NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.2110 8.2644 123.5878 51.9887 19.5510 176.2243 3 R 4.2858 7.4584 122.1637 53.1440 31.3869 174.5937 4 K 3.5474 9.3033 128.2565 59.8496 33.0603 178.1407 5 A 4.2451 7.9571 118.0274 53.6759 18.2021 177.3818 6 L 4.9734 8.8893 116.5732 54.1186 43.4094 176.8549 7 I 4.4463 8.0832 116.8001 60.7396 37.7574 176.9451 8 E 3.7494 8.0809 120.0667 58.5769 29.3266 178.3410 9 K 3.6264 7.4479 120.6301 59.0008 31.7895 177.4300 10 A 4.0373 7.4433 118.5940 53.6287 18.1826 178.9992 11 K 3.9960 8.3388 119.2478 58.9955 31.9634 178.6724 12 R 3.8292 7.8425 113.2437 57.2207 28.3231 176.8439 13 T 4.7179 7.2920 110.5726 61.5588 69.3765 172.0283 14 P 4.2951 0.0000 0.0000 63.0056 31.2669 176.9734 15 K 4.3391 8.1039 129.7000 56.2352 34.4993 173.8865 16 F 4.6238 7.4579 117.6308 56.3992 41.2438 175.6208 17 K 4.3954 8.4389 126.2542 59.9266 33.6754 177.9561 18 V 4.1077 7.4183 113.4899 60.5276 30.0810 177.0960 19 R 4.5897 7.5728 112.3334 56.5641 33.5671 176.2077 20 A 4.2374 7.9580 122.5665 51.3133 18.0203 177.7888 21 Y 4.3081 8.0420 123.9295 60.4842 36.3331 180.1325 22 T 2.9244 7.8460 117.3449 63.4416 71.0883 170.4511 23 R 4.1884 8.1249 131.4952 55.6148 31.0475 176.1828 24 C 4.7654 8.6940 121.6920 58.8458 32.4333 175.1477 25 V 3.6554 8.1014 125.4964 64.1070 31.4706 176.8390 26 R 4.4059 7.9555 118.1286 57.7348 31.2838 176.7864 27 C 4.1586 8.0376 110.9837 59.2142 29.9062 173.6893 28 G 4.1548 7.7009 113.8653 45.2382 0.0000 176.7488 29 R 4.0238 7.0491 115.2445 54.7542 31.6643 177.8569 30 A 4.4869 8.1883 135.0000 53.1922 23.4722 175.9625 31 R 4.7171 7.2919 114.0680 54.7240 33.6567 176.5526 32 S 3.9222 8.8386 109.4511 59.6801 63.3401 171.4511 33 V 4.5295 8.0653 116.4476 64.4424 30.0147 176.0387 34 Y 4.1242 7.5633 115.9628 56.7209 38.7565 178.2496 35 R 3.9774 9.0375 124.7886 59.4670 30.6274 178.4755 36 F 3.8217 8.5113 118.1253 60.8512 39.1665 175.7001 37 F 4.9039 8.4620 116.1824 56.2949 39.1048 177.6483 38 G 4.1313 8.4175 111.2715 47.6706 0.0000 174.4750 39 L 5.0372 9.9221 126.3790 55.5971 39.2828 176.8106 40 C 5.3347 8.4525 119.3954 57.1256 34.3833 172.7695 41 R 3.8248 8.3107 115.2240 57.7814 31.2990 178.2951 42 I 3.5954 8.6571 116.9807 63.4190 35.3931 178.5902 43 C 4.0514 8.5286 117.3256 61.4569 33.2997 178.5802 44 L 3.6137 7.0479 120.3033 56.6882 43.6684 178.4047 45 R 3.8877 7.8549 119.8486 57.5802 30.2859 177.4935 46 E 4.0128 8.5852 116.6602 59.2908 30.8945 179.5682 47 L 4.0236 9.2460 121.7433 55.7898 41.4456 178.0731 48 A 3.8739 6.1610 125.1324 55.4847 19.3003 179.6137 49 H 4.0926 7.9885 113.0488 58.2369 28.9854 175.1370 50 K 4.4140 8.0185 115.1188 56.2128 34.2545 176.8052 51 G 4.3686 7.4145 112.8201 44.8840 0.0000 174.2367 52 Q 4.1329 8.2665 117.3257 57.0191 28.4774 176.6450 53 L 4.5302 7.6754 121.0457 53.0243 43.0164 173.5036 54 P 4.5404 0.0000 0.0000 62.4314 32.7120 177.9465 55 G 4.2795 8.8237 108.5579 46.2207 0.0000 174.3828 56 V 3.7744 7.9226 118.4765 61.3557 31.7500 175.2098 57 R 4.3687 7.8234 118.8066 55.6490 31.9318 173.5507 58 K 3.9503 8.7842 123.8891 56.5630 30.9144 175.7489 59 A 4.3591 8.3126 127.8898 52.5819 16.4123 176.7278 60 S 4.6078 9.3265 116.8473 55.9826 64.9031 174.1387 61 W 3.7252 8.6375 117.7062 56.1224 27.2405 174.2530 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 4.21 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 3 R 7.46 4.29 0.00 1.94 1.85 0.00 3.23 0.00 0.00 3.36 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.73 0.00 4 K 9.30 3.55 0.00 1.87 1.89 0.00 1.73 0.00 0.00 1.83 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.55 1.49 7.81 5 A 7.96 4.25 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 6 L 8.89 4.97 0.00 1.56 1.69 1.14 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 7 I 8.08 4.45 1.88 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.10 0.91 0.00 0.00 8 E 8.08 3.75 0.00 2.16 2.24 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 2.37 2.34 0.00 9 K 7.45 3.63 0.00 0.87 1.38 0.00 1.51 0.00 0.00 1.52 0.00 0.00 3.12 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.19 1.24 7.81 10 A 7.44 4.04 1.28 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 0.00 0.00 0.00 11 K 8.34 4.00 0.00 1.75 1.90 0.00 1.82 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.70 7.81 12 R 7.84 3.83 0.00 1.90 1.96 0.00 3.12 0.00 0.00 3.20 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.58 0.00 13 T 7.29 4.72 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 1.18 0.00 0.00 14 P 0.00 4.30 0.00 2.26 2.00 0.00 3.91 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.99 