NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 L 4.3806 8.1693 120.6291 55.3066 43.3559 176.8752 2 V 4.3306 7.6076 118.8965 57.5907 31.1804 171.8501 3 Q 4.5509 8.2052 115.3636 55.5261 31.9189 175.0306 4 R 4.8380 8.1421 117.8673 53.9759 34.7329 177.4102 5 G 3.6399 8.5046 106.1112 48.2385 0.0000 176.1081 6 R 3.6842 7.9774 118.8800 58.0593 30.1035 177.8506 7 F 4.7506 7.9900 114.1270 57.3238 39.9295 176.7832 8 G 4.0276 8.2800 105.7615 45.2885 0.0000 174.8247 9 R 4.7481 7.5732 115.5234 55.5085 30.8419 175.6908 10 F 4.7643 7.2283 120.2730 57.6606 40.1077 173.6685 11 L 3.5518 7.8133 116.5450 56.0436 38.5815 175.3567 12 R 4.6084 7.8194 116.7526 57.2871 34.0726 178.5304 13 K 4.6757 7.3513 115.7332 55.7528 33.1518 176.0329 14 I 3.9630 8.2384 124.0176 61.5902 43.4818 174.6972 15 R 3.5627 8.7269 117.8138 53.9352 30.2809 175.7849 16 R 3.6897 8.5968 115.5883 57.3751 29.1507 174.4779 17 F 4.6393 7.6074 120.9475 57.5020 40.9114 175.2601 18 R 3.6595 7.3045 123.4647 59.0010 29.4270 175.7928 19 P 4.1409 0.0000 0.0000 63.0010 31.4671 172.8770 20 K 3.7788 8.1836 125.0103 56.3916 28.3356 174.4646 21 V 4.2734 7.3423 120.0174 64.3751 34.8087 177.7827 22 T 4.0011 7.6965 115.8817 66.3428 68.8159 176.5376 23 I 3.6492 7.9659 120.2639 64.7381 37.7250 177.8227 24 T 3.9547 7.7367 115.8623 66.4520 68.3338 176.6888 25 I 3.7021 7.6614 121.2606 64.5780 37.2272 178.2238 26 Q 4.0990 8.4113 119.1030 59.0729 28.5822 179.3033 27 G 3.9431 8.6423 106.9412 47.6919 0.0000 175.7549 28 S 4.1140 8.3087 114.8754 61.1868 62.5492 175.8428 29 A 4.0896 7.6176 121.8224 55.1152 18.2548 179.2485 30 R 3.6608 8.0730 116.0383 58.9634 30.2158 176.3902 31 F 4.5179 8.0608 120.6475 57.5348 39.2587 175.3466 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 L 8.17 4.38 0.00 1.64 1.68 0.93 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 2 V 7.61 4.33 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 0.71 0.00 0.00 0.92 0.00 0.00 3 Q 8.21 4.55 0.00 2.19 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.88 0.00 0.00 0.00 0.00 0.00 2.18 2.33 0.00 4 R 8.14 4.84 0.00 2.09 1.94 0.00 3.22 0.00 0.00 3.39 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.75 0.00 5 G 8.50 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 6 R 7.98 3.68 0.00 1.55 1.14 0.00 3.11 0.00 0.00 3.14 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.34 0.00 7 F 7.99 4.75 0.00 3.05 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 8 G 8.28 4.03 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 0.00 0.00 0.00 0.00 0.00 0.00 9 R 7.57 4.75 0.00 1.97 1.95 0.00 3.04 0.00 0.00 3.17 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.63 0.00 10 F 7.23 4.76 0.00 2.77 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 11 L 7.81 3.55 0.00 1.55 1.57 0.54 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 12 R 7.82 4.61 0.00 1.79 1.94 0.00 3.32 0.00 0.00 3.39 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.80 0.00 13 K 7.35 4.68 0.00 1.88 1.80 0.00 1.96 0.00 0.00 1.66 0.00 0.00 2.79 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.36 1.42 7.81 14 I 8.24 3.96 1.89 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.53 0.93 0.00 0.00 15 R 8.73 3.56 0.00 1.91 1.76 0.00 3.42 0.00 0.00 3.07 7.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.70 0.00 16 R 8.60 3.69 0.00 2.05 1.92 0.00 3.31 0.00 0.00 3.17 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.61 0.00 17 F 7.61 4.64 0.00 3.01 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 18 R 7.30 3.66 0.00 1.42 1.34 0.00 3.14 0.00 0.00 3.09 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.49 0.00 19 P 0.00 4.14 0.00 2.23 2.10 0.00 2.97 0.00 0.00 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.02 0.00 20 K 8.18 3.78 0.00 1.94 1.99 0.00 1.64 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.35 1.51 7.81 21 V 7.34 4.27 2.14 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 1.15 0.00 0.00 1.05 0.00 0.00 22 T 7.70 4.00 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 1.22 0.00 0.00 23 I 7.97 3.65 2.03 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.27 0.94 0.00 0.00 24 T 7.74 3.95 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 25 I 7.66 3.70 2.01 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 1.65 1.08 0.92 0.00 0.00 26 Q 8.41 4.10 0.00 2.27 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.85 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 27 G 8.64 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 28 S 8.31 4.11 0.00 3.87 4.07 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 29 A 7.62 4.09 1.28 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 0.00 0.00 0.00 30 R 8.07 3.66 0.00 1.43 1.43 0.00 3.00 0.00 0.00 2.90 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.50 0.00 31 F 8.06 4.52 0.00 3.16 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