NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.0002 8.0549 114.0527 61.4680 32.7417 174.5083 2 T 4.0793 8.4372 122.4665 60.2686 69.0575 172.6898 3 S 4.7928 8.9250 122.0913 56.3737 66.6570 172.7231 4 Y 4.7482 8.3963 118.6596 56.4732 41.1106 174.8882 5 T 4.7136 8.5293 117.6730 60.0146 70.4382 172.6078 6 L 4.8331 8.4253 128.3362 53.2237 45.1436 175.0994 7 N 5.1318 8.5791 122.0081 51.6012 41.5942 173.4172 8 E 4.6313 8.2206 120.6400 54.6833 32.6739 174.6697 9 V 3.6888 8.3401 125.2019 62.6104 31.9049 175.3544 10 V 4.3040 8.2576 127.2138 60.4737 33.2412 173.8770 11 P 4.5972 0.0000 0.0000 61.1179 30.3221 176.2333 12 L 3.9504 8.3878 127.3885 58.8650 41.6266 178.5696 13 K 3.8240 8.1124 116.1130 59.4268 32.0318 177.8105 14 D 4.6956 8.0035 116.0468 54.2828 41.3236 176.8700 15 V 4.1365 7.6554 117.7864 63.9485 33.0486 175.9528 16 V 4.3920 7.3180 110.0560 58.6969 33.7894 173.5835 17 P 4.6342 0.0000 0.0000 61.9254 32.1097 176.8105 18 E 4.0127 8.8356 118.8017 58.5655 29.4833 177.8804 19 W 4.7531 7.9905 116.7501 54.9037 31.3751 175.4305 20 V 4.6452 8.2170 113.8994 59.9114 35.2828 174.6979 21 R 4.6516 8.4356 120.4429 54.4432 32.1399 175.9039 22 I 4.3582 7.6944 114.5877 59.1377 39.7024 175.4211 23 G 3.6943 7.1721 108.5270 45.9245 0.0000 171.9890 24 F 4.9929 8.3042 116.5205 55.6517 42.2911 174.6911 25 S 4.6678 8.4224 115.3926 56.7880 65.3902 173.0206 26 A 4.7932 8.2653 127.7376 50.9638 22.0898 175.3241 27 T 4.7465 8.1635 108.7872 60.1738 71.9688 173.1791 28 T 4.8743 8.3799 111.9710 60.0515 72.5464 175.3481 29 G 4.1638 8.5340 113.1772 45.4264 0.0000 175.3129 30 A 4.2003 8.9685 126.7058 54.0333 18.7523 177.8870 31 E 4.3169 7.8526 114.6448 55.2737 31.2904 174.8407 32 F 5.1014 7.1668 113.8990 56.3814 40.5449 173.0355 33 A 4.5208 8.2289 121.5136 51.6030 21.4839 175.7507 34 A 4.4973 8.5047 123.0239 51.1853 20.0031 177.2641 35 Q 4.5790 8.3557 120.4785 53.9293 31.6460 174.8516 36 E 4.6477 8.2866 119.0192 55.0646 32.2168 174.4762 37 V 4.2082 8.0869 119.8159 61.5547 33.9733 174.9030 38 H 4.7777 8.7322 123.2274 56.7587 30.0430 174.9028 39 S 4.7752 7.6641 110.8976 57.2719 65.2777 173.5530 40 W 5.4788 8.5112 130.7114 56.4515 33.4375 173.8782 41 S 4.7427 8.8715 118.7634 56.9867 65.7889 172.9765 42 F 4.6883 8.2088 121.4594 57.1689 42.0135 172.7950 43 N 4.7976 7.8285 125.4318 51.5951 41.7078 173.2020 44 S 4.3096 8.0882 117.7435 56.5641 65.5467 173.1406 45 Q 4.1622 8.3906 126.9681 54.2540 30.1697 173.7560 46 L 4.2851 8.5141 128.0333 54.6921 42.8110 176.4923 47 G 4.0295 8.7063 114.3040 45.8461 0.0000 172.4828 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 V 8.05 4.00 2.06 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 0.89 0.00 0.00 0.90 0.00 0.00 2 T 8.44 4.08 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 1.00 0.00 0.00 3 S 8.92 4.79 0.00 3.89 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 4 Y 8.40 4.75 0.00 2.92 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 5 T 8.53 4.71 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 6 L 8.43 4.83 0.00 1.59 1.49 0.94 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 7 N 8.58 5.13 0.00 2.71 2.68 0.00 0.00 6.75 7.66 0.00 0.00 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 E 8.22 4.63 0.00 1.86 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 2.20 2.36 0.00 9 V 8.34 3.69 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 0.82 0.00 0.00 0.93 0.00 0.00 10 V 8.26 4.30 2.09 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 0.93 0.00 0.00 0.94 0.00 0.00 11 P 0.00 4.60 0.00 2.43 2.19 0.00 3.77 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.98 0.00 12 L 8.39 3.95 0.00 1.70 1.77 0.93 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.11 3.82 0.00 1.71 1.90 0.00 1.74 0.00 0.00 1.69 0.00 0.00 3.04 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.49 7.81 14 D 8.00 4.70 0.00 2.76 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.66 4.14 2.09 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 0.80 0.00 0.00 1.01 0.00 0.00 16 V 7.32 4.39 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 0.81 0.00 0.00 0.97 0.00 0.00 17 P 0.00 4.63 0.00 2.30 2.05 0.00 3.71 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 2.07 2.13 0.00 18 E 8.84 4.01 0.00 1.94 1.85 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 2.32 2.40 0.00 19 W 7.99 4.75 0.00 3.22 3.08 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 0.00 0.00 0.00 20 V 8.22 4.65 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 0.77 0.00 0.00 0.95 0.00 0.00 21 R 8.44 4.65 0.00 1.79 1.82 0.00 3.19 0.00 0.00 3.28 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.60 0.00 22 I 7.69 4.36 1.80 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.60 0.75 0.00 0.00 23 G 7.17 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.30 4.99 0.00 2.84 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.42 4.67 0.00 3.77 3.67 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.27 4.79 1.18 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 0.00 0.00 27 T 8.16 4.75 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 1.22 0.00 0.00 28 T 8.38 4.87 4.40 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 1.28 0.00 0.00 29 G 8.53 4.16 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 A 8.97 4.20 1.31 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 31 E 7.85 4.32 0.00 1.96 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.18 0.00 32 F 7.17 5.10 0.00 3.01 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 33 A 8.23 4.52 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 A 8.50 4.50 1.25 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 0.00 0.00 35 Q 8.36 4.58 0.00 1.96 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.64 0.00 0.00 0.00 0.00 0.00 2.20 2.32 0.00 36 E 8.29 4.65 0.00 2.01 1.85 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 2.17 2.35 0.00 37 V 8.09 4.21 1.81 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 0.51 0.00 0.00 0.07 0.00 0.00 38 H 8.73 4.78 0.00 3.12 3.34 0.00 5.81 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 S 7.66 4.78 0.00 4.03 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 40 W 8.51 5.48 0.00 3.36 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 41 S 8.87 4.74 0.00 3.98 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 42 F 8.21 4.69 0.00 2.72 2.70 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.83 4.80 0.00 2.51 2.41 0.00 0.00 6.82 7.63 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 44 S 8.09 4.31 0.00 3.74 3.69 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.39 4.16 0.00 1.92 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.58 0.00 0.00 0.00 0.00 0.00 2.18 2.26 0.00 46 L 8.51 4.29 0.00 1.52 1.49 0.84 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 47 G 8.71 4.03 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 0.00 0.00 0.00 0.00 0.00 0.00