NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 R 4.2219 8.1127 120.8583 56.0506 31.2696 174.3823 5 E 4.1614 8.5525 126.0539 55.1449 30.7934 173.9527 6 C 4.4902 8.9194 122.8554 58.8927 30.0396 174.4745 7 D 4.3641 8.0322 123.7021 56.8350 40.3360 176.1163 8 Y 4.4222 7.3016 118.8940 58.8491 39.6982 175.9573 9 C 3.9318 8.4035 114.4174 59.5323 30.7309 176.0434 10 G 4.1298 8.3692 106.5838 45.0459 0.0000 172.7926 11 T 4.1660 7.6863 109.7705 60.9323 70.4752 173.7520 12 D 4.5311 8.7617 124.2693 54.2619 40.0203 175.5037 13 I 3.6676 7.9217 123.8422 61.4007 39.0033 175.0678 14 E 4.3497 8.7429 128.7574 53.6532 29.1741 173.4696 15 P 4.2850 0.0000 0.0000 64.7855 31.4160 176.4996 16 G 4.0504 10.4285 110.1659 45.3645 0.0000 172.9644 17 T 4.4962 7.3181 114.8666 61.0610 72.5986 173.4576 18 G 4.5490 7.7546 112.6030 43.9084 0.0000 172.1445 19 T 4.7067 8.2396 116.6183 62.0186 72.9218 172.9717 20 M 4.5279 8.8738 126.3762 53.9804 33.8587 174.7720 21 F 4.7715 8.8653 130.3729 56.8580 40.9025 174.6995 22 V 4.1668 7.7681 127.1301 62.4869 31.7559 175.6994 23 H 4.2167 8.9792 125.7041 54.4515 29.7799 176.2278 24 K 3.9251 8.7830 122.2097 59.9855 32.0382 177.4388 25 D 4.4161 8.1974 116.4305 55.6491 39.4895 176.6566 26 G 3.9609 7.0761 115.0382 45.0204 0.0000 172.3719 27 A 4.2772 7.7672 123.5989 52.3157 19.9535 176.9214 28 T 4.9932 8.2490 114.6660 62.2129 72.1449 174.0020 29 T 4.6006 8.6490 122.2257 62.0446 72.1126 172.7861 30 H 5.0015 8.9096 124.5324 55.0438 30.4992 174.5167 31 F 5.1597 8.9615 122.1197 55.7172 40.7068 176.7688 32 C 4.2519 9.1948 119.3456 60.7333 29.8519 173.7301 33 S 4.7263 7.7343 113.9002 55.9131 67.0294 174.6959 34 S 4.8702 8.5145 117.4967 60.2137 62.8375 176.3309 35 K 3.8840 7.9733 123.3928 59.9085 32.1846 178.4222 36 C 4.5389 7.8659 115.9742 62.7504 27.6661 176.0472 37 E 2.7239 7.5280 119.1088 59.0809 28.7303 179.0929 38 N 4.3500 7.9097 115.3746 56.0576 38.4192 177.0418 39 N 4.5860 8.3161 118.0001 56.1339 38.5371 177.3414 40 A 3.9706 7.6125 121.8332 55.0690 18.1659 179.4250 41 D 4.3270 7.4094 115.3321 56.8616 41.0355 177.7844 42 L 4.4442 7.4556 118.2527 54.5051 41.4323 179.2716 43 G 4.1071 7.9623 109.8241 46.2926 0.0000 175.0808 44 R 4.1773 7.6433 117.8312 56.5889 30.4897 175.3695 45 E 4.8526 8.3001 117.0847 54.2967 33.0283 177.3017 46 A 3.1882 7.9277 122.8988 54.5697 18.7824 179.5934 47 R 4.0140 7.7273 114.3259 59.0756 30.5796 177.6595 48 N 4.3716 8.0955 113.6139 55.5838 38.7414 175.2151 49 L 4.5531 6.8281 116.8782 53.1016 43.3481 176.4504 50 E 4.0106 8.7543 123.5023 59.0974 29.7878 179.3353 51 W 4.5432 8.3069 115.1161 59.5596 28.5028 176.6302 52 T 3.7145 6.7393 116.1111 62.7647 68.2795 175.4313 53 D 4.4831 8.5393 125.1509 57.6003 41.2671 178.4449 54 T 3.7916 7.3045 113.9222 66.5406 67.8008 175.3422 55 A 3.9126 6.4887 122.6176 54.5669 18.9571 177.6010 56 R 4.0878 7.5942 116.6156 55.8260 29.7333 176.8606 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 4 R 8.11 4.22 0.00 1.83 1.84 0.00 3.08 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 5 E 8.55 4.16 0.00 2.04 1.81 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 2.26 2.48 0.00 6 C 8.92 4.49 0.00 3.11 2.87 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 0.00 0.00 0.00 0.00 7 D 8.03 4.36 0.00 2.63 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 8 Y 7.30 4.42 0.00 2.82 2.89 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 9 C 8.40 3.93 0.00 3.13 3.24 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 10 G 8.37 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 11 T 7.69 4.17 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 1.31 0.00 0.00 12 D 8.76 4.53 0.00 2.60 2.71 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.92 3.67 1.89 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 1.14 0.79 0.96 0.00 0.00 14 E 8.74 4.35 0.00 2.10 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 2.34 2.36 0.00 15 P 0.00 4.29 0.00 2.22 2.08 0.00 3.79 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 2.00 1.99 0.00 16 G 10.43 4.05 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 0.00 0.00 0.00 17 T 7.32 4.50 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 18 G 7.75 4.