NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3022 8.2649 123.5754 52.3392 19.9534 176.6424 3 K 4.2095 8.3184 111.9940 55.9446 30.4252 175.6786 4 H 3.8775 7.5134 118.2929 56.8340 30.7675 173.4149 5 P 4.9596 0.0000 0.0000 60.6054 34.4335 174.0529 6 V 4.1492 7.4463 116.8788 60.8375 32.8596 170.0395 7 P 4.5847 0.0000 0.0000 62.3367 32.1709 175.7773 8 K 4.3856 7.9368 117.3207 55.8969 33.3792 175.8465 9 K 4.0206 8.0374 112.5233 56.3814 35.0567 174.1066 10 K 3.8167 8.8561 126.0600 56.0156 31.7801 175.6293 11 T 3.8289 8.7531 117.5896 62.3242 68.5439 173.6349 12 S 4.0099 8.3391 121.6446 56.5422 64.4171 174.9680 13 K 4.3407 8.3369 118.9455 58.3862 32.8583 178.2274 14 S 4.2519 7.9907 115.3923 59.9068 62.4492 175.0974 15 K 4.1719 8.3985 121.8392 60.0132 32.0021 178.6946 16 R 3.9127 7.4756 117.2331 59.3398 30.0642 177.2276 17 D 4.6734 8.9772 119.3049 56.1040 41.3841 177.9515 18 M 4.2253 7.6075 112.9575 56.1762 31.3831 177.0179 19 R 4.0938 7.8390 121.0871 59.3592 30.8550 178.0398 20 R 3.8081 7.7630 114.3018 57.1161 29.7660 178.5092 21 S 4.5675 7.4332 112.6348 58.6279 62.1515 174.7024 22 H 4.9544 8.3505 114.6390 56.8573 31.6122 174.2156 23 H 4.4476 8.2114 116.1360 57.0207 29.0385 175.3549 24 A 3.8771 8.1129 121.7404 52.4560 18.2939 177.1660 25 L 4.2229 8.4492 124.8613 55.0269 43.0078 175.7670 26 T 4.5008 8.0699 112.7107 59.3254 70.4994 174.3536 27 A 4.0788 8.4732 128.6562 51.3012 18.9939 175.5459 28 P 4.3519 0.0000 0.0000 63.0201 32.0970 176.7066 29 N 4.6651 8.2532 120.7924 52.1178 37.3641 173.9101 30 L 4.2279 7.7648 120.8844 54.4301 43.0739 176.6318 31 T 4.7263 8.4095 118.9199 61.6800 71.8333 172.9163 32 E 4.6083 8.6905 126.0746 55.5251 31.0286 175.4737 33 C 4.4508 8.3214 125.1993 58.6150 32.8562 172.3984 34 P 4.5781 0.0000 0.0000 63.5529 33.0206 176.1583 35 Q 4.2980 7.7886 115.9387 55.9403 28.6819 177.5738 36 C 3.7068 9.3165 128.9537 60.5653 30.0961 174.9266 37 H 4.9021 8.0781 114.3532 55.4256 26.9338 174.6570 38 G 3.8814 8.0136 107.7234 45.2289 0.0000 173.3751 39 K 4.4584 8.7480 123.3846 57.0086 32.6099 176.0283 40 K 4.7213 9.4394 124.1505 54.6576 36.0353 175.6053 41 L 4.3924 8.3308 122.3396 54.3792 42.9372 175.9809 42 S 4.4569 8.3283 117.8141 59.7415 62.4922 173.7695 43 H 4.5213 9.4669 124.6450 55.8174 26.0974 174.2734 44 H 4.7052 7.6624 115.4787 53.4246 31.1747 173.8906 45 I 3.5777 7.6181 121.3826 60.8292 37.5565 175.8653 46 C 4.1777 8.5357 125.1970 58.8336 31.3231 171.6788 47 P 4.1442 0.0000 0.0000 66.3233 30.2843 176.9819 48 N 4.1265 7.7985 115.9137 56.1163 38.8983 175.8346 49 C 4.3072 8.0010 114.1821 58.7592 30.9828 174.8712 50 G 3.9648 8.5134 108.4158 46.7617 0.0000 172.2787 51 Y 5.3826 7.7869 116.5310 56.6432 39.5915 174.9945 52 Y 5.2091 8.1004 123.0052 55.8366 39.0363 172.4091 53 D 5.2045 9.5554 120.6937 54.0921 40.5713 175.6236 54 G 3.9299 7.5625 110.3246 44.4488 0.0000 172.0995 55 R 4.2614 8.1277 124.4007 54.4241 31.3765 174.4023 56 Q 4.1048 7.9144 126.8945 57.5940 29.5073 176.8751 57 V 3.8720 7.3793 111.1142 60.7476 33.1046 176.1548 58 L 3.8150 8.8133 121.8494 56.2873 42.1531 177.5191 59 A 4.1972 7.9245 122.1080 52.3570 18.6240 176.8143 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 4.30 1.27 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 0.00 0.00 0.00 3 K 8.32 4.21 0.00 1.81 1.95 0.00 1.66 0.00 0.00 1.70 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.36 1.59 7.81 4 H 7.51 3.88 0.00 3.17 3.19 0.00 5.65 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 P 0.00 4.96 0.00 2.01 1.96 0.00 3.75 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 1.92 2.03 0.00 6 V 7.45 4.15 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 0.67 0.00 0.00 0.93 0.00 0.00 7 P 0.00 4.58 0.00 2.20 2.10 0.00 3.72 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 1.98 1.95 0.00 8 K 7.94 4.39 0.00 1.70 1.81 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.31 1.41 7.81 9 K 8.04 4.02 0.00 1.72 1.67 0.00 1.86 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.26 1.28 7.81 10 K 8.86 3.82 0.00 1.71 1.77 0.00 1.79 0.00 0.00 1.76 0.00 0.00 2.86 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.49 7.81 11 T 8.75 3.83 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 1.26 0.00 0.00 12 S 8.34 4.01 0.00 4.02 4.06 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 13 K 8.34 4.34 0.00 1.93 1.96 0.00 1.57 0.00 0.00 1.63 0.00 0.00 