NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 A 4.4226 8.2649 123.5983 52.2860 21.0003 177.7722 7 E 4.2041 8.0110 115.0383 56.0868 29.0625 174.8229 8 D 4.8377 8.6452 116.2384 54.3222 43.9009 177.2462 9 Q 4.5711 7.9164 118.6612 54.9844 29.3765 175.4243 10 V 4.4493 8.2909 118.7036 58.5948 34.3239 174.0009 11 P 4.7273 0.0000 0.0000 62.8933 32.0956 175.3624 12 C 4.2445 9.3367 126.0520 58.8979 31.6061 174.0319 13 E 3.9943 9.0178 127.1377 59.1360 29.2569 178.6693 14 K 4.1765 7.8599 116.7088 57.8548 32.5402 177.2905 15 C 4.6179 7.8838 110.0036 57.0058 31.5016 175.1297 16 G 3.9693 8.9636 107.9970 44.7167 0.0000 173.5551 17 S 4.3370 7.6983 116.4509 58.1553 64.3732 173.6119 18 L 4.6116 8.5050 124.3556 54.5764 41.7829 176.1411 19 V 4.2047 8.5824 125.4325 59.9044 33.9803 173.2517 20 P 3.9559 0.0000 0.0000 62.8367 31.7535 177.3441 21 V 3.4627 8.4273 125.7421 64.9240 30.8198 178.5531 22 W 4.4081 7.3420 114.8766 58.2505 28.5972 176.8354 23 D 4.7738 7.7236 119.1600 54.4360 40.7417 177.8346 24 M 3.9999 7.5678 120.7352 57.9165 31.9813 176.5585 25 P 4.2924 0.0000 0.0000 66.0934 31.4127 178.0202 26 E 3.9908 8.2235 118.2925 59.3056 29.5623 178.8263 27 H 4.2139 8.8915 118.3901 59.6205 29.8920 177.2524 28 M 4.2823 8.9287 120.9223 58.4130 31.7045 178.2565 29 D 4.6303 8.6582 118.5597 57.3674 41.3241 177.6915 30 Y 4.1524 8.0618 120.3149 61.0119 38.7135 177.5894 31 H 4.1715 8.2435 117.0005 58.5370 28.7006 177.6756 32 F 3.9801 8.4550 119.7733 60.5145 38.9123 177.4700 33 A 3.9871 8.3245 120.1714 55.1033 18.0496 179.3367 34 L 3.6579 7.6668 117.7886 58.2550 42.2592 178.5589 35 E 4.1881 8.0786 115.7385 57.5664 29.9433 178.0980 36 L 4.1703 7.8793 121.3257 57.8156 42.0370 177.9894 37 Q 4.2646 7.9020 115.6479 56.8165 28.7353 176.6012 38 K 4.4040 7.7733 117.9463 56.5685 33.7209 176.4673 39 S 4.3663 7.9192 121.4428 58.8531 62.9470 173.7541 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 6 A 8.26 4.42 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.01 4.20 0.00 2.07 1.96 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 2.31 2.42 0.00 8 D 8.65 4.84 0.00 2.56 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 Q 7.92 4.57 0.00 1.85 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.54 6.74 0.00 0.00 0.00 0.00 0.00 2.09 2.27 0.00 10 V 8.29 4.45 2.03 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 0.63 0.00 0.00 0.85 0.00 0.00 11 P 0.00 4.73 0.00 2.04 2.04 0.00 3.72 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.94 0.00 12 C 9.34 4.24 0.00 2.89 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 13 E 9.02 3.99 0.00 1.95 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 2.29 2.32 0.00 14 K 7.86 4.18 0.00 1.40 1.47 0.00 1.38 0.00 0.00 1.67 0.00 0.00 2.82 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.27 1.25 7.81 15 C 7.88 4.62 0.00 3.07 3.09 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 0.00 0.00 0.00 0.00 16 G 8.96 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 0.00 0.00 0.00 17 S 7.70 4.34 0.00 3.80 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 18 L 8.51 4.61 0.00 1.48 1.58 0.90 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 19 V 8.58 4.20 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.66 0.00 0.00 20 P 0.00 3.96 0.00 1.10 0.50 0.00 3.45 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.84 0.00 21 V 8.43 3.46 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 0.90 0.00 0.00 0.93 0.00 0.00 22 W 7.34 4.41 0.00 3.45 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 D 7.72 4.77 0.00 2.61 2.70 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 0.00 0.00 0.00 0.00 24 M 7.57 4.00 0.00 2.07 2.32 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.60 0.00 25 P 0.00 4.29 0.00 2.31 2.36 0.00 3.77 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.13 0.00 26 E 8.22 3.99 0.00 2.25 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 0.00 2.47 2.38 0.00 27 H 8.89 4.21 0.00 3.27 3.50 0.00 5.78 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 M 8.93 4.28 0.00 2.24 2.36 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.89 0.00 29 D 8.66 4.63 0.00 2.96 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.06 4.15 0.00 3.08 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 31 H 8.24 4.17 0.00 3.29 3.26 0.00 5.68 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 32 F 8.45 3.98 0.00 3.19 3.05 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.32 3.99 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 34 L 7.67 3.66 0.00 0.94 1.43 0.73 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.08 4.19 0.00 2.02 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.28 0.00 36 L 7.88 4.17 0.00 1.93 1.84 0.93 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 37 Q 7.90 4.26 0.00 2.20 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.52 0.00 0.00 0.00 0.00 0.00 2.57 2.48 0.00 38 K 7.77 4.40 0.00 1.82 1.87 0.00 1.52 0.00 0.00 1.67 0.00 0.00 2.92 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.39 1.40 7.81 39 S 7.92 4.37 0.00 3.97 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