NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1582 8.3149 119.9209 56.3012 34.3293 176.2409 2 W 4.5627 7.6568 123.8312 56.5667 30.5477 176.1937 3 C 4.2213 10.0360 120.4357 59.7556 43.8737 175.4628 4 F 5.3706 8.5401 125.7178 57.4214 41.9964 173.6040 5 R 3.9195 7.8852 117.3749 56.3033 28.4021 176.6324 6 V 3.8564 8.1097 110.9897 64.4879 32.0316 177.2291 7 C 4.0510 9.5233 123.8890 57.9445 35.0193 172.0837 8 Y 4.5320 8.3149 117.6378 57.8229 42.0570 172.8405 9 R 3.0366 6.8192 118.3606 54.7779 27.4361 179.1974 10 G 4.6663 6.5515 116.1406 44.3728 0.0000 174.3784 11 I 3.7845 6.1777 111.4236 60.0626 39.5493 173.1633 12 C 4.9870 8.6920 118.3695 57.2255 39.9127 173.8812 13 Y 4.3847 8.2651 126.7728 55.2403 38.1327 174.5486 14 R 4.1271 8.0166 118.3916 57.5078 29.9803 177.3279 15 R 4.8551 8.1374 125.5094 56.1611 32.8360 177.2057 16 C 3.6318 8.3961 118.4159 57.4159 44.4215 172.9128 17 R 4.0696 7.1385 123.6189 56.7203 31.1219 175.3087 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 K 8.31 4.16 0.00 1.64 1.77 0.00 0.61 0.00 0.00 1.28 0.00 0.00 2.64 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.01 1.08 7.81 2 W 7.66 4.56 0.00 3.61 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 3 C 10.04 4.22 0.00 3.04 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 4 F 8.54 5.37 0.00 3.09 3.19 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.89 3.92 0.00 2.44 2.63 0.00 3.09 0.00 0.00 3.46 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.81 0.00 6 V 8.11 3.86 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 1.05 0.00 0.00 7 C 9.52 4.05 0.00 3.17 3.28 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 8 Y 8.31 4.53 0.00 3.02 2.96 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 0.00 0.00 0.00 0.00 9 R 6.82 3.04 0.00 1.83 1.89 0.00 3.42 0.00 0.00 3.10 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 1.74 0.00 10 G 6.55 4.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 6.18 3.78 1.92 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.51 0.93 0.00 0.00 12 C 8.69 4.99 0.00 3.02 3.13 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.27 4.38 0.00 2.84 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 R 8.02 4.13 0.00 1.87 1.98 0.00 3.34 0.00 0.00 3.23 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.73 0.00 15 R 8.14 4.86 0.00 2.43 2.10 0.00 3.45 0.00 0.00 3.27 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.55 0.00 16 C 8.40 3.63 0.00 2.95 3.09 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 0.00 0.00 0.00 0.00 17 R 7.14 4.07 0.00 1.58 1.69 0.00 3.44 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.59 0.00