NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3876 8.2644 123.5846 52.1798 19.0670 175.3355 3 R 4.2198 7.9809 118.2834 55.2557 33.2516 174.8558 4 K 4.1668 8.2274 119.8837 58.5585 33.4993 177.5829 5 A 4.0056 7.9948 120.7476 55.2373 17.6925 179.2773 6 L 4.1666 7.8714 117.0636 57.3646 41.9373 178.9192 7 I 3.8134 7.7210 111.7222 62.9997 37.6687 177.3901 8 E 4.1760 7.9610 121.1845 58.6524 29.7982 177.4941 9 K 4.1233 7.8297 117.0029 58.3089 32.2384 177.6509 10 A 4.0508 7.4093 119.2785 54.8450 18.9878 179.1833 11 K 4.0562 7.7601 115.9913 58.4612 33.1418 178.0867 12 R 4.3238 8.1773 119.2276 59.5877 29.3514 178.1376 13 T 3.8705 7.5800 116.4210 66.5557 69.4258 172.7060 14 P 3.9781 0.0000 0.0000 61.3385 33.0249 175.2689 15 K 3.5538 7.4242 118.3279 57.0020 31.2933 177.8201 16 F 3.8832 5.9480 118.0287 56.9782 35.9796 176.8105 17 K 4.0879 8.7853 125.7581 60.1229 32.4202 179.3875 18 V 3.7277 7.8833 111.4632 64.1418 31.5389 177.0907 19 R 4.2051 8.6273 116.4109 56.7380 29.8737 176.6460 20 A 4.4906 7.8118 121.8879 52.3314 19.1317 176.7010 21 Y 4.7033 7.8036 114.7143 56.0698 39.9823 174.1913 22 T 3.8917 8.6422 112.5137 62.0513 69.2184 173.8633 23 R 4.3839 8.3072 114.8837 56.3249 31.0620 172.0984 24 C 3.7655 7.7678 125.0882 58.3992 31.0509 174.4464 25 V 3.5343 8.8626 129.9637 65.5087 31.1433 176.4714 26 R 3.9950 7.4796 114.5929 57.1294 29.6296 175.9147 27 C 4.1591 8.3364 121.3892 57.5673 29.4723 175.3113 28 G 3.9032 8.6873 113.7341 46.0808 0.0000 171.6694 29 R 3.9019 9.3247 120.4344 56.2947 30.7917 176.0599 30 A 4.4975 8.5439 120.7199 53.5744 20.7075 177.5515 31 R 4.2278 7.8276 110.0663 56.1072 31.4840 176.1151 32 S 3.5810 8.4332 112.5159 59.9057 60.0252 172.3678 33 V 5.3280 7.0853 109.9290 58.5239 34.6895 175.9082 34 Y 4.3610 8.9395 122.8341 57.6715 38.6142 177.0868 35 R 4.0816 8.6706 122.1370 58.6292 30.4845 177.2727 36 F 4.4037 8.3126 117.7267 58.4057 39.2075 175.5669 37 F 4.6715 7.8850 116.0614 57.2258 41.7609 176.4908 38 G 3.8577 8.5037 107.6071 45.5134 0.0000 172.5933 39 L 4.8274 7.5136 120.5894 52.7502 44.5682 174.6099 40 C 5.5731 8.0846 113.2222 55.7756 32.3553 174.9286 41 R 4.0640 9.0238 117.6980 59.1163 27.6245 178.4249 42 I 4.1007 7.5665 119.5665 63.7901 37.8674 177.1216 43 C 4.0860 7.9874 118.1693 62.3998 27.9977 175.3791 44 L 3.5233 7.9893 121.0898 58.8073 41.6358 179.0433 45 R 3.9870 7.5617 118.3434 59.5192 29.7144 178.4869 46 E 3.8316 8.3026 118.6874 59.5006 29.6766 179.3682 47 L 3.9735 7.8038 117.9659 57.2178 41.4333 179.3866 48 A 3.9241 8.1148 120.7699 55.6779 18.4827 179.1431 49 H 4.2430 7.9451 112.6524 58.8550 28.8279 177.9361 50 K 4.1798 7.8293 118.7567 57.4467 32.3864 178.3333 51 G 3.9748 8.0534 107.5186 45.3397 0.0000 174.8039 52 Q 4.1440 7.8841 116.0359 56.7377 28.5105 175.7376 53 L 4.5540 7.4179 118.8420 51.9601 42.5218 174.4908 54 P 4.0715 0.0000 0.0000 63.6740 31.8548 177.1657 55 G 3.9403 8.8060 114.1421 46.5513 0.0000 173.5395 56 V 4.4291 7.4637 114.9721 61.0178 34.6027 174.2124 57 R 4.5690 8.3226 125.9965 53.7575 33.1639 173.7461 58 K 3.6948 8.8392 122.6176 56.3594 31.7420 176.3719 59 A 4.3256 8.5919 126.7006 51.6952 19.0659 176.1302 60 S 5.0624 8.4494 116.0479 57.3330 64.5916 176.9079 61 W 3.8248 8.5092 122.3510 57.4527 27.2325 174.2322 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 2 A 8.26 4.39 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.98 4.22 0.00 1.81 1.89 0.00 3.24 0.00 0.00 3.20 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.69 0.00 4 K 8.23 4.17 0.00 1.91 1.74 0.00 1.70 0.00 0.00 1.83 0.00 0.00 3.07 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.47 1.56 7.81 5 A 7.99 4.01 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.87 4.17 0.00 1.75 1.80 1.01 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 7 I 7.72 3.81 1.86 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 1.68 0.52 0.96 0.00 0.00 8 E 7.96 4.18 0.00 2.25 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 2.34 2.41 0.00 9 K 7.83 4.12 0.00 2.05 1.93 0.00 1.88 0.00 0.00 1.75 0.00 0.00 3.15 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.53 1.50 7.81 10 A 7.41 4.05 0.94 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 11 K 7.76 4.06 0.00 1.88 1.85 0.00 1.86 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.42 1.42 7.81 12 R 8.18 4.32 0.00 1.81 1.92 0.00 3.24 0.00 0.00 3.41 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 13 T 7.58 3.87 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 1.20 0.00 0.00 14 P 0.00 3.98 0.00 