NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.6644 8.2076 120.5417 54.3251 43.2369 177.1129 2 Y 4.0994 8.0500 117.7975 58.8586 38.1918 176.0044 3 L 3.6572 7.1455 120.8508 56.9951 42.4293 179.9953 4 R 3.8167 7.7147 118.2062 59.4823 30.0794 177.9571 5 E 3.9484 8.2432 118.2012 59.6583 29.5068 179.1323 6 L 3.9750 8.0965 118.9363 58.2276 41.7348 179.6758 7 L 4.0035 8.1205 119.8684 57.8363 41.8562 178.9212 8 K 3.9538 7.9805 119.4072 59.4886 32.2190 178.8601 9 L 4.0510 7.8216 118.8566 57.8209 41.4851 179.4205 10 E 4.0496 8.0494 118.3142 59.1435 29.3919 179.0538 11 L 4.0010 8.0887 119.1939 58.1640 41.7366 179.7077 12 Q 4.0176 7.9030 117.5685 58.8555 28.5838 178.6453 13 L 3.9887 7.8368 121.3227 58.1640 42.0715 178.8998 14 I 3.8346 8.0486 118.7372 63.7439 37.9760 177.4965 15 K 3.8453 8.1023 120.6955 60.0187 31.9086 178.7444 16 Q 4.0843 8.1506 117.8738 58.9613 28.7401 178.1651 17 Y 3.9702 8.3249 118.0781 60.8305 37.8421 178.6368 18 R 3.9730 8.4327 119.6546 59.2710 30.2948 178.5677 19 E 4.0991 8.1930 118.4754 58.4653 29.7482 178.4331 20 A 4.1991 8.6598 121.7668 55.1987 18.3270 178.8924 21 L 4.6459 7.5059 114.6454 55.1497 41.9048 178.6586 22 E 4.1062 7.6237 118.3045 59.4593 29.6280 178.1541 23 Y 4.3085 7.5531 115.8822 60.0572 38.0923 177.1921 24 V 4.3520 7.3571 115.5361 60.6076 34.5245 172.1523 25 K 4.5203 8.5904 122.9283 56.0132 32.9230 177.0833 26 L 4.5373 7.9901 119.8363 52.4640 43.6687 172.1848 27 P 4.2912 0.0000 0.0000 65.0800 31.6204 177.9052 28 V 3.6412 7.8331 117.4328 64.8155 31.1165 178.0875 29 L 4.0464 8.1443 119.3313 57.7868 41.5284 179.3920 30 A 3.9895 7.9751 120.3496 55.1723 18.3736 179.7872 31 K 3.9930 7.8801 116.2173 58.9660 31.9307 179.7161 32 I 3.5857 7.5927 120.5804 63.8672 37.2045 177.5415 33 L 3.7043 7.5722 120.7608 58.2686 41.6913 178.4052 34 E 3.9062 7.7669 118.2822 59.4873 29.4668 178.3194 35 D 4.1217 7.5863 118.2470 57.6516 40.9332 179.0174 36 E 3.7011 8.5767 119.8044 58.9683 29.3264 179.2860 37 E 3.8132 8.4846 119.0776 59.2592 29.5838 179.1546 38 K 3.3005 7.5231 118.3513 59.8239 32.0456 178.7807 39 H 4.0278 7.7799 116.2202 59.0304 28.6387 177.8709 40 I 3.6756 7.6494 121.3151 64.2595 36.8564 177.7291 41 E 3.8650 8.0411 120.0766 59.2716 29.3648 178.5800 42 W 4.6792 7.9309 118.5256 60.3307 29.3210 178.5027 43 L 4.0524 8.1698 118.4047 58.0211 40.8323 179.5902 44 E 4.0208 8.0591 117.5776 59.6001 29.4220 179.1196 45 T 4.0226 8.0774 115.3364 67.0166 68.6929 176.3447 46 I 3.8256 7.8268 120.6029 66.0171 37.6156 177.5884 47 L 4.5047 8.1784 121.5750 54.1760 44.4817 177.1895 48 G 4.2132 8.7388 110.1020 47.0479 0.0000 173.1335 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 D 8.21 4.66 0.00 2.83 2.84 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 0.00 0.00 0.00 0.00 2 Y 8.05 4.10 0.00 3.38 3.19 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 3 L 7.15 3.66 0.00 1.38 1.50 0.71 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 4 R 7.71 3.82 0.00 1.88 1.91 0.00 3.23 0.00 0.00 3.31 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.77 0.00 5 E 8.24 3.95 0.00 2.24 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 0.00 2.36 2.66 0.00 6 L 8.10 3.97 0.00 1.86 1.76 1.02 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 7 L 8.12 4.00 0.00 1.75 1.80 0.93 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 8 K 7.98 3.95 0.00 1.91 1.95 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.49 7.81 9 L 7.82 4.05 0.00 1.76 1.73 0.95 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 10 E 8.05 4.05 0.00 2.12 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 2.44 2.53 0.00 11 L 8.09 4.00 0.00 1.86 1.74 0.92 0.73 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 12 Q 7.90 4.02 0.00 2.22 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.48 0.00 13 L 7.84 3.99 0.00 2.01 1.92 0.94 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 14 I 8.05 3.83 2.