NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 N 3.8860 8.2827 118.0885 52.8026 40.3623 175.9290 2 N 4.1769 7.9984 118.0899 54.4341 38.9995 173.5353 3 Y 4.2510 8.2878 119.9889 60.2631 38.5541 177.7488 4 T 4.0316 7.3020 118.3059 66.3038 68.6400 176.7423 5 S 4.3200 7.8753 115.1541 60.6425 63.2515 176.3046 6 L 4.0702 7.9671 123.3776 57.6738 41.4884 179.1307 7 I 3.7026 8.2325 120.3030 64.8065 37.0253 178.1918 8 H 4.4600 8.1337 116.7012 58.6662 28.6078 178.0579 9 S 4.1884 8.2487 117.3282 61.5078 62.6376 176.6319 10 L 4.0643 8.2758 121.9876 57.6730 41.3089 179.6535 11 I 3.7444 7.7736 119.7799 64.2032 37.0438 178.0053 12 E 3.9207 8.1702 120.2085 59.1930 29.5010 178.4618 13 E 3.9033 8.0945 119.3407 59.4585 29.7949 179.0415 14 S 4.3943 8.1621 114.0828 61.3576 63.0366 176.3121 15 Q 4.0854 8.2496 121.6639 58.4744 28.2757 178.1765 16 N 4.3946 8.0708 117.9912 55.9804 38.6257 177.2004 17 Q 3.9228 8.5452 121.4036 59.1178 29.1167 177.8192 18 Q 3.9254 8.0121 120.5659 59.5238 29.0849 178.0578 19 E 3.9549 7.9831 119.6312 59.4099 29.4424 179.1160 20 K 4.0155 7.8356 118.2327 59.3278 32.1362 179.0461 21 N 4.3028 8.3612 116.9628 56.4080 38.4701 177.0924 22 E 3.9722 8.5870 121.0350 59.2155 29.6795 178.9017 23 Q 3.9578 8.1400 118.2321 58.8001 28.8094 177.9510 24 E 3.9373 8.2997 120.4860 59.6277 29.6104 178.9682 25 L 4.0063 7.9181 118.5779 57.9264 41.7596 179.6185 26 L 4.0349 8.4217 119.2451 57.8727 41.3395 178.9778 27 E 3.9759 8.6583 118.7445 59.4261 29.3934 179.7178 28 L 3.8785 8.1294 118.6775 57.8397 41.7069 179.3592 29 D 4.3341 8.4385 120.5765 57.6810 41.0600 178.7233 30 K 3.7037 7.7850 123.7651 59.9086 31.6524 181.0196 31 W 4.3084 7.9149 119.7949 59.2905 28.8970 178.6022 32 A 4.0251 7.9973 121.0614 55.1604 17.6904 179.9202 33 S 3.3824 7.9107 113.9688 61.3318 62.7704 176.9077 34 L 3.6890 7.5949 121.7860 56.8598 41.0213 179.4141 35 W 4.1233 8.4207 128.3078 60.6575 30.8385 177.4184 36 N 4.0572 7.6338 114.7891 55.8733 38.0295 176.8808 37 W 4.5894 7.6921 118.8398 58.0253 29.4886 176.9566 38 F 4.4915 7.5192 119.2948 57.1867 37.1594 175.1656 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 N 8.28 3.89 0.00 2.59 2.51 0.00 0.00 6.64 6.03 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 2 N 8.00 4.18 0.00 2.83 2.81 0.00 0.00 6.82 6.67 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 3 Y 8.29 4.25 0.00 3.21 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 4 T 7.30 4.03 4.21 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 1.18 0.00 0.00 5 S 7.88 4.32 0.00 4.05 4.12 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 6 L 7.97 4.07 0.00 1.93 1.78 0.97 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 7 I 8.23 3.70 1.96 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.37 0.90 0.00 0.00 8 H 8.13 4.46 0.00 3.24 3.33 0.00 5.64 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 S 8.25 4.19 0.00 3.98 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 L 8.28 4.06 0.00 1.69 1.72 0.93 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 11 I 7.77 3.74 2.06 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.97 0.94 0.00 0.00 12 E 8.17 3.92 0.00 2.06 2.07 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 2.32 2.33 0.00 13 E 8.09 3.90 0.00 2.16 1.93 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 2.31 2.37 0.00 14 S 8.16 4.39 0.00 4.11 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 15 Q 8.25 4.09 0.00 2.14 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.87 0.00 0.00 0.00 0.00 0.00 2.38 2.63 0.00 16 N 8.07 4.39 0.00 2.98 2.86 0.00 0.00 6.49 7.38 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 17 Q 8.55 3.92 0.00 2.21 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.76 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 18 Q 8.01 3.93 0.00 2.22 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.51 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 19 E 7.98 3.95 0.00 2.10 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 0.00 2.31 2.42 0.00 20 K 7.84 4.02 0.00 1.98 1.84 0.00 1.92 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.48 7.81 21 N 8.36 4.30 0.00 2.89 2.86 0.00 0.00 6.67 7.70 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 22 E 8.59 3.97 0.00 2.00 1.95 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 2.31 2.35 0.00 23 Q 8.14 3.96 0.00 2.27 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.50 0.00 0.00 0.00 0.00 0.00 2.61 2.51 0.00 24 E 8.30 3.94 0.00 2.03 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 0.00 2.32 2.39 0.00 25 L 7.92 4.01 0.00 1.94 1.70 0.92 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 26 L 8.42 4.03 0.00 1.72 1.71 0.92 0.82 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 27 E 8.66 3.98 0.00 2.29 2.07 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 2.53 2.55 0.00 28 L 8.13 3.88 0.00 1.93 1.69 0.90 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 29 D 8.44 4.33 0.00 2.93 2.79 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 30 K 7.79 3.70 0.00 1.82 1.82 0.00 1.87 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.38 1.37 7.81 31 W 7.91 4.31 0.00 3.42 3.16 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 32 A 8.00 4.03 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 33 S 7.91 3.38 0.00 3.32 2.63 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 0.00 0.00 0.00 0.00 34 L 7.59 3.69 0.00 1.78 1.71 0.17 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 35 W 8.42 4.12 0.00 3.48 3.20 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.63 4.06 0.00 2.63 2.85 0.00 0.00 7.14 7.65 0.00 0.00 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 W 7.69 4.59 0.00 3.36 3.04 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.52 4.49 0.00 2.99 3.01 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