NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 C 4.6243 7.7358 117.5598 56.1899 42.2529 175.3125 2 G 3.6786 7.8682 103.8008 45.1384 0.0000 169.9796 3 E 4.4688 7.3931 119.9013 56.3511 31.9646 173.9749 4 T 5.3401 8.3063 109.3627 60.3653 72.0119 172.3070 5 C 5.2314 8.8153 117.0303 52.1902 44.4474 175.2310 6 V 3.8608 7.4612 123.6963 60.1941 29.4930 175.5819 7 G 4.0437 8.0048 108.8095 44.8979 0.0000 172.1185 8 G 3.8569 7.6259 116.1768 45.5856 0.0000 172.5983 9 T 4.2840 7.5191 113.0310 60.6906 69.4964 174.6121 10 C 4.9909 8.4949 123.5478 55.0913 42.8585 173.3622 11 N 4.4368 9.2997 121.0499 56.4085 39.2234 175.7086 12 T 4.0146 8.7119 116.5676 62.3745 68.7304 172.5373 13 P 4.4778 0.0000 0.0000 63.8927 31.5308 176.1019 14 G 3.9690 8.8886 110.9656 45.4891 0.0000 173.9277 15 C 4.8067 8.0353 118.2933 56.4177 36.6332 173.4700 16 T 4.4899 8.8371 122.0357 62.6139 69.8245 173.4153 17 C 4.9699 8.7752 126.8640 56.4297 45.8673 173.1261 18 S 4.7111 9.6704 122.2625 58.3852 66.8917 174.4288 19 W 3.6112 9.5894 125.6360 58.2975 26.4482 174.1269 20 D 4.6911 8.3676 112.0815 55.0237 38.4365 173.4615 21 K 5.0856 8.0677 117.2340 54.9757 36.4519 174.6582 22 C 5.2366 8.9362 121.7804 56.2282 40.9931 173.3734 23 T 4.5767 9.1122 114.3819 60.2189 72.0978 173.1198 24 R 4.6798 9.1231 121.0707 55.7506 33.8609 174.5931 25 N 4.0504 9.8595 121.3080 54.3455 36.1650 174.8276 26 G 3.9440 9.8957 103.9959 45.3640 0.0000 173.6255 27 L 4.5636 7.6468 117.8772 53.5509 43.5026 173.8789 28 P 4.7522 0.0000 0.0000 62.8926 28.5130 176.8730 29 V 3.8307 7.6201 121.8673 62.8368 31.5097 175.5981 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 C 7.74 4.62 0.00 3.20 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 2 G 7.87 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 E 7.39 4.47 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 2.34 2.27 0.00 4 T 8.31 5.34 4.26 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 1.26 0.00 0.00 5 C 8.82 5.23 0.00 3.04 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 6 V 7.46 3.86 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 0.86 0.00 0.00 0.94 0.00 0.00 7 G 8.00 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 8 G 7.63 3.86 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 0.00 0.00 0.00 0.00 0.00 0.00 9 T 7.52 4.28 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 10 C 8.49 4.99 0.00 2.97 3.14 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 11 N 9.30 4.44 0.00 2.63 3.12 0.00 0.00 7.19 7.60 0.00 0.00 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 T 8.71 4.01 4.26 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 1.21 0.00 0.00 13 P 0.00 4.48 0.00 2.04 2.01 0.00 3.65 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 14 G 8.89 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 15 C 8.04 4.81 0.00 2.97 3.05 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.84 4.49 4.26 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 1.23 0.00 0.00 17 C 8.78 4.97 0.00 3.01 3.01 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 0.00 0.00 0.00 18 S 9.67 4.71 0.00 3.94 3.93 0.00 0.00 0.00 0.00 0.00 0.00 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 W 9.59 3.61 0.00 3.36 3.35 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 0.00 0.00 0.00 0.00 20 D 8.37 4.69 0.00 2.92 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 21 K 8.07 5.09 0.00 1.82 1.72 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.67 7.81 22 C 8.94 5.24 0.00 2.90 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 23 T 9.11 4.58 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 1.20 0.00 0.00 24 R 9.12 4.68 0.00 1.82 1.74 0.00 3.25 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.72 0.00 25 N 9.86 4.05 0.00 2.91 2.88 0.00 0.00 7.11 7.65 0.00 0.00 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 G 9.90 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 27 L 7.65 4.56 0.00 1.78 1.70 0.91 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 28 P 0.00 4.75 0.00 2.04 2.05 0.00 3.63 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.02 0.00 29 V 7.62 3.83 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 0.91 0.00 0.00 1.00 0.00 0.00