NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3400 8.2893 120.3451 55.5907 33.3766 174.4350 2 T 4.6792 7.9701 114.6707 59.3430 71.9967 172.2388 3 F 4.8453 9.3268 121.2677 55.5321 43.6424 175.8705 4 E 4.2799 8.8902 123.8371 56.3889 29.8725 176.3025 5 M 4.7888 8.3264 122.8396 52.7879 35.3359 175.1836 6 L 4.0457 8.4955 123.8914 55.7232 42.4860 175.9809 7 Y 4.3742 8.8182 127.8729 59.6743 39.2791 175.0265 8 S 4.5585 7.6970 110.3233 57.6545 65.5366 173.2144 9 K 4.4748 8.0415 118.1688 56.0263 34.5809 175.1570 10 I 4.3146 8.2072 121.1975 59.8658 38.6022 174.6504 11 H 4.5376 8.8236 125.8791 55.9227 30.9276 175.1911 12 R 3.6190 8.3140 126.0428 57.2054 27.2285 175.6580 13 A 4.3746 7.6237 118.9326 51.8633 20.1042 177.1153 14 T 4.5605 7.9759 115.7502 61.5017 70.6524 174.7954 15 I 3.8985 8.3537 127.6349 61.5750 37.4444 175.9261 16 T 4.3414 8.3148 115.0599 62.2328 69.9181 173.6526 17 D 4.5638 7.5532 118.9242 53.4972 44.0287 173.7268 18 A 4.6526 8.1222 124.1863 50.7558 22.2456 176.2228 19 N 4.8666 8.3134 119.4833 51.0404 39.6450 174.1155 20 L 3.9955 8.5695 125.3172 57.4870 42.3591 177.9492 21 N 4.9714 7.8446 113.6163 52.6657 39.1820 174.4399 22 Y 4.3220 7.6182 118.6348 58.2608 39.3309 175.3228 23 I 4.1476 7.5432 126.8326 60.1766 39.4047 175.8991 24 G 4.0851 8.5487 112.8557 46.0296 0.0000 173.2281 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 M 8.29 4.34 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 1.98 0.00 2 T 7.97 4.68 4.25 0.00 0.00 0.00 0.00 0.00 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 F 9.33 4.85 0.00 2.92 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 4 E 8.89 4.28 0.00 2.01 1.94 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 2.33 2.35 0.00 5 M 8.33 4.79 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.71 0.00 6 L 8.50 4.05 0.00 1.63 1.63 0.95 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 7 Y 8.82 4.37 0.00 2.91 2.99 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.70 4.56 0.00 3.91 3.51 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.04 4.47 0.00 1.87 1.79 0.00 1.52 0.00 0.00 1.69 0.00 0.00 2.83 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.31 1.45 7.81 10 I 8.21 4.31 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.69 0.91 0.00 0.00 11 H 8.82 4.54 0.00 3.09 3.21 0.00 5.88 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 R 8.31 3.62 0.00 1.91 1.90 0.00 3.22 0.00 0.00 3.22 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.09 0.00 13 A 7.62 4.37 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 14 T 7.98 4.56 4.23 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 1.20 0.00 0.00 15 I 8.35 3.90 1.86 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 1.45 0.72 0.92 0.00 0.00 16 T 8.31 4.34 4.23 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 1.26 0.00 0.00 17 D 7.55 4.56 0.00 2.59 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.12 4.65 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.31 4.87 0.00 2.73 2.67 0.00 0.00 6.80 6.66 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 20 L 8.57 4.00 0.00 1.64 1.72 0.93 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 21 N 7.84 4.97 0.00 2.77 2.82 0.00 0.00 6.81 7.46 0.00 0.00 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 Y 7.62 4.32 0.00 3.02 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 23 I 7.54 4.15 1.67 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 1.28 0.83 0.80 0.00 0.00 24 G 8.55 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