NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 Q 4.2735 8.2033 121.7112 55.8175 29.8862 176.1229 6 T 3.7559 8.7964 109.6153 65.9381 68.3625 174.0887 7 W 3.8315 8.1909 129.6896 60.4976 31.1579 177.3152 8 E 3.5509 8.0952 117.3852 58.9206 29.3428 178.0877 9 E 3.8999 9.6719 119.4017 59.1454 29.8573 178.0075 10 F 3.9602 8.1737 121.3564 61.5774 39.3220 177.1193 11 S 2.7900 7.0935 113.5625 61.1900 62.3734 176.2057 12 R 3.6485 7.4152 119.1876 59.1226 28.9974 178.1954 13 A 3.8660 7.8279 121.2893 54.4022 18.1794 179.3461 14 A 3.8315 7.5010 118.7047 55.3659 18.7432 179.4871 15 E 4.1465 8.6038 116.0401 58.0088 29.3766 179.1793 16 K 4.0925 7.7849 120.7069 59.1690 32.1545 178.6454 17 L 3.9695 7.7363 119.0856 57.8813 41.3454 178.7149 18 Y 4.0242 8.3701 119.8587 60.7167 38.4591 178.3179 19 L 3.8871 7.4866 117.4772 57.4627 41.9024 178.4931 20 A 4.2986 7.6654 119.9889 54.4282 19.2481 177.2552 21 D 4.2840 7.3790 113.2755 53.2396 42.9489 173.8728 22 P 4.0329 0.0000 0.0000 62.5694 31.1372 177.0599 23 M 4.5031 7.7439 117.6400 55.4544 33.4927 176.0608 24 K 4.3469 7.8152 114.8986 56.5760 33.9502 176.0129 25 A 4.8219 7.6836 121.0174 50.8471 21.0172 175.3300 26 R 4.9271 8.5455 115.3562 55.0213 33.8145 174.5082 27 V 4.7099 8.1699 117.9222 60.2790 33.6379 175.7066 28 V 4.1929 8.9079 119.6333 60.7027 33.7512 175.9556 29 L 4.8456 8.2830 124.6403 54.3987 43.5245 174.8255 30 K 4.3899 9.3967 130.1561 55.1141 33.3194 174.3820 31 Y 4.6780 8.5692 129.9106 56.3418 39.8247 175.4084 32 R 4.1931 7.8684 128.7929 53.8236 29.2576 175.1508 33 H 3.4845 7.6723 123.8405 58.4688 30.4488 176.4166 34 S 4.0483 7.9205 108.9799 61.3849 62.1085 174.4274 35 D 4.2772 8.6638 125.2142 54.9557 41.6155 175.8641 36 G 3.6881 7.9585 109.4218 44.1248 0.0000 171.9234 37 N 4.5705 7.1647 117.7169 52.3809 40.4842 173.9547 38 L 5.0210 8.1339 122.9622 54.0681 45.7343 175.0674 39 C 4.6813 8.2580 121.9142 58.8601 34.9353 172.6097 40 V 5.0068 8.8462 127.3831 61.4783 33.7910 174.4778 41 K 5.3030 9.1730 127.0596 55.1269 35.8029 174.7510 42 V 4.9153 9.1872 126.5513 61.5735 34.4462 174.1266 43 T 4.9689 8.7992 121.2911 59.0220 71.9348 173.1146 44 D 4.7875 8.0506 119.5741 53.5928 42.2455 175.0034 45 D 4.5184 8.1538 113.5775 54.4986 38.9641 175.0450 46 L 4.4587 7.2531 112.3818 55.4833 44.7100 176.4586 47 V 4.1847 7.2384 108.4675 61.2410 33.3240 170.2564 48 C 4.7467 8.5330 121.7782 58.8475 27.9845 171.9210 49 L 4.9109 8.5574 123.6346 52.9487 43.0495 175.9952 50 V 5.1595 8.5420 123.0647 59.9898 34.8631 174.4387 51 Y 4.5872 9.2060 123.4529 55.9106 41.4724 174.0717 52 K 4.7673 8.2359 125.4168 55.1461 35.0317 175.5454 53 T 4.6224 8.1450 118.2709 62.4743 72.9018 174.3039 54 D 4.6169 8.4474 119.3621 53.3693 41.2536 176.3649 55 Q 4.1081 7.8233 118.2656 55.5857 29.5767 176.9581 56 A 3.9516 8.5311 122.7364 55.0727 18.4152 180.0172 57 Q 4.0496 8.0275 114.4172 58.7848 28.6136 177.6243 58 D 4.3878 7.5171 119.9602 55.2631 40.9960 178.4238 59 V 3.5261 7.5484 119.6651 65.8987 31.6165 177.2787 60 K 3.8599 8.0396 118.8858 59.8300 31.9029 178.1813 61 K 4.1082 7.8997 118.1177 60.1454 32.3257 178.8634 62 I 3.8725 7.2558 121.0799 64.0762 36.9304 178.2408 63 E 4.0727 8.6190 118.9208 59.4141 29.3681 179.4175 64 K 4.0477 8.3784 119.5289 59.1909 32.0821 179.1340 65 F 4.4783 8.8941 121.0394 61.2416 39.2351 176.6670 66 H 4.0287 8.0517 118.2601 59.2202 29.6184 177.0421 67 S 4.0073 8.1680 116.2321 61.9866 62.9815 176.4357 68 Q 3.9569 8.4936 122.3343 58.9658 28.9113 177.9475 69 L 3.4498 7.4114 119.5363 58.1179 41.6505 179.5877 70 M 3.9770 7.7330 117.7506 58.7355 32.2164 178.5583 71 