NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 R 4.2414 8.2393 119.7055 56.3169 30.4191 174.7145 4 S 4.4777 7.6448 121.0313 55.8323 65.1226 173.9353 5 L 3.9788 8.2883 120.0388 57.7411 42.2131 180.1492 6 S 4.2629 7.9673 111.2128 58.9490 63.5929 175.1025 7 G 3.9443 7.7983 109.4548 45.0107 0.0000 173.6028 8 L 4.5143 7.5902 119.6889 54.2372 42.8963 176.1263 9 T 4.5751 8.8094 111.9240 60.5389 71.7767 175.5211 10 E 3.8723 8.7127 122.3954 59.7659 29.4596 179.1908 11 E 4.0340 8.0921 118.1559 59.1804 29.5382 178.8830 12 E 3.9558 8.1531 118.5570 59.1073 29.4445 178.9461 13 A 3.9820 8.2565 121.1877 55.5529 18.6014 179.8036 14 I 3.6355 7.8045 117.8355 64.3334 36.9965 178.7039 15 A 4.0023 7.9711 121.7417 55.0326 18.2257 179.7731 16 V 3.5235 8.0568 117.0410 66.6356 31.7344 177.6891 17 H 4.0521 8.5315 118.0728 59.1631 29.4736 176.7775 18 D 4.3165 7.9611 119.5764 57.4776 41.1022 178.0647 19 Q 4.0612 7.9988 119.7351 58.7243 28.9413 177.8285 20 F 3.9283 8.4539 122.1172 61.3268 39.5499 177.0334 21 K 4.1775 8.3302 118.0599 60.0585 31.8390 179.4198 22 T 3.9014 7.7993 115.3571 67.0946 68.5238 177.0210 23 T 3.8858 8.2065 117.7645 66.5720 68.3807 176.5623 24 F 4.1831 8.6402 123.0478 61.5367 39.4010 177.4351 25 S 4.0574 8.3594 114.5326 61.3744 62.5762 176.5181 26 A 4.0004 7.9759 123.7004 54.8391 17.9872 179.4289 27 F 4.0882 8.2464 119.1637 61.6568 39.5568 177.3014 28 I 3.1525 7.6177 119.8536 64.2677 36.8565 178.5060 29 I 3.7124 7.6397 113.8146 63.8255 37.5385 178.3424 30 L 3.9494 7.8947 120.6063 57.3576 41.3911 179.2762 31 A 3.8355 7.9901 121.0457 54.8428 18.2245 179.5257 32 A 3.8556 7.9206 119.3510 55.2150 18.4720 179.9444 33 V 3.5279 7.8729 116.5153 66.1680 31.7132 178.0040 34 A 4.0524 8.0826 120.3875 55.7051 18.1646 179.3915 35 H 4.3302 8.5854 114.6752 58.8169 28.6568 178.3186 36 V 3.7254 7.9900 120.2224 66.0788 31.3081 177.9610 37 L 4.0861 8.1395 118.7738 57.9173 41.4866 179.8699 38 V 3.9347 7.9959 117.5616 65.9885 31.3946 177.7832 39 W 4.1058 8.6608 126.9082 60.6424 30.5316 177.7509 40 V 3.8491 8.3145 117.7100 65.5321 31.0159 177.4792 41 W 4.7395 7.9131 127.5740 59.0915 31.3349 176.1750 42 K 3.8347 8.1913 118.5694 54.3378 32.8572 172.3303 43 P 2.9700 0.0000 0.0000 61.8711 31.3261 176.8048 44 W 4.4952 7.0475 116.4943 56.2607 28.7988 176.1917 45 F 4.7686 6.8099 123.1806 58.1014 39.3964 174.4541 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 3 R 8.24 4.24 0.00 1.81 1.99 0.00 3.32 0.00 0.00 3.22 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 4 S 7.64 4.48 0.00 3.98 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.29 3.98 0.00 1.64 1.76 0.91 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 6 S 7.97 4.26 0.00 3.96 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 7 G 7.80 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 8 L 7.59 4.51 0.00 1.74 1.58 0.92 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 9 T 8.81 4.58 4.24 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 1.24 0.00 0.00 10 E 8.71 3.87 0.00 2.04 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 11 E 8.09 4.03 0.00 2.10 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.45 0.00 12 E 8.15 3.96 0.00 2.28 2.00 0.00 0.00 0.00 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 13 A 8.26 3.98 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.80 3.64 2.01 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 1.45 1.03 0.93 0.00 0.00 15 A 7.97 4.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.06 3.52 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 1.06 0.00 0.00 1.01 0.00 0.00 17 H 8.53 4.05 0.00 3.32 3.31 0.00 5.83 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 D 7.96 4.32 0.00 3.12 2.80 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.00 4.06 0.00 2.21 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.59 0.00 0.00 0.00 0.00 0.00 2.37 2.42 0.00 20 F 8.45 3.93 0.00 3.23 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 21 K 8.33 4.18 0.00 2.07 1.96 0.00 1.78 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.60 7.81 22 T 7.80 3.90 4.44 0.00 0.00 0.00 0.00 0.00 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 T 8.21 3.89 4.14 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 1.15 0.00 0.00 24 F 8.64 4.18 0.00 2.86 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 S 8.36 4.06 0.00 4.22 3.93 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 26 A 7.98 4.00 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 27 F 8.25 4.09 0.00 2.99 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 28 I 7.62 3.15 1.59 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.36 0.74 0.00 0.00 29 I 7.64 3.71 1.82 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.82 0.90 0.00 0.00 30 L 7.89 3.95 0.00 1.79 1.71 0.94 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 31 A 7.99 3.84 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 A 7.92 3.86 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 33 V 7.87 3.53 2.22 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 1.01 0.00 0.00 0.95 0.00 0.00 34 A 8.08 4.05 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 35 H 8.59 4.33 0.00 3.51 3.70 0.00 5.82 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 V 7.99 3.73 2.31 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 1.19 0.00 0.00 0.99 0.00 0.00 37 L 8.14 4.09 0.00 1.98 1.78 0.94 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 38 V 8.00 3.93 2.40 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 1.21 0.00 0.00 1.11 0.00 0.00 39 W 8.66 4.11 0.00 3.51 3.31 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 40 V 8.31 3.85 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 1.07 0.00 0.00 41 W 7.91 4.74 0.00 3.22 3.48 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 42 K 8.19 3.83 0.00 0.79 0.74 0.00 1.32 0.00 0.00 1.39 0.00 0.00 2.13 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.90 0.81 7.81 43 P 0.00 2.97 0.00 1.10 0.49 0.00 3.35 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.38 0.00 44 W 7.05 4.50 0.00 3.04 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 45 F 6.81 4.77 0.00 3.36 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00