NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.7847 8.3549 109.7378 44.0832 0.0000 172.4963 2 S 3.7631 8.4566 118.8229 56.3658 60.2168 169.1802 3 L 4.7628 7.6122 120.0465 55.0647 44.7488 176.0651 4 L 3.7853 8.6094 117.0070 55.3090 39.0210 175.3828 5 K 4.1852 7.2207 114.7555 55.0871 34.7900 173.5878 6 P 4.4417 0.0000 0.0000 62.9036 31.8291 177.0518 7 A 4.7399 8.2143 124.0560 51.5180 19.4886 176.0770 8 R 4.3306 8.1155 118.3187 56.2430 34.2387 176.1235 9 F 5.0346 7.0702 119.2298 54.0733 37.0912 173.3765 10 M 4.5879 7.6571 118.3724 55.8759 35.6473 174.3360 11 C 4.4236 8.7510 128.4093 57.8078 30.5044 173.6808 12 L 3.9656 8.5018 125.1428 57.0839 41.5470 178.1140 13 P 4.4444 0.0000 0.0000 64.6172 31.4227 176.6175 14 C 4.6215 7.6762 113.5086 58.8632 30.1225 174.5184 15 G 3.7572 8.9399 107.3722 46.1905 0.0000 173.1666 16 I 4.3500 7.5663 119.7716 58.9045 40.4212 174.5531 17 A 4.5136 8.4176 129.8898 51.2662 19.3608 176.9455 18 F 4.5802 8.4083 123.6046 57.1452 41.8243 177.4517 19 S 4.0566 8.4572 115.8412 57.2270 62.9297 175.1291 20 S 4.3654 7.6576 109.6060 54.7403 66.1186 172.9565 21 P 4.3302 0.0000 0.0000 66.4641 31.1331 179.0385 22 S 4.1114 8.0107 115.1883 61.1853 62.6830 176.7879 23 T 3.6591 7.4071 117.1406 66.2467 68.0655 176.5941 24 L 3.5718 7.4076 120.7190 57.7864 41.7077 179.2660 25 E 4.0879 8.0816 118.2629 59.0525 29.3388 178.5691 26 A 4.0176 7.5463 121.0412 55.0476 18.2927 179.1853 27 H 4.2793 7.9542 116.7796 59.6896 29.9265 177.5676 28 Q 3.6269 8.4403 117.8289 57.9824 28.4895 178.3621 29 A 4.2739 7.6735 121.9775 54.6866 18.6916 178.0965 30 Y 4.5263 7.7476 109.3289 58.0677 40.9314 175.2925 31 Y 4.0526 8.0671 121.5834 59.1784 39.8897 175.3071 32 C 4.1314 8.7176 122.6243 59.3533 31.0592 173.5522 33 S 3.4196 8.2422 124.0869 60.1023 61.9751 172.3449 34 H 4.5893 8.3299 114.0208 54.9013 27.3029 173.0040 35 R 4.0581 7.7289 121.3938 55.5281 31.0967 176.0714 36 I 3.9704 8.1919 124.0218 61.0773 38.1472 174.7849 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 3.78 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 0.00 0.00 0.00 2 S 8.46 3.76 0.00 4.12 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.61 4.76 0.00 1.75 1.70 0.92 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 4 L 8.61 3.79 0.00 1.82 1.79 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 5 K 7.22 4.19 0.00 1.79 1.72 0.00 1.73 0.00 0.00 1.77 0.00 0.00 3.07 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.32 1.46 7.81 6 P 0.00 4.44 0.00 2.21 2.07 0.00 3.76 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 7 A 8.21 4.74 1.26 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 0.00 0.00 0.00 8 R 8.12 4.33 0.00 1.70 1.69 0.00 3.08 0.00 0.00 3.11 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.48 0.00 9 F 7.07 5.03 0.00 3.16 3.21 0.00 0.00 0.00 0.00 0.00 0.00 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 M 7.66 4.59 0.00 1.91 1.86 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.46 0.00 11 C 8.75 4.42 0.00 3.11 2.82 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 12 L 8.50 3.97 0.00 1.79 1.71 0.92 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 13 P 0.00 4.44 0.00 2.08 2.14 0.00 3.57 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.13 0.00 14 C 7.68 4.62 0.00 3.17 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 15 G 8.94 3.76 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 0.00 0.00 0.00 16 I 7.57 4.35 1.58 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.81 0.41 0.00 0.00 17 A 8.42 4.51 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.41 4.58 0.00 3.11 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 19 S 8.46 4.06 0.00 3.78 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 20 S 7.66 4.37 0.00 3.77 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 21 P 0.00 4.33 0.00 2.29 2.30 0.00 3.66 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.03 0.00 22 S 8.01 4.11 0.00 3.83 3.90 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 T 7.41 3.66 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 0.00 0.00 24 L 7.41 3.57 0.00 1.72 1.71 1.08 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 25 E 8.08 4.09 0.00 1.96 1.99 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 2.37 2.32 0.00 26 A 7.55 4.02 1.25 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 0.00 0.00 27 H 7.95 4.28 0.00 3.22 3.47 0.00 5.79 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 28 Q 8.44 3.63 0.00 2.23 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.76 0.00 0.00 0.00 0.00 0.00 2.46 2.44 0.00 29 A 7.67 4.27 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.75 4.53 0.00 2.87 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 Y 8.07 4.05 0.00 2.96 2.86 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 32 C 8.72 4.13 0.00 2.95 2.86 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 33 S 8.24 3.42 0.00 3.99 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 H 8.33 4.59 0.00 3.04 3.22 0.00 5.89 0.00 0.00 0.00 0.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 R 7.73 4.06 0.00 1.69 1.70 0.00 3.20 0.00 0.00 3.12 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.60 0.00 36 I 8.19 3.97 1.84 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.03 0.89 0.00 0.00