NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8887 8.3549 109.7365 45.6056 0.0000 173.2813 2 S 4.2084 8.5612 120.8274 57.9370 63.6823 172.6931 3 S 4.6948 8.4568 118.4141 57.0840 64.7972 174.4791 4 G 3.8266 8.6709 118.4523 45.7616 0.0000 174.5179 5 S 4.8547 9.1364 112.2768 56.4111 65.7673 174.5484 6 S 4.6522 8.5213 116.1693 58.1268 63.2082 173.7006 7 G 3.6530 8.0735 109.8764 46.3513 0.0000 173.3382 8 I 3.7271 7.9794 124.4307 64.5698 37.6892 176.6024 9 K 3.9087 7.8022 118.3963 57.4754 32.8555 175.6152 10 Q 4.7623 8.3695 118.2567 54.9137 31.8579 174.3045 11 H 5.1985 8.5179 117.2295 54.0386 31.8859 173.0240 12 C 4.0457 8.3309 124.2443 60.2268 32.2364 174.5201 13 R 4.3273 8.6159 120.4663 57.4586 31.6082 178.2289 14 F 4.1421 8.3269 115.8721 60.4536 39.0318 176.2497 15 C 4.3806 8.2342 112.8952 58.0499 30.4909 173.2859 16 K 4.5255 7.9408 117.6169 56.9507 28.4772 174.6011 17 K 4.6146 7.8754 117.6865 55.1856 35.5094 175.8896 18 K 4.8807 8.3906 119.6894 55.2888 33.9162 175.9787 19 Y 4.6186 8.1089 120.7582 56.6255 41.5079 175.6324 20 S 4.3487 9.0571 117.2355 60.6671 64.1817 174.3830 21 D 4.8097 7.8434 122.0464 51.8944 42.6187 177.7319 22 V 3.6111 8.3973 124.8174 64.7789 31.2642 178.3400 23 K 3.8104 8.1324 118.7463 59.4757 31.8433 178.3193 24 N 4.2700 8.1554 116.3213 56.7556 38.8166 175.9126 25 L 3.0622 7.4071 121.5269 57.9306 41.9233 178.6611 26 I 3.5864 7.7798 119.2269 64.6546 37.2272 177.9594 27 K 3.8075 7.7812 119.7806 59.9137 31.9551 178.1393 28 H 4.0527 8.2272 118.4644 59.2945 29.6230 176.8825 29 I 3.4172 7.8889 121.8263 64.7573 36.8496 178.4159 30 R 3.9163 7.4330 116.6691 57.8787 29.9556 178.4049 31 D 4.3560 7.5421 118.1596 57.1726 41.4323 176.3321 32 M 4.3326 7.5521 116.3133 56.8223 34.3094 176.7369 33 H 4.4197 7.6125 116.5825 55.1483 27.9049 177.1552 34 D 4.6527 7.1860 119.6111 51.5276 40.5379 172.4166 35 P 4.4188 0.0000 0.0000 62.0743 32.5439 177.6484 36 Q 4.2920 8.3787 120.8573 56.1718 28.8023 175.3278 37 D 4.4606 7.9112 122.0407 55.5147 41.2946 175.3725 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 G 8.35 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.56 4.21 0.00 3.96 3.82 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.46 4.69 0.00 3.83 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 G 8.67 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 9.14 4.85 0.00 3.97 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 S 8.52 4.65 0.00 3.99 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 7 G 8.07 3.65 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 I 7.98 3.73 1.89 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 1.48 0.85 0.92 0.00 0.00 9 K 7.80 3.91 0.00 2.05 1.87 0.00 1.60 0.00 0.00 1.74 0.00 0.00 3.14 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.39 1.40 7.81 10 Q 8.37 4.76 0.00 2.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.91 0.00 0.00 0.00 0.00 0.00 2.38 2.32 0.00 11 H 8.52 5.20 0.00 2.97 3.36 0.00 5.93 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 C 8.33 4.05 0.00 3.09 3.03 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 13 R 8.62 4.33 0.00 1.53 1.61 0.00 3.11 0.00 0.00 3.15 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.57 0.00 14 F 8.33 4.14 0.00 2.37 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 C 8.23 4.38 0.00 3.23 3.31 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.94 4.53 0.00 1.97 1.97 0.00 1.80 0.00 0.00 2.38 0.00 0.00 2.98 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.54 1.35 7.81 17 K 7.88 4.61 0.00 1.88 1.77 0.00 1.74 0.00 0.00 1.87 0.00 0.00 2.91 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.46 1.52 7.81 18 K 8.39 4.88 0.00 1.56 1.68 0.00 1.69 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.48 7.81 19 Y 8.11 4.62 0.00 2.87 2.78 0.00 0.00 0.00 0.00 0.00 0.00 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 S 9.06 4.35 0.00 3.99 3.98 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 21 D 7.84 4.81 0.00 2.76 2.65 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 0.00 0.00 0.00 0.00 22 V 8.40 3.61 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 0.84 0.00 0.00 0.92 0.00 0.00 23 K 8.13 3.81 0.00 1.79 1.92 0.00 1.69 0.00 0.00 1.74 0.00 0.00 2.90 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.54 1.47 7.81 24 N 8.16 4.27 0.00 2.82 3.10 0.00 0.00 6.92 6.96 0.00 0.00 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 7.41 3.06 0.00 1.38 1.72 0.69 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 26 I 7.78 3.59 1.96 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 1.39 0.89 0.88 0.00 0.00 27 K 7.78 3.81 0.00 1.74 1.92 0.00 1.63 0.00 0.00 1.57 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.41 1.44 7.81 28 H 8.23 4.05 0.00 3.19 3.20 0.00 5.85 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 29 I 7.89 3.42 1.94 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 1.61 0.77 0.76 0.00 0.00 30 R 7.43 3.92 0.00 1.65 1.92 0.00 3.13 0.00 0.00 3.11 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.56 0.00 31 D 7.54 4.36 0.00 2.83 2.71 0.00 0.00 0.00 0.00 0.00 0.00 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 M 7.55 4.33 0.00 1.90 1.72 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 2.50 2.54 0.00 33 H 7.61 4.42 0.00 2.39 1.83 0.00 5.62 0.00 0.00 0.00 0.00 8.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 D 7.19 4.65 0.00 2.74 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 P 0.00 4.42 0.00 2.23 2.06 0.00 3.73 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 36 Q 8.38 4.29 0.00 2.18 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.03 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 37 D 7.91 4.46 0.00 2.65 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00