.7644 116.3068 54.4617 41.5623 176.6451 26 S 4.3286 8.3409 119.5705 57.2500 65.6809 173.8798 27 L 3.6120 8.1296 124.3235 54.4544 39.9970 174.6053 28 V 4.0579 8.3873 123.2025 60.1839 33.0944 173.7084 29 W 5.0438 7.3949 123.3409 56.3599 30.0617 172.0452 30 G 4.4060 8.8406 103.6791 46.7361 0.0000 172.1042 31 C 5.8667 8.9999 119.5536 55.5056 43.7121 173.3322 32 S 5.1082 9.7769 121.0618 55.6142 64.7243 171.4017 33 P 5.3047 0.0000 0.0000 61.7853 31.5340 177.6786 34 V 3.7994 8.4239 123.6932 64.1488 31.7446 175.6702 35 E 4.2180 7.6274 125.9589 56.5736 29.7154 174.1978 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 D 8.36 4.63 0.00 2.71 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 2 H 8.06 4.96 0.00 3.54 3.37 0.00 5.81 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 V 8.51 5.24 2.16 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 1.20 0.00 0.00 1.01 0.00 0.00 4 C 9.31 4.17 0.00 2.52 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 D 9.40 4.37 0.00 3.14 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 6 D 8.47 4.83 0.00 2.68 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 7 N 8.34 4.70 0.00 2.75 2.82 0.00 0.00 5.55 7.15 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 8 F 7.41 4.47 0.00 2.83 3.12 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 9 S 7.16 5.05 0.00 3.94 3.74 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.30 4.80 0.00 3.11 3.12 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 11 P 0.00 4.45 0.00 2.22 2.23 0.00 3.84 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.96 0.00 12 A 7.80 4.05 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 13 G 7.50 4.09 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 S 7.20 4.78 0.00 3.91 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 15 T 8.89 5.01 4.28 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 1.25 0.00 0.00 16 C 8.87 4.87 0.00 2.64 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 S 9.28 4.10 0.00 4.12 4.09 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 0.00 0.00 0.00 0.00 18 S 8.22 2.79 0.00 3.64 3.55 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.22 4.67 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.95 3.71 0.00 3.46 3.22 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.04 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 0.00 0.00 0.00 0.00 22 F 8.00 4.73 0.00 3.13 3.09 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 0.00 0.00 0.00 0.00 23 R 7.16 4.77 0.00 0.72 1.46 0.00 3.46 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.31 0.00 24 N 6.82 4.20 0.00 2.89 2.83 0.00 0.00 6.78 7.70 0.00 0.00 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 L 7.76 4.76 0.00 1.80 1.73 1.27 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 26 S 8.34 4.33 0.00 3.70 3.30 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 27 L 8.13 3.61 0.00 1.88 2.03 1.20 0.90 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 28 V 8.39 4.06 1.74 0.00 0.00 0.00 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 0.87 0.00 0.00 29 W 7.39 5.04 0.00 3.66 3.19 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 0.00 0.00 0.00 0.00 30 G 8.84 4.41 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 C 9.00 5.87 0.00 3.01 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 32 S 9.78 5.11 0.00 3.86 3.73 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 5.30 0.00 2.44 2.21 0.00 3.96 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.94 0.00 34 V 8.42 3.80 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 0.68 0.00 0.00 0.95 0.00 0.00 35 E 7.63 4.22 0.00 2.01 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.30 0.00