R 3.9330 8.1929 118.5066 59.1035 29.9497 178.8113 72 L 4.1719 7.1969 116.1747 57.1310 41.7366 178.5562 73 M 4.7817 7.7100 119.1249 56.1750 32.2243 177.5592 74 V 4.1620 7.4410 115.4176 62.7660 32.6533 175.0630 75 A 4.1623 7.8979 125.7399 52.9050 18.1939 177.0139 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 5 Q 8.20 4.27 0.00 2.17 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.73 0.00 0.00 0.00 0.00 0.00 2.36 2.48 0.00 6 T 8.80 3.76 4.33 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 0.00 0.00 0.00 1.32 0.00 0.00 7 W 8.19 3.83 0.00 3.05 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 8 E 8.10 3.55 0.00 1.99 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 2.16 2.31 0.00 9 E 9.67 3.90 0.00 2.14 1.88 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 2.29 2.32 0.00 10 F 8.17 3.96 0.00 2.98 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 11 S 7.09 2.79 0.00 3.28 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 R 7.42 3.65 0.00 1.96 2.09 0.00 2.90 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.57 0.00 13 A 7.83 3.87 1.28 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 0.00 0.00 0.00 14 A 7.50 3.83 1.14 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 0.00 0.00 0.00 0.00 0.00 0.00 15 E 8.60 4.15 0.00 2.06 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 2.43 2.59 0.00 16 K 7.78 4.09 0.00 1.91 1.99 0.00 1.60 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.45 7.81 17 L 7.74 3.97 0.00 2.00 1.73 0.95 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 18 Y 8.37 4.02 0.00 3.05 3.01 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 19 L 7.49 3.89 0.00 1.85 1.69 0.98 0.91 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 20 A 7.67 4.30 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 21 D 7.38 4.28 0.00 2.56 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 22 P 0.00 4.03 0.00 1.66 1.14 0.00 3.20 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.66 0.00 23 M 7.74 4.50 0.00 1.85 2.01 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.48 0.00 24 K 7.82 4.35 0.00 1.77 1.91 0.00 1.73 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.36 1.62 7.81 25 A 7.68 4.82 1.30 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 0.00 0.00 0.00 26 R 8.55 4.93 0.00 1.90 2.04 0.00 2.77 0.00 0.00 3.26 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00 27 V 8.17 4.71 2.11 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 0.75 0.00 0.00 1.06 0.00 0.00 28 V 8.91 4.19 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 0.77 0.00 0.00 1.04 0.00 0.00 29 L 8.28 4.85 0.00 1.61 1.54 1.04 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 30 K 9.40 4.39 0.00 1.87 1.72 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.76 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.35 1.37 7.81 31 Y 8.57 4.68 0.00 2.95 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 R 7.87 4.19 0.00 1.80 1.72 0.00 3.28 0.00 0.00 3.24 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.42 0.00 33 H 7.67 3.48 0.00 3.04 3.17 0.00 5.75 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 S 7.92 4.05 0.00 3.97 3.75 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.66 4.28 0.00 2.58 2.76 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 36 G 7.96 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 0.00 0.00 0.00 37 N 7.16 4.57 0.00 2.83 2.78 0.00 0.00 5.60 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 L 8.13 5.02 0.00 1.87 1.50 1.01 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 39 C 8.26 4.68 0.00 