NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 90 K 4.1941 8.3149 121.7822 55.8568 34.2392 175.9376 91 Y 4.5934 7.7375 113.8300 58.6866 40.2071 174.3710 92 W 4.2387 9.0459 119.4265 58.4699 30.3496 175.1076 93 D 4.3940 9.0088 120.9558 55.2244 37.8957 173.8859 94 V 4.0081 7.3542 119.8225 60.7465 30.8696 174.1288 95 P 4.4444 0.0000 0.0000 61.4174 32.3447 174.5876 96 P 4.2976 0.0000 0.0000 61.5754 31.8257 174.4336 97 P 4.4100 0.0000 0.0000 64.7904 31.4418 176.9009 98 G 3.8569 9.2374 111.4720 45.3922 0.0000 173.3482 99 F 4.8122 8.2281 118.2962 57.0062 39.5652 177.2443 100 E 4.0242 8.3170 120.4679 58.9750 29.5209 177.0004 101 H 4.7491 8.0446 115.2749 55.6088 29.0898 174.1709 102 I 4.7518 7.3933 113.0050 58.5389 40.7081 175.5346 103 T 4.4460 8.6773 111.6638 60.3412 71.3014 174.0399 104 P 4.3023 0.0000 0.0000 66.1736 31.3402 178.9394 105 M 4.1914 8.0393 117.0457 58.5199 31.7142 178.6584 106 Q 4.1071 7.9511 117.1559 58.6826 29.1882 177.8660 107 Y 4.1024 8.0792 120.8575 60.7294 38.9246 177.8679 108 K 3.9814 8.7100 119.6332 59.4044 31.8782 179.0777 109 A 3.9956 7.8794 120.2957 55.0896 18.3203 178.7931 110 M 4.1423 7.6074 114.9223 55.5616 32.7441 176.8507 111 Q 4.0388 7.3790 118.9726 55.6878 29.6173 176.0137 112 A 4.1276 8.1797 123.6578 52.7198 19.0741 175.9556 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 90 K 8.31 4.19 0.00 1.54 1.53 0.00 1.44 0.00 0.00 1.19 0.00 0.00 2.54 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.45 1.18 7.81 91 Y 7.74 4.59 0.00 2.86 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 W 9.05 4.24 0.00 3.34 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 D 9.01 4.39 0.00 2.93 2.82 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 94 V 7.35 4.01 2.18 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 0.80 0.00 0.00 1.06 0.00 0.00 95 P 0.00 4.44 0.00 2.22 2.02 0.00 3.83 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 96 P 0.00 4.30 0.00 2.03 1.81 0.00 3.41 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 1.60 0.00 97 P 0.00 4.41 0.00 2.12 2.07 0.00 3.75 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.14 0.00 98 G 9.24 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 F 8.23 4.81 0.00 3.07 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 0.00 100 E 8.32 4.02 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 2.12 1.83 0.00 101 H 8.04 4.75 0.00 3.18 3.37 0.00 5.64 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 I 7.39 4.75 2.14 0.00 0.00 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 1.78 0.87 1.04 0.00 0.00 103 T 8.68 4.45 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 1.29 0.00 0.00 104 P 0.00 4.30 0.00 2.21 2.15 0.00 3.63 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.18 0.00 105 M 8.04 4.19 0.00 2.05 2.15 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.60 0.00 106 Q 7.95 4.11 0.00 2.29 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.97 0.00 0.00 0.00 0.00 0.00 2.44 2.41 0.00 107 Y 8.08 4.10 0.00 3.06 3.07 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 0.00 108 K 8.71 3.98 0.00 1.84 1.87 0.00 1.75 0.00 0.00 1.68 0.00 0.00 3.05 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.70 7.81 109 A 7.88 4.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 M 7.61 4.14 0.00 1.89 1.97 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.52 0.00 111 Q 7.38 4.04 0.00 2.10 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.69 0.00 0.00 0.00 0.00 0.00 2.18 2.27 0.00 112 A 8.18 4.13 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00