NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8992 8.3393 109.7376 45.3188 0.0000 171.6590 2 S 4.4758 7.9026 114.7390 54.9684 64.8895 173.5983 3 S 4.5768 8.6180 120.3030 57.0910 65.5497 175.7705 4 G 3.7923 8.1468 110.3554 45.0242 0.0000 173.0350 5 S 4.4991 8.4525 121.7417 55.8227 63.6676 173.2186 6 S 4.8174 8.4676 120.6446 56.6289 65.8950 172.5907 7 G 4.1231 7.9555 112.0684 44.9205 0.0000 176.7859 8 T 4.1170 8.7181 117.2800 61.9352 69.7599 172.6188 9 G 3.8802 9.0513 117.3681 45.1757 0.0000 172.4361 10 E 3.8943 8.6088 125.0492 56.1778 29.5647 176.5089 11 K 4.1757 8.4423 126.5800 55.4187 32.8535 176.2199 12 P 4.2843 0.0000 0.0000 64.0082 31.3869 175.6018 13 Y 5.0546 7.5138 116.6654 56.4787 42.2454 174.3540 14 K 4.9268 8.5926 123.2257 55.0232 35.3667 174.8506 15 C 4.2469 9.3493 128.4559 58.8091 32.3811 173.7793 16 S 5.1236 8.4332 125.0128 58.9281 62.2810 173.9724 17 D 4.6745 8.2145 118.2617 55.6279 43.8192 176.3251 18 C 4.5172 8.4137 110.1504 61.0658 31.4952 174.2721 19 G 4.0481 6.8233 108.1414 45.7235 0.0000 173.3137 20 K 4.6675 8.1952 119.4949 54.4676 36.0423 175.1973 21 S 5.4121 8.4198 121.3235 57.2708 64.7483 173.5223 22 F 4.7761 8.6944 121.7891 56.1439 41.2459 175.5430 23 T 3.9902 9.0787 120.7525 65.8869 68.3731 175.3510 24 W 4.9550 7.9925 120.6572 54.8465 32.1885 177.1725 25 K 2.9897 8.5765 123.8400 59.4167 31.6549 179.1552 26 S 4.0671 8.1643 114.9789 61.8230 62.7516 176.6757 27 R 3.9444 8.1192 119.8517 59.3490 29.8980 178.2038 28 L 2.9305 7.4022 118.9826 58.2028 41.7178 178.9471 29 R 3.7996 7.5571 117.2726 59.5750 30.0713 178.8894 30 I 3.6944 7.4375 118.8762 64.5838 37.2213 177.8229 31 H 4.0893 8.2472 118.8748 59.6287 29.4708 176.6882 32 Q 3.9681 8.1150 118.6661 59.4430 28.7703 179.5920 33 K 4.0625 7.9002 119.2151 60.0171 32.3277 178.2775 34 C 3.8546 7.8408 119.1764 63.0610 31.3814 174.9818 35 H 4.0124 7.5468 115.3835 58.5903 28.7951 175.1660 36 T 3.9612 7.1442 115.1584 62.5944 67.9080 174.9900 37 G 4.0139 8.8311 116.7958 46.4263 0.0000 173.0868 38 E 4.3678 8.3446 127.9037 53.8773 28.4414 174.4159 39 R 4.4271 7.8298 123.3606 55.1690 29.9762 174.7740 40 H 3.9675 8.3473 123.0040 55.7738 26.8065 175.6019 41 S 4.4018 8.0431 112.4035 56.9944 63.6642 171.4800 42 G 4.0202 7.9593 115.2142 46.1264 0.0000 170.1946 43 P 4.3910 0.0000 0.0000 61.8772 32.4929 176.4682 44 S 4.6828 8.2116 116.2287 57.3829 64.8336 174.6799 45 S 4.3062 8.6416 116.1791 60.5382 62.5617 174.2166 46 G 3.7278 7.6929 111.8135 45.7352 0.0000 171.9534 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 G 8.34 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.90 4.48 0.00 4.05 3.87 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 3 S 8.62 4.58 0.00 3.99 3.90 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.15 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 5 S 8.45 4.50 0.00 3.90 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 S 8.47 4.82 0.00 3.95 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 G 7.96 4.12 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 0.00 0.00 0.00 8 T 8.72 4.12 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 9 G 9.05 3.88 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 E 8.61 3.89 0.00 1.91 1.86 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 2.27 2.26 0.00 11 K 8.44 4.18 0.00 1.93 1.88 0.00 1.76 0.00 0.00 1.85 0.00 0.00 3.00 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.65 1.45 7.81 12 P 0.00 4.28 0.00 1.20 1.79 0.00 3.54 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 1.62 0.00 13 Y 7.51 5.05 0.00 3.16 2.79 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 14 K 8.59 4.93 0.00 1.79 1.70 0.00 1.82 0.00 0.00 1.68 0.00 0.00 2.77 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.52 7.81 15 C 9.35 4.25 0.00 3.23 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 16 S 8.43 5.12 0.00 3.90 3.84 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.21 4.67 0.00 2.65 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 C 8.41 4.52 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 19 G 6.82 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 20 K 8.20 4.67 0.00 1.79 1.75 0.00 1.50 0.00 0.00 1.30 0.00 0.00 2.20 0.00 0.00 2.59 0.00 0.00 0.00 0.00 0.45 1.10 7.81 21 S 8.42 5.41 0.00 3.74 3.77 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 22 F 8.69 4.78 0.00 2.86 3.04 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 23 T 9.08 3.99 4.18 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 0.82 0.00 0.00 24 W 7.99 4.96 0.00 3.45 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 25 K 8.58 2.99 0.00 1.09 1.61 0.00 1.76 0.00 0.00 1.77 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.20 0.69 7.81 26 S 8.16 4.07 0.00 3.86 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 27 R 8.12 3.94 0.00 2.22 2.23 0.00 3.39 0.00 0.00 3.37 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.92 0.00 28 L 7.40 2.93 0.00 1.26 1.57 0.11 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 29 R 7.56 3.80 0.00 2.07 1.94 0.00 3.10 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.59 0.00 30 I 7.44 3.69 2.05 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.80 0.92 0.00 0.00 31 H 8.25 4.09 0.00 3.47 3.32 0.00 5.82 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 32 Q 8.11 3.97 0.00 2.17 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.71 0.00 0.00 0.00 0.00 0.00 2.38 2.41 0.00 33 K 7.90 4.06 0.00 1.94 2.05 0.00 1.33 0.00 0.00 1.56 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.58 1.47 7.81 34 C 7.84 3.85 0.00 3.12 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 35 H 7.55 4.01 0.00 3.35 3.34 0.00 5.70 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.14 3.96 4.25 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 1.30 0.00 0.00 37 G 8.83 4.01 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 0.00 0.00 0.00 38 E 8.34 4.37 0.00 1.90 1.87 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 2.20 2.31 0.00 39 R 7.83 4.43 0.00 1.76 1.81 0.00 3.52 0.00 0.00 3.26 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.71 0.00 40 H 8.35 3.97 0.00 3.26 3.33 0.00 5.91 0.00 0.00 0.00 0.00 8.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 S 8.04 4.40 0.00 3.88 3.71 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 42 G 7.96 4.02 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 0.00 0.00 0.00 43 P 0.00 4.39 0.00 2.20 2.07 0.00 3.76 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 44 S 8.21 4.68 0.00 3.89 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 S 8.64 4.31 0.00 3.83 3.88 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 0.00 0.00 0.00 0.00 46 G 7.69 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00