2.95 2.88 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 40 V 8.85 5.01 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 1.24 0.00 0.00 41 K 9.17 5.30 0.00 1.96 1.69 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.84 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.47 1.59 7.81 42 V 9.19 4.92 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 1.04 0.00 0.00 1.17 0.00 0.00 43 T 8.80 4.97 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 1.26 0.00 0.00 44 D 8.05 4.79 0.00 2.74 2.52 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.15 4.52 0.00 2.88 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.25 4.46 0.00 1.80 1.61 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 47 V 7.24 4.18 2.11 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 0.71 0.00 0.00 0.95 0.00 0.00 48 C 8.53 4.75 0.00 2.90 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 49 L 8.56 4.91 0.00 1.96 1.91 0.92 0.76 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 50 V 8.54 5.16 2.17 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 0.75 0.00 0.00 0.98 0.00 0.00 51 Y 9.21 4.59 0.00 1.47 2.17 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 52 K 8.24 4.77 0.00 1.45 1.50 0.00 1.73 0.00 0.00 1.64 0.00 0.00 2.69 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.24 1.32 7.81 53 T 8.15 4.62 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 54 D 8.45 4.62 0.00 2.66 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.82 4.11 0.00 2.06 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.96 0.00 0.00 0.00 0.00 0.00 2.41 2.28 0.00 56 A 8.53 3.95 1.29 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 0.00 0.00 0.00 57 Q 8.03 4.05 0.00 2.19 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.95 0.00 0.00 0.00 0.00 0.00 2.30 2.42 0.00 58 D 7.52 4.39 0.00 2.43 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.55 3.53 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 1.02 0.00 0.00 0.89 0.00 0.00 60 K 8.04 3.86 0.00 1.83 1.80 0.00 1.78 0.00 0.00 1.87 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.54 1.55 7.81 61 K 7.90 4.11 0.00 2.21 2.12 0.00 1.12 0.00 0.00 1.00 0.00 0.00 3.00 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.25 0.58 7.81 62 I 7.26 3.87 2.04 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 1.39 0.23 1.03 0.00 0.00 63 E 8.62 4.07 0.00 2.23 2.36 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 2.30 2.66 0.00 64 K 8.38 4.05 0.00 2.16 2.01 0.00 1.73 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.52 1.80 7.81 65 F 8.89 4.48 0.00 3.52 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 66 H 8.05 4.03 0.00 3.40 3.51 0.00 5.86 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 67 S 8.17 4.01 0.00 3.98 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 Q 8.49 3.96 0.00 2.19 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.65 0.00 0.00 0.00 0.00 0.00 2.26 2.35 0.00 69 L 7.41 3.45 0.00 1.39 1.27 0.10 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 70 M 7.73 3.98 0.00 2.16 1.86 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.51 0.00 71 R 8.19 3.93 0.00 1.91 1.92 0.00 3.15 0.00 0.00 3.14 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.86 0.00 72 L 7.20 4.17 0.00 1.24 1.84 0.83 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 73 M 7.71 4.78 0.00 2.06 2.26 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.71 0.00 74 V 7.44 4.16 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 0.87 0.00 0.00 0.92 0.00 0.00 75 A 7.90 4.16 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