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 T 8.24 4.71 4.42 0.00 0.00 0.00 0.00 0.00 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 20 M 8.87 4.53 0.00 2.01 1.92 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.40 0.00 21 F 8.87 4.77 0.00 3.41 3.18 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 22 V 7.77 4.17 1.84 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 0.71 0.00 0.00 0.83 0.00 0.00 23 H 8.98 4.22 0.00 3.33 3.22 0.00 5.71 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 K 8.78 3.93 0.00 1.73 1.91 0.00 1.67 0.00 0.00 1.78 0.00 0.00 3.14 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.55 7.81 25 D 8.20 4.42 0.00 2.82 2.78 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 26 G 7.08 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 27 A 7.77 4.28 1.15 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 28 T 8.25 4.99 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 1.15 0.00 0.00 29 T 8.65 4.60 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 0.69 0.00 0.00 30 H 8.91 5.00 0.00 3.28 3.21 0.00 5.76 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 F 8.96 5.16 0.00 3.06 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 32 C 9.19 4.25 0.00 3.16 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 33 S 7.73 4.73 0.00 4.06 4.04 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 34 S 8.51 4.87 0.00 4.01 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 35 K 7.97 3.88 0.00 1.84 1.91 0.00 1.57 0.00 0.00 1.79 0.00 0.00 2.13 0.00 0.00 2.53 0.00 0.00 0.00 0.00 1.58 1.45 7.81 36 C 7.87 4.54 0.00 3.42 3.38 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 37 E 7.53 2.72 0.00 1.91 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 1.47 2.40 0.00 38 N 7.91 4.35 0.00 2.77 2.81 0.00 0.00 7.12 7.60 0.00 0.00 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 N 8.32 4.59 0.00 3.24 3.25 0.00 0.00 6.80 6.98 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 40 A 7.61 3.97 0.96 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 41 D 7.41 4.33 0.00 2.77 2.65 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 42 L 7.46 4.44 0.00 1.92 1.70 0.95 0.79 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 43 G 7.96 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 0.00 0.00 0.00 44 R 7.64 4.18 0.00 2.12 2.01 0.00 3.26 0.00 0.00 3.39 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.90 0.00 45 E 8.30 4.85 0.00 1.95 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.32 0.00 46 A 7.93 3.19 0.66 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 0.00 0.00 47 R 7.73 4.01 0.00 1.73 1.91 0.00 3.18 0.00 0.00 3.18 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.53 0.00 48 N 8.10 4.37 0.00 2.67 2.88 0.00 0.00 6.85 7.85 0.00 0.00 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 L 6.83 4.55 0.00 1.00 1.41 1.04 1.03 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 50 E 8.75 4.01 0.00 2.10 2.02 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 2.39 2.30 0.00 51 W 8.31 4.54 0.00 3.53 3.27 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 52 T 6.74 3.71 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.44 0.00 0.00 53 D 8.54 4.48 0.00 2.70 2.73 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.30 3.79 4.19 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 1.08 0.00 0.00 55 A 6.49 3.91 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 56 R 7.59 4.09 0.00 1.92 1.91 0.00 3.09 0.00 0.00 3.27 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.61 0.00