3.05 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.38 1.48 7.81 14 S 7.99 4.25 0.00 3.91 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 15 K 8.40 4.17 0.00 1.91 1.83 0.00 1.60 0.00 0.00 1.57 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.54 7.81 16 R 7.48 3.91 0.00 1.97 1.99 0.00 3.47 0.00 0.00 3.23 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.85 0.00 17 D 8.98 4.67 0.00 2.89 2.66 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 0.00 0.00 0.00 0.00 18 M 7.61 4.23 0.00 2.12 2.15 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.69 0.00 19 R 7.84 4.09 0.00 1.97 2.09 0.00 3.20 0.00 0.00 3.35 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.65 0.00 20 R 7.76 3.81 0.00 2.00 1.90 0.00 3.19 0.00 0.00 3.26 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.56 0.00 21 S 7.43 4.57 0.00 3.82 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 22 H 8.35 4.95 0.00 3.04 3.25 0.00 5.65 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 H 8.21 4.45 0.00 3.21 3.33 0.00 5.74 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 24 A 8.11 3.88 1.27 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 0.00 0.00 0.00 25 L 8.45 4.22 0.00 1.61 1.58 0.92 0.98 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 26 T 8.07 4.50 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 27 A 8.47 4.08 1.27 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 0.00 0.00 0.00 28 P 0.00 4.35 0.00 2.05 2.00 0.00 3.67 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 29 N 8.25 4.67 0.00 2.68 2.75 0.00 0.00 7.07 7.78 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 30 L 7.76 4.23 0.00 1.68 1.59 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 31 T 8.41 4.73 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 32 E 8.69 4.61 0.00 1.99 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 2.51 2.37 0.00 33 C 8.32 4.45 0.00 3.12 2.84 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 34 P 0.00 4.58 0.00 2.03 2.02 0.00 3.67 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 2.01 2.09 0.00 35 Q 7.79 4.30 0.00 1.71 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.73 0.00 0.00 0.00 0.00 0.00 2.16 1.85 0.00 36 C 9.32 3.71 0.00 3.11 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 37 H 8.08 4.90 0.00 3.24 3.36 0.00 5.61 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 38 G 8.01 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 39 K 8.75 4.46 0.00 1.66 1.84 0.00 1.72 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.43 7.81 40 K 9.44 4.72 0.00 1.78 1.92 0.00 1.40 0.00 0.00 1.66 0.00 0.00 2.88 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.34 1.38 7.81 41 L 8.33 4.39 0.00 1.55 1.49 0.89 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 42 S 8.33 4.46 0.00 3.93 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 43 H 9.47 4.52 0.00 3.36 3.91 0.00 5.72 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 H 7.66 4.71 0.00 3.03 3.15 0.00 5.72 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 I 7.62 3.58 1.77 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.13 0.90 0.00 0.00 46 C 8.54 4.18 0.00 3.05 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 47 P 0.00 4.14 0.00 2.22 2.18 0.00 3.88 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.04 0.00 48 N 7.80 4.13 0.00 2.76 2.91 0.00 0.00 6.89 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 49 C 8.00 4.31 0.00 3.34 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 G 8.51 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 0.00 0.00 0.00 51 Y 7.79 5.38 0.00 3.07 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 52 Y 8.10 5.21 0.00 2.76 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 53 D 9.56 5.20 0.00 2.72 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 54 G 7.56 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 0.00 0.00 0.00 55 R 8.13 4.26 0.00 0.67 1.15 0.00 3.05 0.00 0.00 2.95 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.36 0.00 56 Q 7.91 4.10 0.00 2.05 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.70 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 57 V 7.38 3.87 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 58 L 8.81 3.82 0.00 1.60 1.62 0.90 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 59 A 7.92 4.20 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00