NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9039 8.3544 109.7367 44.7383 0.0000 173.5974 2 S 4.5275 7.6969 112.0179 53.9145 65.1531 171.6204 3 S 4.4719 8.6739 119.5721 57.9628 63.9713 172.3441 4 G 4.3953 8.5042 113.0325 46.2244 0.0000 172.5392 5 S 4.7441 7.5771 114.6984 56.4441 66.4598 174.1734 6 S 4.4851 7.6084 117.3615 57.5317 66.9225 175.3813 7 G 4.0722 7.7491 114.6104 46.1248 0.0000 171.0727 8 L 4.4888 7.7648 123.0031 52.1950 45.8740 173.7015 9 P 4.4589 0.0000 0.0000 61.4430 32.0926 173.8155 10 P 4.4387 0.0000 0.0000 65.6301 31.0994 175.5257 11 G 3.7801 8.6776 112.1584 44.7793 0.0000 172.2811 12 W 4.8616 7.8193 119.9357 55.0377 31.2550 175.3269 13 E 4.7457 9.0715 124.0638 54.6244 32.5849 174.1213 14 Q 4.9512 8.5400 122.4614 54.4767 31.4649 174.2193 15 R 4.6676 8.7977 124.3993 54.5762 35.2891 174.0920 16 V 4.5605 7.8586 118.5563 61.4015 34.6621 174.5272 17 D 5.0664 8.6204 125.2845 52.9452 42.8246 176.6517 18 Q 4.3234 8.6323 116.6240 57.5771 28.8778 176.2233 19 H 4.4856 8.1277 115.3351 56.3276 29.6056 176.0228 20 G 4.0122 8.0604 106.0632 45.1819 0.0000 173.4800 21 R 4.3866 7.9817 119.5010 54.1528 30.2219 175.8259 22 V 4.1631 8.3407 124.2333 63.4384 32.8059 174.3110 23 Y 4.8533 8.8103 124.7783 55.7622 41.8008 173.6335 24 Y 5.9833 8.6427 119.5576 56.4214 40.9233 174.8242 25 V 4.9325 8.4807 120.8394 61.2455 34.8735 173.7252 26 D 4.0092 7.9432 128.7304 53.9600 41.3955 176.4831 27 H 4.3204 8.3510 122.6142 57.1481 28.8747 176.4772 28 V 4.0073 7.6590 116.4761 63.1025 32.3555 176.0929 29 E 4.2581 7.8588 116.9791 55.1900 31.4438 175.5277 30 K 3.8139 7.7427 116.8357 57.2978 29.6761 175.3008 31 R 4.8688 7.1136 114.5550 54.4873 33.7453 175.5277 32 T 5.1803 8.4672 110.7460 60.3153 71.0256 173.1995 33 T 4.4682 8.5245 119.0443 60.2058 70.6684 174.7830 34 W 4.7261 8.7003 126.9165 58.1342 29.5003 175.4719 35 D 4.8384 7.4187 116.0458 51.4575 42.2020 175.5777 36 R 4.2167 8.3057 119.0186 55.9508 30.4293 176.4223 37 P 4.1968 0.0000 0.0000 64.5453 31.6687 176.3357 38 S 4.6146 7.6720 113.3076 56.7607 64.0985 172.5197 39 G 3.8995 8.6174 111.7707 42.7073 0.0000 171.4331 40 P 4.4391 0.0000 0.0000 62.5316 31.9141 175.5643 41 S 4.6336 8.3308 113.9601 56.4532 64.9359 173.0218 42 S 4.5713 8.6297 122.1205 56.7844 63.3215 173.9140 43 G 3.7608 8.6316 115.3595 45.9245 0.0000 173.1335 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 8.35 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 7.70 4.53 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 3 S 8.67 4.47 0.00 4.02 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 4 G 8.50 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 0.00 0.00 0.00 0.00 5 S 7.58 4.74 0.00 3.80 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 6 S 7.61 4.49 0.00 3.80 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 7 G 7.75 4.07 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 0.00 0.00 0.00 8 L 7.76 4.49 0.00 1.43 1.36 0.23 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 9 P 0.00 4.46 0.00 2.33 2.22 0.00 3.52 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 1.91 0.00 10 P 0.00 4.44 0.00 2.22 2.15 0.00 3.79 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 2.02 1.98 0.00 11 G 8.68 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 W 7.82 4.86 0.00 3.20 3.02 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 13 E 9.07 4.75 0.00 2.24 1.88 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 2.33 2.33 0.00 14 Q 8.54 4.95 0.00 2.05 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.62 0.00 0.00 0.00 0.00 0.00 2.31 2.54 0.00 15 R 8.80 4.67 0.00 0.99 1.44 0.00 3.22 0.00 0.00 3.14 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.52 0.00 16 V 7.86 4.56 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 0.83 0.00 0.00 0.90 0.00 0.00 17 D 8.62 5.07 0.00 3.63 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 18 Q 8.63 4.32 0.00 2.20 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 6.72 0.00 0.00 0.00 0.00 0.00 2.29 2.19 0.00 19 H 8.13 4.49 0.00 3.17 3.32 0.00 5.66 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 G 8.06 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 21 R 7.98 4.39 0.00 1.61 1.77 0.00 2.21 0.00 0.00 2.69 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.33 0.00 22 V 8.34 4.16 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 1.01 0.00 0.00 0.98 0.00 0.00 23 Y 8.81 4.85 0.00 2.56 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.64 5.98 0.00 2.80 3.23 0.00 0.00 0.00 0.00 0.00 0.00 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 8.48 4.93 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 1.00 0.00 0.00 1.20 0.00 0.00 26 D 7.94 4.01 0.00 1.58 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 0.00 0.00 0.00 27 H 8.35 4.32 0.00 3.00 3.25 0.00 5.69 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 V 7.66 4.01 1.94 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 0.68 0.00 0.00 0.85 0.00 0.00 29 E 7.86 4.26 0.00 1.81 1.88 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 2.16 2.27 0.00 30 K 7.74 3.81 0.00 1.84 1.81 0.00 1.72 0.00 0.00 1.81 0.00 0.00 3.03 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.29 1.45 7.81 31 R 7.11 4.87 0.00 1.92 1.99 0.00 3.06 0.00 0.00 3.95 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.59 0.00 32 T 8.47 5.18 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 1.09 0.00 0.00 33 T 8.52 4.47 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 1.18 0.00 0.00 34 W 8.70 4.73 0.00 3.27 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 35 D 7.42 4.84 0.00 2.62 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 R 8.31 4.22 0.00 1.92 1.81 0.00 3.35 0.00 0.00 3.59 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.75 0.00 37 P 0.00 4.20 0.00 2.18 1.84 0.00 3.45 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.25 0.00 38 S 7.67 4.61 0.00 3.89 3.74 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.62 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 40 P 0.00 4.44 0.00 2.19 2.07 0.00 3.71 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 41 S 8.33 4.63 0.00 3.81 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 42 S 8.63 4.57 0.00 3.87 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 43 G 8.63 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00