NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 19 E 4.2516 8.3027 118.7906 56.3853 31.5635 177.5369 20 I 3.5714 7.6284 117.9631 62.3962 38.0670 173.8932 21 D 4.4388 7.1994 118.5711 53.2021 45.8690 175.5854 22 Y 4.1778 8.2580 122.2653 59.8600 38.1965 178.4707 23 K 3.7898 6.7054 118.2627 59.0950 33.0014 176.8372 24 D 4.6428 7.5528 121.1590 53.3177 40.4097 177.3799 25 I 3.7851 7.3454 113.7983 63.4794 37.3791 176.3959 26 A 4.1045 7.4393 122.4851 54.4267 18.6473 178.6460 27 T 4.3380 8.3247 108.0701 63.3870 69.7786 177.2257 28 L 4.2503 7.9483 121.6143 57.4361 41.8792 178.6068 29 K 4.2613 7.7249 115.9124 58.1410 32.7025 177.4094 30 N 4.3465 8.0232 118.8859 56.1905 39.0799 174.7927 31 Y 4.8932 7.9878 115.0921 57.6265 39.2033 175.2156 32 I 4.9301 7.6402 112.3512 58.8835 40.2931 175.2910 33 T 4.0474 9.2107 116.4936 61.5173 69.8850 174.7365 34 E 4.3358 8.7645 119.8861 57.2228 29.0201 177.7350 35 S 4.9497 7.2642 112.2480 56.5601 64.3731 174.5391 36 G 4.1582 8.1248 108.7337 46.2309 0.0000 174.4603 37 K 4.2328 7.9815 119.1442 56.3105 33.7323 176.5847 38 I 4.3728 8.0546 122.9797 59.9144 37.4308 176.1826 39 V 3.8081 8.0298 128.1817 61.9879 31.7520 174.3243 40 P 4.4688 0.0000 0.0000 62.7214 31.9910 177.5811 41 S 4.3291 8.5536 114.3138 60.9034 63.6396 176.9277 42 R 3.8301 8.0791 117.1783 59.3649 28.9234 177.5783 43 I 3.6925 7.4695 118.8624 64.0262 37.4831 177.2772 44 T 3.8961 7.7987 111.0931 63.2400 68.6589 175.1452 45 G 3.8148 8.1498 108.7789 46.2513 0.0000 172.8979 46 T 4.0859 7.7551 114.8898 60.5689 67.9889 174.7255 47 R 3.9553 8.5118 124.9829 56.4916 29.8531 177.3750 48 A 3.9005 8.6054 120.1354 55.2377 18.4052 179.5896 49 K 3.8651 8.2005 117.6521 60.2032 32.0311 178.1071 50 Y 3.9140 8.2676 115.9383 61.2833 37.8901 177.8251 51 Q 3.8570 7.9539 120.0003 59.6028 28.8781 179.4983 52 R 3.8755 7.7849 118.4634 59.3421 30.1818 178.6535 53 Q 3.9557 7.4954 117.4231 59.3532 28.7163 178.6977 54 L 3.7912 8.0942 120.8549 58.3943 42.1713 178.7101 55 A 4.0401 8.3809 120.3849 55.4706 17.9643 179.8036 56 R 3.9116 8.5391 116.5643 58.7677 29.9402 178.8617 57 A 4.2129 7.8151 120.2808 54.7948 19.2204 179.3648 58 I 3.5971 8.0906 117.0017 64.5282 37.4604 178.5434 59 K 3.8594 7.8919 118.9546 59.3722 32.0906 179.6031 60 R 4.2431 7.4667 118.5012 59.1434 29.9015 178.8515 61 A 4.0056 8.2335 120.4867 54.6430 18.2414 179.4410 62 R 4.3649 7.3127 117.5005 57.8565 30.1526 178.4849 63 Y 4.3727 7.3445 115.3565 60.5067 38.2032 176.3788 64 L 4.3156 7.9664 117.6620 54.1114 41.9888 177.8177 65 S 4.0345 7.9031 111.8646 58.4759 61.9913 171.5204 66 L 4.1528 7.7131 119.2429 58.2611 41.4658 177.3312 67 L 4.6238 7.9596 119.2355 52.2163 43.0833 174.4646 68 P 4.6335 0.0000 0.0000 62.6224 33.0774 173.8139 69 Y 3.9071 9.3296 120.9322 59.6412 37.4343 178.3989 70 T 4.7877 9.0301 120.4590 62.0699 67.6219 172.5246 71 D 4.7187 8.8244 112.5941 55.6345 45.5239 177.2978 72 R 3.8785 8.3017 113.7512 58.9260 29.2378 175.8877 73 H 4.4945 8.0662 118.4928 55.4383 29.1070 173.9569 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 19 E 8.30 4.25 0.00 2.01 2.21 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 2.18 1.94 0.00 20 I 7.63 3.57 1.80 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 1.34 0.86 0.86 0.00 0.00 21 D 7.20 4.44 0.00 2.65 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 0.00 0.00 0.00 0.00 22 Y 8.26 4.18 0.00 3.19 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 23 K 6.71 3.79 0.00 1.80 1.96 0.00 1.40 0.00 0.00 1.26 0.00 0.00 2.74 0.00 0.00 2.64 0.00 0.00 0.00 0.00 0.42 1.11 7.81 24 D 7.55 4.64 0.00 2.71 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 I 7.35 3.79 1.92 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.97 1.07 0.00 0.00 26 A 7.44 4.10 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.32 4.34 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 28 L 7.95 4.25 0.00 1.85 1.84 1.12 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 29 K 7.72 4.26 0.00 1.80 1.95 0.00 1.48 0.00 0.00 1.62 0.00 0.00 3.31 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.49 1.52 7.81 30 N 8.02 4.35 0.00 2.53 2.56 0.00 0.00 