NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.7856 8.3249 115.8373 56.3424 39.6970 175.1161 2 V 3.6274 7.0413 113.8243 61.6718 32.4528 175.1084 3 N 4.6079 7.4470 120.0462 50.6679 37.8231 172.3833 4 Q 4.3825 7.0323 116.2508 55.5739 31.6509 173.8277 5 H 4.4063 8.6240 115.6406 55.1944 28.9134 175.0230 6 L 4.6228 8.4697 124.8795 53.0810 43.3340 175.7198 7 C 4.9590 8.1676 120.7791 58.6523 33.0696 174.9832 8 G 3.8176 8.4760 110.8712 46.6084 0.0000 177.5960 9 S 4.0789 8.5899 117.7856 60.9455 63.4147 176.0723 10 H 4.2668 8.1565 120.9926 58.9542 29.4873 177.0040 11 L 3.8408 7.7518 121.7428 58.1395 42.0278 178.9091 12 V 3.2202 7.3580 117.8805 65.8705 31.3077 177.6220 13 E 3.9060 8.5983 119.3092 59.0855 29.3691 178.6067 14 A 4.2006 7.9895 120.9120 55.0885 18.4096 179.5912 15 L 3.6150 7.7406 117.4791 57.8521 41.4147 179.0754 16 Y 4.1471 7.6976 119.4786 60.7405 38.5371 178.2565 17 L 3.9010 8.0570 118.8344 57.8384 41.8744 179.3870 18 V 3.7775 7.8453 117.2077 66.1215 31.4218 177.5468 19 C 4.3045 8.4674 116.5798 61.8244 28.4816 174.7892 20 G 4.0270 8.2041 110.0632 45.6603 0.0000 174.7195 21 E 4.0454 8.8085 117.7617 58.7583 29.8219 178.7303 22 R 3.8687 7.5923 118.6005 57.2354 30.2080 177.7601 23 G 3.9441 9.4261 105.5221 45.2238 0.0000 171.3020 24 F 4.9212 7.4384 112.5261 55.9041 40.3078 173.0208 25 F 4.9039 8.4896 115.0484 55.0673 39.9369 173.7820 26 Y 4.6120 8.9838 125.8437 56.1234 39.1372 174.9108 27 T 4.3275 7.8777 118.4558 58.7238 68.9922 172.0427 28 P 3.9795 0.0000 0.0000 64.7373 31.8016 176.8657 29 K 4.3124 7.7910 117.9061 54.6024 32.3917 175.9588 30 A 4.2899 8.3175 126.0826 52.1856 19.2283 175.4049 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 4.79 0.00 3.19 3.23 0.00 0.00 0.00 0.00 0.00 0.00 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 7.04 3.63 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.65 0.00 0.00 3 N 7.45 4.61 0.00 2.63 2.73 0.00 0.00 6.77 7.69 0.00 0.00 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 7.03 4.38 0.00 2.13 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.20 6.95 0.00 0.00 0.00 0.00 0.00 2.23 2.34 0.00 5 H 8.62 4.41 0.00 3.19 3.31 0.00 5.65 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.47 4.62 0.00 1.54 1.50 0.84 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 7 C 8.17 4.96 0.00 2.97 2.80 0.00 0.00 0.00 0.00 0.00 0.00 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 8.48 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 0.00 0.00 0.00 9 S 8.59 4.08 0.00 3.96 4.10 0.00 0.00 0.00 0.00 0.00 0.00 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 8.16 4.27 0.00 3.16 3.47 0.00 5.60 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.75 3.84 0.00 1.86 1.82 0.89 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 12 V 7.36 3.22 1.84 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 0.98 0.00 0.00 0.12 0.00 0.00 13 E 8.60 3.91 0.00 1.99 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00 14 A 7.99 4.20 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.74 3.61 0.00 0.95 0.25 0.80 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 7.70 4.15 0.00 3.14 3.18 0.00 0.00 0.00 0.00 0.00 0.00 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 8.06 3.90 0.00 1.80 1.78 0.79 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.85 3.78 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 0.78 0.00 0.00 0.89 0.00 0.00 19 C 8.47 4.30 0.00 3.28 3.23 0.00 0.00 0.00 0.00 0.00 0.00 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 8.20 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 21 E 8.81 4.05 0.00 2.09 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.34 0.00 22 R 7.59 3.87 0.00 2.03 2.09 0.00 3.23 0.00 0.00 3.52 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.60 0.00 23 G 9.43 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 24 F 7.44 4.92 0.00 3.09 3.04 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 25 F 8.49 4.90 0.00 3.17 3.06 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 0.00 0.00 0.00 0.00 26 Y 8.98 4.61 0.00 3.21 3.17 0.00 0.00 0.00 0.00 0.00 0.00 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 7.88 4.33 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 1.41 0.00 0.00 28 P 0.00 3.98 0.00 2.11 1.82 0.00 3.52 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.86 0.00 29 K 7.79 4.31 0.00 1.73 1.79 0.00 1.68 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.34 1.39 7.81 30 A 8.32 4.29 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00