NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8135 8.3549 109.7363 45.1986 0.0000 173.9403 2 S 4.1234 8.5648 123.4195 57.5281 62.0425 172.0840 3 S 4.8361 8.3837 120.4749 57.1323 67.9856 173.4270 4 G 4.2618 8.1981 106.5554 46.6064 0.0000 173.5712 5 S 4.3780 7.4393 109.5626 57.1046 64.9362 175.0815 6 S 4.7087 10.2757 122.5226 58.4554 64.4712 172.6061 7 G 4.1574 7.4082 117.8714 44.1873 0.0000 173.2092 8 Q 4.5830 7.9174 122.4968 54.1638 30.8902 173.8471 9 P 4.6242 0.0000 0.0000 62.7597 29.1277 175.5649 10 S 4.6711 7.6288 122.0913 56.4353 63.3601 171.9931 11 P 4.4491 0.0000 0.0000 61.5613 32.2264 176.9193 12 P 4.5166 0.0000 0.0000 62.5686 28.2761 175.9294 13 Q 3.9604 7.5809 124.6580 58.5011 29.9560 176.7282 14 R 4.6348 7.3042 119.4758 54.6786 30.6166 174.5092 15 P 4.4124 0.0000 0.0000 62.8116 32.5924 175.9844 16 N 5.0044 8.6008 119.4154 51.2978 42.1736 173.4738 17 R 4.9315 8.2756 120.6470 53.8876 33.8298 174.8042 18 C 4.1553 8.7394 122.2915 60.4405 31.7822 174.0295 19 T 4.2172 8.1933 122.2888 64.3931 68.0947 174.8523 20 V 4.3439 8.0438 121.2654 63.9361 33.2045 175.8067 21 C 4.7538 7.8358 108.9374 56.5497 31.0372 173.3462 22 R 3.8649 8.4387 120.3696 57.4301 27.5178 176.7651 23 K 4.4275 7.9294 111.4431 56.4680 33.2143 177.2553 24 R 4.4975 7.2464 114.5673 56.6454 27.9781 176.7885 25 V 3.6327 7.5832 109.3387 61.6136 32.2970 175.2501 26 G 3.9671 8.0955 117.9199 46.1124 0.0000 175.2895 27 L 3.9595 8.1655 121.6882 56.9646 41.8917 179.3945 28 T 4.6276 7.5812 110.4585 61.3565 67.9982 173.7766 29 G 3.9791 7.7370 105.8345 46.0518 0.0000 174.0327 30 F 4.6442 9.1302 119.1644 55.6570 42.4783 174.2978 31 M 4.7016 8.7880 125.0366 54.2035 32.0827 175.0235 32 C 4.3202 9.0624 127.6941 59.4690 32.7303 175.0648 33 R 4.1879 8.8981 118.3047 59.2563 29.4190 177.5447 34 C 3.8953 8.5347 112.6941 60.9175 29.3052 173.6653 35 G 4.1219 7.1002 108.2056 45.8924 0.0000 172.9601 36 T 4.6402 8.0032 108.0891 59.8905 73.4235 172.3323 37 T 4.9163 7.6699 117.1785 61.8169 71.8108 173.5840 38 F 5.3720 9.1776 123.8251 56.0055 44.2973 173.3263 39 C 4.9295 8.8119 114.0895 56.8005 31.3404 175.1059 40 G 3.9290 9.0011 109.2149 48.4430 0.0000 174.4879 41 S 4.4070 7.9696 112.8173 59.8338 62.8648 174.0692 42 H 5.1061 8.4104 116.7123 55.3631 29.0138 175.5710 43 R 4.1609 7.9136 118.7461 58.8898 29.9918 176.7872 44 Y 4.2265 7.4918 116.3682 57.0138 38.8454 175.0869 45 P 3.8830 0.0000 0.0000 65.6338 32.1547 178.4444 46 E 3.9094 8.2329 117.1017 58.9039 29.7175 178.9825 47 V 3.4938 7.9391 118.2824 65.6129 31.4704 176.8736 48 H 4.6809 7.0605 112.3962 56.2916 29.0728 175.6735 49 G 3.7846 7.5951 104.0449 46.9274 0.0000 172.8714 50 C 4.0346 8.4221 120.2794 60.8380 32.2445 174.2187 51 T 4.6234 8.2612 119.6751 61.4306 68.8971 174.0772 52 F 3.7057 8.3558 124.3750 59.4922 39.0911 174.4728 53 D 4.5562 8.3185 129.6862 53.3171 40.2820 176.1774 54 F 4.9855 8.0715 119.3235 54.8848 40.2831 174.9636 55 K 4.0224 8.4919 116.7148 58.4229 31.4604 174.8316 56 S 4.6836 7.6667 111.2153 58.3021 63.7096 174.8137 57 A 4.3569 7.6934 120.2442 51.6964 22.2173 177.8712 58 G 4.2715 8.5479 113.7666 43.8286 0.0000 171.4499 59 S 4.4615 7.6868 110.8470 57.6884 66.3430 173.3770 60 G 4.0657 8.5927 111.9722 43.8992 0.0000 171.8230 61 P 4.3290 0.0000 0.0000 62.2464 31.8855 176.7546 62 S 4.3622 8.4892 118.2524 58.6028 63.6110 172.4194 63 S 4.5537 7.9600 114.4723 58.5639 64.6061 176.0121 64 G 3.7569 8.4814 110.9768 45.8850 0.0000 172.6547 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 G 8.35 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 2 S 8.56 4.12 0.00 3.95 3.86 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 0.00 0.00 0.00 3 S 8.38 4.84 0.00 3.79 3.73 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 4 G 8.20 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 S 7.44 4.38 0.00 3.77 3.68 0.00 0.00 0.00 0.00 0.00 0.00 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 S 10.28 4.71 0.00 3.98 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 0.00 7 G 7.41 4.16 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 0.00 0.00 0.00 8 Q 7.92 4.58 0.00 2.13 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 7.40 0.00 0.00 0.00 0.00 0.00 2.23 2.33 0.00 9 P 0.00 4.62 0.00 2.19 2.13 0.00 3.70 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 10 S 7.63 4.67 0.00 3.82 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 11 P 0.00 4.45 0.00 2.17 2.04 0.00 3.81 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 12 P 0.00 4.52 0.00 2.19 2.13 0.00 3.76 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.97 0.00 13 Q 7.58 3.96 0.00 2.03 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.45 