NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.9204 8.3249 119.4384 57.6446 40.3853 173.3633 2 V 4.3977 8.3438 113.2633 59.7958 35.3536 173.4909 3 N 4.4608 9.6274 123.3361 53.4431 39.9860 174.1770 4 Q 4.5710 8.3566 120.8380 54.2881 31.4863 174.8975 5 H 4.6157 8.5990 120.6871 54.8271 29.7203 174.8564 6 L 4.6278 8.2283 127.0928 53.1700 43.5086 175.8796 7 C 4.8748 8.1479 120.9928 58.6000 32.5729 175.2213 8 G 4.0741 8.5726 109.9407 46.3653 0.0000 176.1778 9 S 4.0010 8.5761 114.4131 61.9483 62.8369 176.3642 10 H 4.1257 7.6999 119.3485 58.2655 28.2724 177.5913 11 L 3.8451 7.7813 122.3652 58.0778 42.0262 178.7608 12 V 3.3073 7.5444 117.6750 66.3069 31.2642 177.7026 13 E 4.0375 8.4585 117.9807 59.1755 29.1376 179.2482 14 A 3.9650 7.7359 120.6943 54.9876 18.4342 179.6695 15 L 3.5359 7.7288 117.5959 57.6760 41.4414 178.8873 16 Y 4.2462 7.7406 119.4459 60.9863 38.5191 178.4808 17 L 3.8602 7.5161 117.8212 57.7726 41.8335 179.3848 18 V 3.7091 7.7548 117.2688 65.5674 31.5167 177.3057 19 C 4.3327 8.3902 115.9304 60.0130 29.0931 175.5567 20 G 3.5599 8.4363 109.3443 46.9686 0.0000 175.5821 21 E 4.4212 8.7282 122.2713 56.2216 30.1015 177.3361 22 R 3.8541 7.9936 118.9051 57.5506 30.3443 177.6223 23 G 3.8930 8.8126 106.5167 45.2124 0.0000 171.7011 24 F 4.9364 7.6806 111.8927 56.2981 40.3011 172.8461 25 F 4.5276 8.9373 119.2550 55.6716 41.0962 174.8978 26 Y 5.0198 8.7348 124.7343 56.2948 40.0165 175.6279 27 T 4.3491 7.9578 117.5900 58.5481 69.0629 171.6989 28 P 4.2519 0.0000 0.0000 62.5405 32.2293 177.0204 29 K 4.0300 8.2477 120.6073 56.8923 32.8007 176.8876 30 T 4.1276 8.2446 118.0848 63.8895 68.4869 174.9266 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 4.92 0.00 3.09 2.98 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 2 V 8.34 4.40 2.13 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 0.75 0.00 0.00 1.11 0.00 0.00 3 N 9.63 4.46 0.00 2.71 2.75 0.00 0.00 6.88 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 8.36 4.57 0.00 1.95 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.91 0.00 0.00 0.00 0.00 0.00 2.21 2.17 0.00 5 H 8.60 4.62 0.00 3.06 3.23 0.00 5.69 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.23 4.63 0.00 1.58 1.52 0.86 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 7 C 8.15 4.87 0.00 2.93 2.77 0.00 0.00 0.00 0.00 0.00 0.00 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 8.57 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 0.00 0.00 0.00 9 S 8.58 4.00 0.00 3.93 4.05 0.00 0.00 0.00 0.00 0.00 0.00 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 7.70 4.13 0.00 3.27 3.34 0.00 5.61 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.78 3.85 0.00 1.91 1.73 0.90 1.00 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 12 V 7.54 3.31 1.94 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 0.99 0.00 0.00 0.35 0.00 0.00 13 E 8.46 4.04 0.00 2.15 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 2.28 2.43 0.00 14 A 7.74 3.97 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.73 3.54 0.00 0.27 0.13 0.58 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 7.74 4.25 0.00 3.21 3.16 0.00 0.00 0.00 0.00 0.00 0.00 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 7.52 3.86 0.00 1.64 1.70 1.01 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.75 3.71 2.13 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 0.77 0.00 0.00 0.83 0.00 0.00 19 C 8.39 4.33 0.00 3.19 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 20 G 8.44 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.73 4.42 0.00 2.08 2.07 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 2.21 2.31 0.00 22 R 7.99 3.85 0.00 2.06 2.10 0.00 3.32 0.00 0.00 3.25 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 23 G 8.81 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 24 F 7.68 4.94 0.00 3.18 3.05 0.00 0.00 0.00 0.00 0.00 0.00 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 8.94 4.53 0.00 3.12 3.08 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 0.00 0.00 0.00 0.00 26 Y 8.73 5.02 0.00 3.16 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 27 T 7.96 4.35 4.19 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 1.22 0.00 0.00 28 P 0.00 4.25 0.00 2.11 1.96 0.00 3.24 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.72 0.00 29 K 8.25 4.03 0.00 1.69 1.74 0.00 1.64 0.00 0.00 1.69 0.00 0.00 3.05 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.51 7.81 30 T 8.24 4.13 4.23 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 1.20 0.00 0.00