NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.8051 8.3249 122.8280 58.0610 41.1590 175.4603 2 V 3.6628 6.6241 118.4464 60.1800 29.7306 176.5493 3 N 4.4059 8.7548 120.8468 56.9601 39.3463 176.8410 4 Q 4.0106 8.0031 118.6377 59.0303 28.6040 178.0215 5 H 4.1160 8.1560 118.8389 59.3357 29.3874 177.2120 6 L 3.9404 7.7588 120.4253 57.7930 41.4074 178.7673 7 C 4.1507 8.4522 119.1937 62.6733 31.4762 175.7169 8 G 3.7306 8.4238 107.4825 48.0940 0.0000 175.3864 9 S 3.9618 7.6761 115.0245 61.5169 62.3638 176.0788 10 H 4.2490 7.9318 117.9658 58.4569 28.4360 177.6680 11 L 3.9209 8.1375 121.2336 58.0859 41.4431 180.1111 12 V 3.4298 7.5736 112.0351 64.0389 31.3294 178.3462 13 E 3.9268 7.7528 117.9299 59.0400 29.3920 178.7001 14 A 3.9528 8.0763 120.9294 55.0259 18.4127 179.5066 15 L 3.6197 8.0662 117.8549 57.8778 41.4078 178.8418 16 Y 4.3404 7.8208 119.6979 61.1238 38.4697 178.5607 17 L 3.8620 7.6976 118.1047 57.5276 41.7990 179.4660 18 V 3.6866 7.7117 117.4657 66.3650 31.8274 177.7789 19 C 4.3078 8.6569 116.9112 60.2724 28.3486 175.2043 20 G 3.6448 8.2499 109.2949 46.4377 0.0000 177.2051 21 E 4.0777 8.8574 123.0072 58.7432 29.4592 178.2529 22 R 3.9090 7.7637 117.4046 57.0028 30.4339 178.2125 23 G 3.9968 8.2533 106.4899 45.8801 0.0000 172.0136 24 F 4.8468 7.7868 111.6611 56.2266 40.1016 172.7174 25 F 4.9920 9.1617 123.1854 56.5881 40.9280 173.5012 26 Y 4.6729 8.6972 129.5697 56.1177 39.4796 175.2193 27 T 3.9735 7.2180 117.7090 58.6453 68.8854 172.4396 28 P 3.9531 0.0000 0.0000 64.6386 32.0491 177.3322 29 K 4.0525 7.1079 123.8260 56.8442 31.8308 176.4764 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 F 8.32 4.81 0.00 2.92 3.07 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 0.00 0.00 0.00 0.00 2 V 6.62 3.66 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 0.72 0.00 0.00 0.25 0.00 0.00 3 N 8.75 4.41 0.00 2.79 2.97 0.00 0.00 7.00 7.74 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 4 Q 8.00 4.01 0.00 2.11 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.89 0.00 0.00 0.00 0.00 0.00 2.47 2.43 0.00 5 H 8.16 4.12 0.00 3.19 3.37 0.00 5.87 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 7.76 3.94 0.00 1.81 1.75 1.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 7 C 8.45 4.15 0.00 2.99 3.16 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 0.00 0.00 0.00 0.00 8 G 8.42 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 0.00 0.00 0.00 9 S 7.68 3.96 0.00 3.74 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 10 H 7.93 4.25 0.00 3.35 3.32 0.00 5.68 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 8.14 3.92 0.00 1.80 1.63 1.02 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 12 V 7.57 3.43 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 0.05 0.00 0.00 0.83 0.00 0.00 13 E 7.75 3.93 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 2.29 2.39 0.00 14 A 8.08 3.95 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 L 8.07 3.62 0.00 0.71 0.35 0.80 0.66 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 16 Y 7.82 4.34 0.00 3.26 3.20 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 0.00 0.00 0.00 0.00 17 L 7.70 3.86 0.00 1.80 1.69 0.96 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.71 3.69 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 0.81 0.00 0.00 0.91 0.00 0.00 19 C 8.66 4.31 0.00 3.20 3.25 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 0.00 20 G 8.25 3.64 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 E 8.86 4.08 0.00 1.96 2.03 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 2.30 2.31 0.00 22 R 7.76 3.91 0.00 1.97 2.04 0.00 3.31 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.59 0.00 23 G 8.25 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 F 7.79 4.85 0.00 3.21 3.07 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 0.00 0.00 0.00 0.00 25 F 9.16 4.99 0.00 2.84 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 26 Y 8.70 4.67 0.00 3.23 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.22 3.97 3.85 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 -0.36 0.00 0.00 28 P 0.00 3.95 0.00 2.09 1.93 0.00 3.41 0.00 0.00 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.87 0.00 29 K 7.11 4.05 0.00 1.70 1.72 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.49 7.81