NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 F 4.8603 8.1827 119.3736 57.2240 40.2497 175.3280 2 V 3.5381 8.5273 126.1894 64.0020 31.3410 176.0506 3 N 4.3376 8.4954 116.7681 56.2553 37.4670 176.3952 4 Q 3.9832 8.1890 121.6525 58.8548 29.3069 177.3160 5 H 4.2141 8.2822 119.3379 59.4337 29.7719 177.3108 6 L 4.0060 8.3481 121.0328 57.6668 41.3891 178.7740 7 C 4.1499 8.4345 119.0862 62.7019 31.4453 175.9586 8 G 3.6276 8.5769 107.5161 47.7652 0.0000 175.3852 9 S 3.9290 7.8089 114.8200 61.7230 62.3977 176.1645 10 H 4.1671 8.0207 118.6894 58.5198 28.3236 177.7736 11 L 3.9600 8.0977 121.2853 57.8110 41.3888 179.6747 12 V 3.2779 7.7204 118.2519 65.7594 31.3804 177.6728 13 E 3.9001 7.8638 118.9095 59.2290 29.4185 178.6814 14 A 3.9733 8.0315 120.7682 55.1326 18.4196 179.6116 15 L 3.6730 7.9105 117.7679 57.8772 41.3060 178.9890 16 Y 4.3334 7.7492 118.7421 60.6647 38.7825 177.8432 17 L 3.9820 7.7336 119.9984 58.3480 41.0441 179.0200 18 V 3.8484 8.0049 112.0539 63.6793 31.4596 177.7790 19 C 4.1271 8.2528 115.0207 60.1270 29.0730 176.0684 20 G 3.6170 7.7879 109.7409 46.9501 0.0000 176.5123 21 E 4.1733 8.8174 120.9666 58.4898 29.8271 178.0387 22 R 3.9017 8.1376 114.7255 57.0535 29.6635 177.9856 23 G 4.0528 8.0055 106.0666 45.5546 0.0000 172.0496 24 F 4.9769 8.0572 111.5138 56.2188 40.2742 172.8815 25 F 5.0372 8.9662 120.0841 55.9178 40.8522 174.6688 26 Y 4.8378 8.7758 125.5115 56.1443 40.7945 173.6014 27 T 4.3259 7.2153 114.8741 63.8102 70.7249 172.0282 28 P 4.3129 0.0000 0.0000 60.6770 30.6657 175.3915 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 8.18 4.86 0.00 3.16 3.24 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 2 V 8.53 3.54 2.14 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 1.21 0.00 0.00 0.95 0.00 0.00 3 N 8.50 4.34 0.00 2.98 3.11 0.00 0.00 5.90 7.81 0.00 0.00 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 8.19 3.98 0.00 2.24 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.93 0.00 0.00 0.00 0.00 0.00 2.56 2.51 0.00 5 H 8.28 4.21 0.00 3.48 3.53 0.00 5.83 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 6 L 8.35 4.01 0.00 1.76 1.74 0.96 1.01 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 7 C 8.43 4.15 0.00 3.06 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 8 G 8.58 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.81 3.93 0.00 3.78 3.96 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 10 H 8.02 4.17 0.00 3.28 3.31 0.00 5.68 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 L 8.10 3.96 0.00 1.82 1.76 1.06 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 12 V 7.72 3.28 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 1.18 0.00 0.00 0.45 0.00 0.00 13 E 7.86 3.90 0.00 1.98 2.08 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 2.33 2.33 0.00 14 A 8.03 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 7.91 3.67 0.00 0.64 0.56 0.83 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 16 Y 7.75 4.33 0.00 3.16 3.25 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 17 L 7.73 3.98 0.00 1.73 1.88 0.92 1.09 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 18 V 8.00 3.85 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 0.84 0.00 0.00 0.95 0.00 0.00 19 C 8.25 4.13 0.00 3.21 3.25 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 20 G 7.79 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.82 4.17 0.00 1.97 2.02 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 2.30 2.27 0.00 22 R 8.14 3.90 0.00 1.95 2.10 0.00 3.18 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.93 0.00 23 G 8.01 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 0.00 0.00 0.00 24 F 8.06 4.98 0.00 3.22 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 25 F 8.97 5.04 0.00 2.93 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 26 Y 8.78 4.84 0.00 3.25 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 27 T 7.22 4.33 4.24 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 1.33 0.00 0.00 28 P 0.00 4.31 0.00 2.06 2.04 0.00 2.73 0.00 0.00 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.78 0.00