0.00 15 K 8.10 4.34 0.00 1.67 1.70 0.00 1.79 0.00 0.00 2.04 0.00 0.00 3.00 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.30 0.95 7.81 16 F 7.46 4.62 0.00 3.15 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 17 K 8.44 4.40 0.00 1.89 1.94 0.00 1.52 0.00 0.00 1.78 0.00 0.00 2.91 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.43 1.62 7.81 18 V 7.42 4.11 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 0.73 0.00 0.00 0.98 0.00 0.00 19 R 7.57 4.59 0.00 1.94 2.06 0.00 3.50 0.00 0.00 3.39 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.98 0.00 20 A 7.96 4.24 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 21 Y 8.04 4.31 0.00 3.18 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 22 T 7.85 2.92 4.31 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 1.32 0.00 0.00 23 R 8.12 4.19 0.00 1.99 1.99 0.00 3.57 0.00 0.00 3.42 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 24 C 8.69 4.77 0.00 2.96 2.95 0.00 0.00 0.00 0.00 0.00 0.00 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 8.10 3.66 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 0.78 0.00 0.00 0.96 0.00 0.00 26 R 7.96 4.41 0.00 1.79 1.97 0.00 3.24 0.00 0.00 3.29 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.59 0.00 27 C 8.04 4.16 0.00 3.13 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 28 G 7.70 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.05 4.02 0.00 1.93 1.45 0.00 3.27 0.00 0.00 3.25 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 30 A 8.19 4.49 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.29 4.72 0.00 1.92 1.88 0.00 3.36 0.00 0.00 3.43 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 32 S 8.84 3.92 0.00 4.21 4.11 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 33 V 8.07 4.53 2.18 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 0.99 0.00 0.00 1.02 0.00 0.00 34 Y 7.56 4.12 0.00 3.12 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 35 R 9.04 3.98 0.00 1.92 2.00 0.00 3.16 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.65 0.00 36 F 8.51 3.82 0.00 2.97 2.98 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 0.00 0.00 0.00 37 F 8.46 4.90 0.00 3.34 3.15 0.00 0.00 0.00 0.00 0.00 0.00 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 8.42 4.13 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 0.00 0.00 0.00 39 L 9.92 5.04 0.00 1.93 1.38 0.99 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 40 C 8.45 5.33 0.00 2.91 2.82 0.00 0.00 0.00 0.00 0.00 0.00 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 8.31 3.82 0.00 1.70 1.84 0.00 3.07 0.00 0.00 3.18 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.65 0.00 42 I 8.66 3.60 1.84 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 0.46 0.89 0.00 0.00 43 C 8.53 4.05 0.00 3.10 2.98 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 0.00 0.00 0.00 44 L 7.05 3.61 0.00 1.58 1.53 0.29 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 45 R 7.85 3.89 0.00 1.73 1.78 0.00 3.19 0.00 0.00 3.18 7.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.50 0.00 46 E 8.59 4.01 0.00 2.22 2.23 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 2.36 2.46 0.00 47 L 9.25 4.02 0.00 1.57 1.54 0.88 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 48 A 6.16 3.87 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.99 4.09 0.00 3.37 3.39 0.00 5.60 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 50 K 8.02 4.41 0.00 1.82 1.88 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.57 1.56 7.81 51 G 7.41 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.27 4.13 0.00 2.05 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.98 0.00 0.00 0.00 0.00 0.00 2.38 2.43 0.00 53 L 7.68 4.53 0.00 1.58 1.51 1.18 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.54 0.00 2.31 2.23 0.00 3.95 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.02 0.00 55 G 8.82 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 0.00 0.00 0.00 0.00 56 V 7.92 3.77 2.23 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 0.67 0.00 0.00 0.86 0.00 0.00 57 R 7.82 4.37 0.00 1.79 1.84 0.00 3.45 0.00 0.00 3.24 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.40 0.00 58 K 8.78 3.95 0.00 1.80 1.82 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.41 7.81 59 A 8.31 4.36 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 9.33 4.61 0.00 3.88 3.89 0.00 0.00 0.00 0.00 0.00 0.00 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 8.64 3.73 0.00 3.45 3.33 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