NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 50 P 4.1654 0.0000 0.0000 62.4081 32.9798 176.0491 51 T 4.2597 7.6127 108.6667 61.8808 69.8754 172.0055 52 Y 4.9101 9.3334 120.9420 55.7510 42.1490 176.3625 53 K 4.5315 8.7738 123.0407 56.8045 33.0247 177.3766 54 C 4.7721 8.8081 123.5081 55.9736 39.4959 171.9132 55 P 4.5737 0.0000 0.0000 62.2056 32.0684 177.1159 56 E 3.9500 9.1472 121.2014 60.4093 29.2389 179.7373 57 T 4.1498 7.9969 114.7723 66.3894 68.4964 176.7973 58 F 3.8227 8.2837 119.4198 60.4991 38.8041 176.8060 59 D 4.3810 8.4381 116.4622 57.5398 41.0694 178.0031 60 A 3.8549 8.2867 120.3343 53.9883 18.4453 178.1224 61 W 4.7893 8.1357 114.2615 56.9670 31.6378 176.7170 62 Y 4.3222 8.4960 119.6309 60.5335 38.4276 174.8121 63 C 4.3116 7.9965 115.8838 55.8679 42.5383 173.4870 64 L 4.3994 8.4258 124.4389 53.5539 43.2688 175.6062 65 N 4.0314 8.8957 113.6510 54.8791 35.6231 174.5817 66 D 4.3075 8.2562 111.4344 55.1098 38.7790 174.2394 67 A 4.3655 7.6967 120.2637 52.3993 19.5787 177.1067 68 H 4.8937 8.9621 119.4825 54.7159 31.7314 173.2771 69 C 5.2807 8.8067 126.3465 56.5580 45.7058 172.1430 70 F 5.3029 8.8146 118.6981 55.9602 41.6332 172.5212 71 A 5.0067 9.5010 121.2868 50.0814 22.2855 175.1674 72 V 4.6435 8.6182 121.1439 60.9373 34.4665 174.5430 73 K 4.5353 8.8823 129.2819 55.9323 32.0362 175.6546 74 I 4.1287 8.0928 127.4037 62.7750 38.6120 176.9302 75 A 4.5774 6.9985 121.2155 50.6418 18.5297 176.7172 76 D 4.6792 8.1419 119.3630 53.7744 40.8928 174.6885 77 L 4.6258 7.3425 119.2410 51.8776 43.5725 173.9865 78 P 4.4565 0.0000 0.0000 62.6860 32.4448 175.5694 79 V 4.0401 8.6861 122.7754 61.3954 33.2327 174.4126 80 Y 4.7559 8.1100 125.6053 57.8762 39.1763 174.6510 81 S 4.7067 8.6247 115.7199 57.3911 66.7597 171.8475 82 C 5.5797 8.6544 120.5523 55.0847 43.9017 173.3316 83 E 4.5670 9.8141 126.3967 55.4422 30.0297 174.9655 84 C 4.8997 8.9088 125.0517 56.5223 39.0915 174.0414 85 A 4.3490 8.6913 125.2372 51.6939 18.8502 177.0119 86 I 3.7728 8.2116 120.7152 63.2325 37.5570 176.8916 87 G 3.7504 9.2636 112.3034 45.0163 0.0000 172.6055 88 F 5.4988 7.4435 116.7434 56.0719 42.5644 173.6469 89 M 4.6544 9.3535 118.6313 54.8343 34.2056 174.3467 90 G 4.3115 8.9450 105.0381 44.6327 0.0000 174.3104 91 Q 3.9849 8.7318 119.4138 58.8686 28.9463 177.8196 92 R 4.1601 8.3676 114.4602 55.5458 30.4369 175.4923 93 C 4.4190 7.9983 113.7168 58.0879 37.9700 174.6345 94 E 3.6836 8.1268 119.5243 58.4881 29.8898 176.1253 95 Y 4.9238 7.6180 117.2751 56.4483 40.0619 175.4282 96 K 4.6149 8.7754 122.3108 56.0061 33.4249 176.8652 97 E 4.2325 8.7055 122.8399 56.7000 29.0527 176.7693 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 50 P 0.00 4.17 0.00 2.15 2.15 0.00 3.68 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.94 0.00 51 T 7.61 4.26 4.36 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 1.21 0.00 0.00 52 Y 9.33 4.91 0.00 2.84 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 K 8.77 4.53 0.00 1.87 1.82 0.00 1.84 0.00 0.00 1.77 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.50 1.56 7.81 54 C 8.81 4.77 0.00 3.01 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 P 0.00 4.57 0.00 2.34 2.03 0.00 3.53 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.08 0.00 56 E 9.15 3.95 0.00 2.06 2.03 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 2.43 2.46 0.00 57 T 8.00 4.15 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 58 F 8.28 3.82 0.00 3.10 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 D 8.44 4.38 0.00 2.85 