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.46 1.00 0.00 0.00 15 K 8.10 3.85 0.00 1.94 2.08 0.00 1.58 0.00 0.00 1.65 0.00 0.00 3.20 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.56 7.81 16 Q 8.15 4.08 0.00 2.07 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.58 0.00 0.00 0.00 0.00 0.00 2.38 2.54 0.00 17 Y 8.32 3.97 0.00 3.06 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 18 R 8.43 3.97 0.00 2.20 1.99 0.00 3.13 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 19 E 8.19 4.10 0.00 2.07 2.16 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 2.48 2.45 0.00 20 A 8.66 4.20 1.43 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 0.00 0.00 21 L 7.51 4.65 0.00 1.70 1.75 0.95 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 22 E 7.62 4.11 0.00 1.82 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.52 0.00 23 Y 7.55 4.31 0.00 3.19 2.98 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 24 V 7.36 4.35 2.15 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 0.84 0.00 0.00 0.96 0.00 0.00 25 K 8.59 4.52 0.00 1.78 1.80 0.00 1.79 0.00 0.00 1.64 0.00 0.00 2.76 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.43 1.43 7.81 26 L 7.99 4.54 0.00 1.82 1.52 0.95 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 27 P 0.00 4.29 0.00 2.20 2.10 0.00 3.67 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.16 0.00 28 V 7.83 3.64 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 0.86 0.00 0.00 0.94 0.00 0.00 29 L 8.14 4.05 0.00 1.96 1.93 1.01 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 30 A 7.98 3.99 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.88 3.99 0.00 1.92 1.83 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.46 7.81 32 I 7.59 3.59 1.61 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 1.07 0.26 0.00 0.00 33 L 7.57 3.70 0.00 1.60 1.70 0.90 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 34 E 7.77 3.91 0.00 2.11 1.97 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 2.21 2.28 0.00 35 D 7.59 4.12 0.00 2.69 2.44 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.58 3.70 0.00 1.82 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.09 0.00 37 E 8.48 3.81 0.00 1.97 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 2.25 2.36 0.00 38 K 7.52 3.30 0.00 1.36 0.74 0.00 1.34 0.00 0.00 1.44 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.34 1.36 7.81 39 H 7.78 4.03 0.00 3.22 3.33 0.00 5.64 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 40 I 7.65 3.68 1.95 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.98 0.89 0.00 0.00 41 E 8.04 3.86 0.00 1.90 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 0.00 2.41 2.39 0.00 42 W 7.93 4.68 0.00 3.68 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 43 L 8.17 4.05 0.00 1.75 1.74 0.95 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 44 E 8.06 4.02 0.00 2.27 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 0.00 2.35 2.46 0.00 45 T 8.08 4.02 4.51 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 1.24 0.00 0.00 46 I 7.83 3.83 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.79 0.89 0.00 0.00 47 L 8.18 4.50 0.00 1.82 1.58 0.89 0.59 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 48 G 8.74 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 0.00 0.00 0.00 0.00