NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 5.0234 8.3244 122.8245 56.7396 41.7303 175.0976 2 V 3.4388 7.5040 122.2636 63.8113 33.1815 175.7032 3 N 4.6197 7.5128 118.6763 50.5125 37.7921 172.2453 4 Q 4.3911 7.0111 116.4983 55.6130 31.5361 173.8510 5 H 4.3678 8.7131 115.7466 55.3934 28.7514 175.0556 6 L 4.7190 8.4809 124.9580 53.1083 43.6285 175.7518 7 C 4.9586 8.1301 120.5911 58.5183 33.0915 175.5243 8 G 3.7915 8.4524 110.7352 46.4980 0.0000 177.3462 9 S 4.1254 8.6307 117.1562 61.2692 63.1618 176.3785 10 H 4.2284 8.2750 118.4371 58.5979 28.3079 177.4753 11 L 3.8937 7.6655 121.7811 58.0290 42.0746 178.9121 12 V 3.2419 7.5568 118.2200 65.9603 31.3892 177.9207 13 E 4.0574 8.2936 118.1434 59.1033 29.1862 179.1489 14 A 4.0619 7.7171 121.0956 55.1577 18.3614 179.6551 15 L 3.5797 7.5224 117.4998 57.7534 41.3659 179.0805 16 Y 4.2480 7.5756 119.3384 60.8830 38.5658 178.3334 17 L 3.7697 7.8169 118.4270 57.5690 41.7982 179.4599 18 V 3.7388 7.7466 117.4712 66.2883 31.9541 177.7430 19 C 4.3046 8.5365 116.6174 60.8731 28.5100 175.0188 20 G 3.6619 8.2420 110.2175 46.6062 0.0000 175.8193 21 E 4.2511 8.7869 122.2805 57.9828 29.6240 178.0754 22 R 3.9294 7.8573 118.3614 57.0229 30.3219 177.6615 23 G 3.9374 9.4970 105.2198 45.2910 0.0000 171.2506 24 F 4.8970 7.4622 112.4072 56.1135 40.1638 172.8781 25 F 4.9840 8.3874 114.9308 55.0252 40.2040 173.5814 26 Y 4.8427 8.9536 124.2433 56.3582 40.0861 175.2935 27 T 4.3227 8.0143 123.8367 60.6512 69.8147 172.0000 28 P 4.1119 0.0000 0.0000 65.1790 31.6892 178.4219 29 K 4.2317 7.4667 118.5054 54.7503 30.6142 176.6267 30 A 4.1605 7.8503 124.4720 52.2111 18.3096 177.8724 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 5.02 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 2 V 7.50 3.44 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 -0.18 0.00 0.00 3 N 7.51 4.62 0.00 2.72 2.73 0.00 0.00 6.71 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 7.01 4.39 0.00 2.12 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.38 7.00 0.00 0.00 0.00 0.00 0.00 2.18 2.34 0.00 5 H 8.71 4.37 0.00 3.18 3.30 0.00 5.65 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 L 8.48 4.72 0.00 1.56 1.55 0.86 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 7 C 8.13 4.96 0.00 2.90 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 8.45 3.79 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 S 8.63 4.13 0.00 4.01 4.14 0.00 0.00 0.00 0.00 0.00 0.00 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 8.28 4.23 0.00 3.38 3.37 0.00 5.63 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 7.67 3.89 0.00 1.86 1.75 0.86 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 12 V 7.56 3.24 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.28 0.00 0.00 13 E 8.29 4.06 0.00 2.08 2.04 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 2.30 2.56 0.00 14 A 7.72 4.06 1.24 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 0.00 0.00 0.00 0.00 0.00 0.00 15 L 7.52 3.58 0.00 0.92 0.20 0.71 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 7.58 4.25 0.00 3.15 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 17 L 7.82 3.77 0.00 1.86 1.84 0.99 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.75 3.74 2.05 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 0.76 0.00 0.00 0.81 0.00 0.00 19 C 8.54 4.30 0.00 3.23 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 8.24 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.79 4.25 0.00 1.98 2.04 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 2.31 2.28 0.00 22 R 7.86 3.93 0.00 2.08 2.05 0.00 3.24 0.00 0.00 3.25 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.60 0.00 23 G 9.50 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 7.46 4.90 0.00 3.05 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 25 F 8.39 4.98 0.00 3.17 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.95 4.84 0.00 3.11 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 27 T 8.01 4.32 4.28 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 1.23 0.00 0.00 28 P 0.00 4.11 0.00 1.90 1.99 0.00 3.40 0.00 0.00 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.98 0.00 29 K 7.47 4.23 0.00 1.68 1.74 0.00 1.61 0.00 0.00 1.68 0.00 0.00 3.07 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.38 1.46 7.81 30 A 7.85 4.16 1.24 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 0.00 0.00 0.00 0.00 0.00 0.00