NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9002 8.3393 109.7364 44.9574 0.0000 173.1266 2 P 4.3499 0.0000 0.0000 62.3223 32.1671 173.5734 3 M 4.6160 8.0363 118.0441 53.7342 34.8563 178.8731 4 S 4.1700 8.4464 116.0349 60.5989 64.2230 176.4348 5 T 3.8646 7.9952 112.5238 64.9899 68.2412 175.9503 6 T 4.0868 7.4814 112.3643 64.5676 68.4209 176.0365 7 E 3.8899 8.2228 122.4543 59.3091 29.8590 179.1372 8 V 3.7158 7.6882 118.5041 64.2716 31.5831 178.2218 9 R 3.8219 8.4394 120.1945 59.3684 30.0242 178.0789 10 E 3.9203 7.9737 118.6700 59.3579 29.4626 178.7279 11 R 4.1257 7.6781 118.8022 58.8497 30.1899 178.1451 12 R 4.0363 8.1916 118.5853 59.0843 30.1660 178.6026 13 R 4.1213 8.0043 118.1372 59.0914 29.9840 178.9179 14 S 4.7273 8.5768 116.6973 60.9428 62.5268 175.9241 15 Y 4.3166 7.5193 119.6694 59.6320 37.5173 176.8850 16 L 4.3301 7.1611 121.4963 53.7911 42.8706 177.2798 17 T 3.8979 8.2408 116.5409 65.6229 68.7252 172.7535 18 P 4.7966 0.0000 0.0000 61.3731 30.4474 176.1734 19 V 3.7882 8.0048 124.9139 64.5360 31.6540 176.8376 20 R 3.9094 8.0693 115.5761 60.3600 28.6841 177.8611 21 D 4.3363 7.7627 116.9854 56.8993 41.2715 177.8066 22 E 3.8907 8.4607 120.4758 58.7855 29.5710 178.5025 23 E 3.9239 7.9933 119.1468 59.3638 29.8596 178.7437 24 S 4.1446 7.8712 114.8009 61.4405 62.9947 176.2815 25 E 3.9432 8.5155 122.7048 59.2756 29.4514 179.0777 26 S 4.1897 7.9821 113.9043 61.3285 63.2167 176.6188 27 Q 3.9453 8.1734 121.6571 58.9394 28.6345 178.7335 28 R 3.9672 8.3315 119.4528 59.1066 29.9802 179.4044 29 K 3.9744 8.0237 117.7642 59.4175 32.2339 179.3227 30 A 4.0597 7.9617 120.9286 55.0067 18.2285 179.7255 31 R 3.8679 7.9486 117.3062 59.5563 30.1003 178.6712 32 S 4.1433 8.0525 112.9003 61.0103 62.4877 176.1218 33 R 3.8534 8.3798 121.9630 59.6871 29.9114 178.6394 34 Q 4.0410 8.0441 117.2150 58.4775 28.6588 178.5329 35 A 3.9192 8.0524 121.9943 55.3115 18.5320 179.7429 36 R 3.8622 8.2315 117.4926 59.5258 30.1908 178.5013 37 Q 4.0081 8.0881 119.5882 58.9629 29.1433 178.2814 38 S 4.1780 8.1506 115.5868 61.2378 63.0500 176.7535 39 R 3.8910 8.0090 121.9092 59.1177 29.7218 179.2850 40 R 4.4769 7.6626 115.7686 58.7771 29.3703 178.7315 41 S 4.2267 7.7490 115.0789 61.9211 62.9785 176.1412 42 T 4.0286 7.5213 116.6480 65.8360 68.8367 173.8851 43 Q 4.4995 7.4590 116.9951 55.6783 33.9050 174.6261 44 G 3.5111 8.0210 106.7583 47.0211 0.0000 176.3238 45 V 3.4042 8.0818 116.3975 62.5973 31.1488 171.6421 46 T 3.6584 7.7602 113.4483 64.7637 66.7932 172.3840 47 L 4.6616 7.8904 119.3848 56.1132 45.5477 179.3237 48 T 3.9259 7.9294 114.8350 66.3598 68.2826 176.3728 49 D 4.3801 8.0587 121.0152 56.2098 39.5322 178.2274 50 L 3.9425 7.6866 121.9654 57.9595 42.1058 178.8356 51 Q 3.9514 7.9593 118.9858 59.2708 29.0701 177.7713 52 E 3.9725 8.2166 119.4696 59.3676 29.4457 179.2060 53 A 4.1595 8.4479 122.6184 54.5415 18.1611 179.3323 54 E 3.9247 7.8709 116.7810 59.0839 29.7888 178.6242 55 K 4.1139 7.9644 119.2869 59.6141 32.4732 178.6449 56 T 3.8918 8.2976 110.4662 62.2889 68.5765 173.6100 57 I 3.1517 7.0931 124.4949 60.2498 37.2097 173.6186 58 G 4.0089 8.3654 108.9662 44.3243 0.0000 171.6022 59 R 4.9556 8.3299 128.1658 54.3938 32.9475 176.5509 60 S 4.2633 8.4616 115.0915 59.7287 63.7951 173.7691 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 8.34 3.90 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 0.00 0.00 0.00 0.00 0.00 0.00 2 P 0.00 4.35 0.00 2.27 2.08 0.00 3.75 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 1.98 2.05 0.00 3 M 8.04 4.62 0.00 2.09 2.00 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.50 0.00 4 S 8.45 4.17 0.00 4.00 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 5 T 8.00 3.86 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 1.21 0.00 0.00 6 T 7.48 4.09 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 1.21 0.00 0.00 7 E 8.22 3.89 0.00 2.11 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 0.00 2.30 2.36 0.00 8 V 7.69 3.72 2.07 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 0.88 0.00 0.00 0.91 0.00 0.00 9 R 8.44 3.82 0.00 1.93 2.10 0.00 3.09 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 10 E 7.97 3.92 0.00 2.24 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.33 0.00 11 R 7.68 4.13 0.00 2.11 1.95 0.00 3.17 0.00 0.00 3.01 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.51 0.00 12 R 8.19 4.04 0.00 2.01 1.99 0.00 3.05 0.00 0.00 3.07 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.52 0.00 13 R 8.00 4.12 0.00 2.20 2.03 0.00 3.40 0.00 0.00 3.29 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.85 