NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 20 K 4.2491 8.3031 120.1339 55.9621 33.5079 174.6625 21 G 3.6539 8.2665 108.7597 45.0765 0.0000 171.9674 22 S 4.4141 8.3549 115.9197 57.5841 64.6675 172.8156 23 V 3.8683 8.0711 122.0503 62.4234 32.0007 175.4346 24 V 4.3646 8.0763 125.9792 60.8484 33.6809 174.8094 25 I 4.0289 8.3172 127.7866 61.2821 37.1954 176.0687 26 V 4.2376 8.0952 117.6180 60.3050 32.4316 175.3304 27 G 3.9791 7.4412 107.5149 46.1171 0.0000 172.3066 28 R 4.6442 8.2071 113.7380 54.9156 31.9702 174.3006 29 I 4.4160 8.1476 119.3108 59.5518 39.7399 175.1090 30 V 4.2631 8.4123 125.3383 61.2844 32.5492 175.1328 31 L 4.4660 8.4139 126.6636 55.6610 42.6449 177.4684 32 S 4.3870 8.0494 111.1092 58.7067 63.4547 174.5075 33 G 3.8104 7.7872 110.6618 45.3560 0.0000 173.2267 34 K 4.6638 8.1445 120.9134 53.0609 35.2285 174.3080 35 P 4.2265 0.0000 0.0000 63.4847 31.7260 175.8699 36 A 4.6629 8.0494 123.0829 50.5249 22.1838 175.6719 37 I 3.9995 8.2059 122.1362 60.3196 37.7123 176.1913 38 I 3.7653 8.3423 127.2692 60.4640 37.1746 174.2835 39 P 4.3335 0.0000 0.0000 62.5015 31.8021 175.6981 40 K 4.3055 8.4335 122.5255 55.4919 33.2792 176.5395 41 K 4.1990 8.5129 123.7710 56.5893 32.2676 176.1749 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 20 K 8.30 4.25 0.00 1.76 1.86 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.45 7.81 21 G 8.27 3.65 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 S 8.35 4.41 0.00 3.87 3.80 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 23 V 8.07 3.87 2.08 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 0.76 0.00 0.00 0.93 0.00 0.00 24 V 8.08 4.36 2.08 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 0.90 0.00 0.00 0.93 0.00 0.00 25 I 8.32 4.03 1.87 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 1.41 0.65 0.96 0.00 0.00 26 V 8.10 4.24 2.08 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 0.77 0.00 0.00 0.93 0.00 0.00 27 G 7.44 3.98 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 0.00 0.00 0.00 28 R 8.21 4.64 0.00 1.88 1.86 0.00 2.98 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.65 0.00 29 I 8.15 4.42 1.87 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 1.30 0.68 0.91 0.00 0.00 30 V 8.41 4.26 2.08 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 0.84 0.00 0.00 0.93 0.00 0.00 31 L 8.41 4.47 0.00 1.66 1.70 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 32 S 8.05 4.39 0.00 3.98 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 33 G 7.79 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.14 4.66 0.00 1.72 1.70 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.33 1.36 7.81 35 P 0.00 4.23 0.00 2.03 2.02 0.00 3.65 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 2.04 2.11 0.00 36 A 8.05 4.66 1.18 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 0.00 0.00 0.00 0.00 0.00 0.00 37 I 8.21 4.00 1.87 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 1.41 0.58 0.91 0.00 0.00 38 I 8.34 3.77 1.87 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 1.47 0.46 0.91 0.00 0.00 39 P 0.00 4.33 0.00 2.17 2.05 0.00 3.75 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 40 K 8.43 4.31 0.00 1.73 1.74 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.45 7.81 41 K 8.51 4.20 0.00 1.77 1.68 0.00 1.85 0.00 0.00 1.74 0.00 0.00 3.04 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.35 1.35 7.81