7.06 7.70 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 31 Y 7.99 4.89 0.00 3.02 2.93 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 32 I 7.64 4.93 1.94 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.57 0.94 0.00 0.00 33 T 9.21 4.05 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 1.22 0.00 0.00 34 E 8.76 4.34 0.00 1.98 2.01 0.00 0.00 0.00 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 2.23 0.00 35 S 7.26 4.95 0.00 3.95 3.95 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 36 G 8.12 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 37 K 7.98 4.23 0.00 1.76 1.74 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.42 7.81 38 I 8.05 4.37 1.86 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.47 0.92 0.00 0.00 39 V 8.03 3.81 2.14 0.00 0.00 0.00 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 1.04 0.00 0.00 40 P 0.00 4.47 0.00 2.23 1.98 0.00 3.66 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 2.13 2.10 0.00 41 S 8.55 4.33 0.00 4.24 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 42 R 8.08 3.83 0.00 1.95 2.11 0.00 3.06 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 43 I 7.47 3.69 1.90 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.82 0.92 0.00 0.00 44 T 7.80 3.90 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 45 G 8.15 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 46 T 7.76 4.09 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 1.26 0.00 0.00 47 R 8.51 3.96 0.00 1.93 1.93 0.00 2.21 0.00 0.00 2.96 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.46 0.00 48 A 8.61 3.90 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 49 K 8.20 3.87 0.00 1.88 2.09 0.00 1.78 0.00 0.00 1.82 0.00 0.00 3.18 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.56 1.58 7.81 50 Y 8.27 3.91 0.00 2.90 2.93 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 51 Q 7.95 3.86 0.00 2.25 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.82 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 52 R 7.78 3.88 0.00 2.05 1.95 0.00 3.20 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 53 Q 7.50 3.96 0.00 2.30 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.76 0.00 0.00 0.00 0.00 0.00 2.31 2.30 0.00 54 L 8.09 3.79 0.00 1.72 1.71 0.71 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.38 4.04 1.31 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 0.00 0.00 0.00 56 R 8.54 3.91 0.00 2.01 2.02 0.00 3.29 0.00 0.00 3.19 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.80 0.00 57 A 7.82 4.21 1.44 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 0.00 0.00 58 I 8.09 3.60 1.82 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 1.54 0.82 0.88 0.00 0.00 59 K 7.89 3.86 0.00 1.97 1.90 0.00 1.68 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.31 1.47 7.81 60 R 7.47 4.24 0.00 1.86 1.78 0.00 3.21 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.96 0.00 61 A 8.23 4.01 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 62 R 7.31 4.36 0.00 1.28 1.30 0.00 2.63 0.00 0.00 2.35 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.40 0.00 63 Y 7.34 4.37 0.00 3.07 2.97 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 64 L 7.97 4.32 0.00 1.71 1.68 0.66 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 65 S 7.90 4.03 0.00 4.02 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 L 7.71 4.15 0.00 1.79 1.78 1.10 0.96 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 67 L 7.96 4.62 0.00 1.63 1.53 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 68 P 0.00 4.63 0.00 2.21 2.09 0.00 3.78 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 2.00 2.00 0.00 69 Y 9.33 3.91 0.00 3.01 2.79 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 70 T 9.03 4.79 4.32 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 1.28 0.00 0.00 71 D 8.82 4.72 0.00 2.90 2.55 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 72 R 8.30 3.88 0.00 1.78 2.04 0.00 3.26 0.00 0.00 3.25 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 73 H 8.07 4.49 0.00 3.10 3.22 0.00 5.93 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00