0.00 14 S 8.58 4.73 0.00 3.94 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 15 Y 7.52 4.32 0.00 3.29 3.23 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 0.00 16 L 7.16 4.33 0.00 0.27 0.39 0.69 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 17 T 8.24 3.90 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 1.21 0.00 0.00 18 P 0.00 4.80 0.00 2.17 2.18 0.00 3.51 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.90 0.00 19 V 8.00 3.79 2.05 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 1.20 0.00 0.00 0.94 0.00 0.00 20 R 8.07 3.91 0.00 2.05 2.19 0.00 2.99 0.00 0.00 3.24 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.68 0.00 21 D 7.76 4.34 0.00 2.75 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.46 3.89 0.00 1.96 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.43 0.00 23 E 7.99 3.92 0.00 2.10 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 2.36 2.66 0.00 24 S 7.87 4.14 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 25 E 8.52 3.94 0.00 2.08 1.95 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 2.30 2.31 0.00 26 S 7.98 4.19 0.00 4.10 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 0.00 27 Q 8.17 3.95 0.00 2.41 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.83 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 28 R 8.33 3.97 0.00 1.90 1.98 0.00 3.12 0.00 0.00 3.16 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.87 0.00 29 K 8.02 3.97 0.00 2.00 1.85 0.00 1.67 0.00 0.00 1.74 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.45 7.81 30 A 7.96 4.06 1.41 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 0.00 0.00 0.00 31 R 7.95 3.87 0.00 2.05 2.03 0.00 3.09 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 32 S 8.05 4.14 0.00 3.97 3.83 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 0.00 0.00 0.00 33 R 8.38 3.85 0.00 2.09 1.90 0.00 3.14 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 1.63 1.67 0.00 34 Q 8.04 4.04 0.00 2.36 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 35 A 8.05 3.92 1.42 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 0.00 0.00 0.00 36 R 8.23 3.86 0.00 1.95 1.95 0.00 3.10 0.00 0.00 3.09 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 37 Q 8.09 4.01 0.00 2.33 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.59 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 38 S 8.15 4.18 0.00 4.11 4.22 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.01 3.89 0.00 2.13 2.01 0.00 3.13 0.00 0.00 3.22 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.63 0.00 40 R 7.66 4.48 0.00 1.96 2.07 0.00 3.22 0.00 0.00 3.08 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.73 0.00 41 S 7.75 4.23 0.00 4.05 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 42 T 7.52 4.03 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 1.21 0.00 0.00 43 Q 7.46 4.50 0.00 2.05 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.80 0.00 0.00 0.00 0.00 0.00 2.12 2.11 0.00 44 G 8.02 3.51 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 0.00 0.00 0.00 45 V 8.08 3.40 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 0.88 0.00 0.00 0.98 0.00 0.00 46 T 7.76 3.66 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 1.21 0.00 0.00 47 L 7.89 4.66 0.00 1.77 1.60 0.99 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 48 T 7.93 3.93 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 1.21 0.00 0.00 49 D 8.06 4.38 0.00 2.86 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 50 L 7.69 3.94 0.00 1.75 1.70 0.92 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 51 Q 7.96 3.95 0.00 2.16 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.68 0.00 0.00 0.00 0.00 0.00 2.42 2.45 0.00 52 E 8.22 3.97 0.00 2.22 1.98 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 2.33 2.47 0.00 53 A 8.45 4.16 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.87 3.92 0.00 2.17 2.07 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 2.32 2.31 0.00 55 K 7.96 4.11 0.00 1.79 1.94 0.00 1.75 0.00 0.00 1.75 0.00 0.00 3.16 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.45 1.49 7.81 56 T 8.30 3.89 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 1.26 0.00 0.00 57 I 7.09 3.15 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 1.26 0.60 0.91 0.00 0.00 58 G 8.37 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 0.00 0.00 0.00 59 R 8.33 4.96 0.00 1.77 1.87 0.00 3.15 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 1.52 1.60 0.00 60 S 8.46 4.26 0.00 3.80 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00