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 60 A 8.29 3.85 0.96 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 0.00 0.00 61 W 8.14 4.79 0.00 3.25 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 Y 8.50 4.32 0.00 2.73 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 63 C 8.00 4.31 0.00 2.99 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 L 8.43 4.40 0.00 1.58 1.40 0.77 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 65 N 8.90 4.03 0.00 1.94 1.42 0.00 0.00 6.92 8.06 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 66 D 8.26 4.31 0.00 2.77 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 A 7.70 4.37 1.28 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 0.00 0.00 68 H 8.96 4.89 0.00 3.32 3.29 0.00 5.78 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 C 8.81 5.28 0.00 3.15 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 70 F 8.81 5.30 0.00 3.30 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 A 9.50 5.01 1.04 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 0.00 0.00 0.00 0.00 0.00 72 V 8.62 4.64 2.10 0.00 0.00 0.00 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 1.14 0.00 0.00 73 K 8.88 4.54 0.00 1.96 1.81 0.00 1.80 0.00 0.00 1.61 0.00 0.00 2.56 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.32 1.33 7.81 74 I 8.09 4.13 1.85 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.72 0.91 0.00 0.00 75 A 7.00 4.58 1.20 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 0.00 0.00 76 D 8.14 4.68 0.00 2.83 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 L 7.34 4.63 0.00 1.64 1.45 0.89 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 78 P 0.00 4.46 0.00 1.18 1.66 0.00 3.55 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.67 0.00 79 V 8.69 4.04 1.97 0.00 0.00 0.00 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 0.85 0.00 0.00 80 Y 8.11 4.76 0.00 2.68 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 S 8.62 4.71 0.00 3.60 2.63 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 82 C 8.65 5.58 0.00 2.84 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 83 E 9.81 4.57 0.00 2.24 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 2.28 2.39 0.00 84 C 8.91 4.90 0.00 3.02 3.18 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 0.00 0.00 0.00 0.00 85 A 8.69 4.35 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 I 8.21 3.77 1.90 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.61 0.90 0.00 0.00 87 G 9.26 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 F 7.44 5.50 0.00 3.05 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 89 M 9.35 4.65 0.00 2.22 2.22 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.74 0.00 90 G 8.95 4.31 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 0.00 0.00 0.00 91 Q 8.73 3.98 0.00 2.09 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.26 0.00 0.00 0.00 0.00 0.00 2.37 2.53 0.00 92 R 8.37 4.16 0.00 1.63 1.63 0.00 3.21 0.00 0.00 3.01 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 1.22 0.00 93 C 8.00 4.42 0.00 3.00 3.14 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 94 E 8.13 3.68 0.00 1.69 1.77 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 1.47 1.47 0.00 95 Y 7.62 4.92 0.00 3.20 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 K 8.78 4.61 0.00 1.69 1.67 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.71 0.00 0.00 2.17 0.00 0.00 0.00 0.00 1.38 1.56 7.81 97 E 8.71 4.23 0.00 1.88 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.29 0.00