2.08 1.91 0.00 3.64 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.13 0.00 15 K 7.42 3.55 0.00 1.82 1.68 0.00 0.94 0.00 0.00 0.87 0.00 0.00 2.90 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.11 1.27 7.81 16 F 5.95 3.88 0.00 3.19 3.11 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.79 4.09 0.00 1.97 2.14 0.00 1.54 0.00 0.00 1.85 0.00 0.00 3.11 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.57 1.57 7.81 18 V 7.88 3.73 2.12 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 0.76 0.00 0.00 1.06 0.00 0.00 19 R 8.63 4.21 0.00 2.00 2.09 0.00 3.40 0.00 0.00 3.35 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.77 0.00 20 A 7.81 4.49 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 21 Y 7.80 4.70 0.00 3.07 2.81 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 0.00 0.00 0.00 0.00 22 T 8.64 3.89 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 1.24 0.00 0.00 23 R 8.31 4.38 0.00 1.52 1.72 0.00 3.40 0.00 0.00 3.30 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.46 0.00 24 C 7.77 3.77 0.00 3.06 3.05 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 25 V 8.86 3.53 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.95 0.00 0.00 26 R 7.48 4.00 0.00 1.95 1.82 0.00 3.08 0.00 0.00 3.27 7.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.00 27 C 8.34 4.16 0.00 3.14 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 28 G 8.69 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 29 R 9.32 3.90 0.00 1.93 1.95 0.00 3.13 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.86 0.00 30 A 8.54 4.50 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 R 7.83 4.23 0.00 1.95 1.95 0.00 3.20 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 32 S 8.43 3.58 0.00 4.05 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 33 V 7.09 5.33 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 1.00 0.00 0.00 34 Y 8.94 4.36 0.00 3.37 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 35 R 8.67 4.08 0.00 1.89 2.05 0.00 3.22 0.00 0.00 3.19 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.66 0.00 36 F 8.31 4.40 0.00 2.91 2.88 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 37 F 7.89 4.67 0.00 3.19 2.92 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.50 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 39 L 7.51 4.83 0.00 1.93 1.64 0.68 0.71 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 40 C 8.08 5.57 0.00 3.23 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 41 R 9.02 4.06 0.00 2.06 2.32 0.00 3.14 0.00 0.00 3.28 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.79 0.00 42 I 7.57 4.10 1.88 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 1.65 0.90 0.90 0.00 0.00 43 C 7.99 4.09 0.00 3.04 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 44 L 7.99 3.52 0.00 1.29 1.76 0.50 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 45 R 7.56 3.99 0.00 2.04 2.00 0.00 3.16 0.00 0.00 3.14 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.68 0.00 46 E 8.30 3.83 0.00 2.15 1.93 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 2.27 2.51 0.00 47 L 7.80 3.97 0.00 1.58 1.67 0.88 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 48 A 8.11 3.92 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 H 7.95 4.24 0.00 3.21 3.39 0.00 5.85 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 K 7.83 4.18 0.00 1.74 1.87 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.68 7.81 51 G 8.05 3.97 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 0.00 0.00 0.00 52 Q 7.88 4.14 0.00 2.04 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.78 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 53 L 7.42 4.55 0.00 1.63 1.67 0.67 0.87 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 54 P 0.00 4.07 0.00 2.09 2.07 0.00 3.91 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.13 0.00 55 G 8.81 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 56 V 7.46 4.43 2.12 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 0.90 0.00 0.00 1.18 0.00 0.00 57 R 8.32 4.57 0.00 1.76 1.74 0.00 3.35 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 1.52 1.63 0.00 58 K 8.84 3.69 0.00 1.78 1.84 0.00 1.81 0.00 0.00 1.69 0.00 0.00 2.74 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.39 7.81 59 A 8.59 4.33 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.45 5.06 0.00 3.94 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 61 W 8.51 3.82 0.00 3.49 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