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 14 R 7.30 4.63 0.00 1.66 1.77 0.00 3.26 0.00 0.00 3.25 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.62 0.00 15 P 0.00 4.41 0.00 2.20 2.04 0.00 3.81 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.97 0.00 16 N 8.60 5.00 0.00 2.88 2.65 0.00 0.00 6.82 7.61 0.00 0.00 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 R 8.28 4.93 0.00 1.71 1.77 0.00 3.22 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.56 0.00 18 C 8.74 4.16 0.00 3.02 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 19 T 8.19 4.22 4.23 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 1.23 0.00 0.00 20 V 8.04 4.34 2.33 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 0.59 0.00 0.00 1.10 0.00 0.00 21 C 7.84 4.75 0.00 3.13 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 22 R 8.44 3.86 0.00 1.94 1.98 0.00 3.27 0.00 0.00 3.40 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.70 0.00 23 K 7.93 4.43 0.00 1.88 1.93 0.00 1.75 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.57 7.81 24 R 7.25 4.50 0.00 2.01 2.05 0.00 3.36 0.00 0.00 3.08 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.59 0.00 25 V 7.58 3.63 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 0.75 0.00 0.00 0.97 0.00 0.00 26 G 8.10 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 27 L 8.17 3.96 0.00 1.63 1.79 0.92 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 28 T 7.58 4.63 4.29 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 1.32 0.00 0.00 29 G 7.74 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 30 F 9.13 4.64 0.00 3.02 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 31 M 8.79 4.70 0.00 2.03 1.99 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.54 0.00 32 C 9.06 4.32 0.00 3.57 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 33 R 8.90 4.19 0.00 2.18 2.18 0.00 3.17 0.00 0.00 3.32 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 2.00 0.00 34 C 8.53 3.90 0.00 3.15 3.35 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.10 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 0.00 0.00 0.00 36 T 8.00 4.64 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 37 T 7.67 4.92 4.06 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 1.16 0.00 0.00 38 F 9.18 5.37 0.00 2.94 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 39 C 8.81 4.93 0.00 3.03 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 40 G 9.00 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 41 S 7.97 4.41 0.00 3.79 3.71 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 42 H 8.41 5.11 0.00 3.22 3.23 0.00 5.73 0.00 0.00 0.00 0.00 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 R 7.91 4.16 0.00 1.57 1.85 0.00 2.21 0.00 0.00 2.35 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.68 0.00 44 Y 7.49 4.23 0.00 2.97 2.81 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 45 P 0.00 3.88 0.00 2.19 2.32 0.00 3.88 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.99 0.00 46 E 8.23 3.91 0.00 2.10 2.20 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 2.30 2.21 0.00 47 V 7.94 3.49 2.19 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 0.76 0.00 0.00 1.00 0.00 0.00 48 H 7.06 4.68 0.00 3.28 2.86 0.00 5.72 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 G 7.60 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 0.00 0.00 0.00 50 C 8.42 4.03 0.00 2.98 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 51 T 8.26 4.62 4.30 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 1.34 0.00 0.00 52 F 8.36 3.71 0.00 3.15 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 D 8.32 4.56 0.00 2.57 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.07 4.99 0.00 3.33 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 55 K 8.49 4.02 0.00 2.02 2.14 0.00 1.62 0.00 0.00 2.00 0.00 0.00 2.98 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.26 1.34 7.81 56 S 7.67 4.68 0.00 3.75 3.79 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 57 A 7.69 4.36 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 58 G 8.55 4.27 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 0.00 59 S 7.69 4.46 0.00 3.94 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 60 G 8.59 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 61 P 0.00 4.33 0.00 2.19 2.08 0.00 3.77 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 1.99 1.99 0.00 62 S 8.49 4.36 0.00 3.90 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 S 7.96 4.55 0.00 3.77 3.70 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 64 G 8.48 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00