NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.3780 8.1733 120.1300 56.9902 34.7354 173.6792 2 D 4.8962 9.0544 118.8139 51.5708 44.9552 174.6517 3 G 3.7521 6.6139 106.0419 47.0103 0.0000 169.7091 4 Y 5.2073 8.1178 117.5645 54.6480 40.0652 174.0087 5 P 4.7785 0.0000 0.0000 63.1015 32.9571 176.2578 6 V 5.5839 8.6653 116.2692 59.6604 34.7562 173.4239 7 D 5.1320 8.1397 120.3841 52.0703 41.5920 176.5997 8 S 4.1922 8.7072 112.2980 61.0500 62.9520 174.7239 9 K 4.1443 8.2452 120.4568 56.4890 32.6324 176.8659 10 G 4.0408 8.3685 106.5913 45.6300 0.0000 172.3897 11 C 4.7628 8.7249 117.3290 54.7149 41.6491 173.7462 12 K 4.4898 8.4558 122.3826 56.7823 32.4413 176.3245 13 L 4.2740 8.4248 124.4861 54.6402 43.0871 176.0231 14 S 4.8392 8.9148 123.4188 59.1609 62.5644 172.7570 15 C 5.2310 9.0615 120.9033 54.2861 43.6506 174.7787 16 V 4.2163 8.4018 116.7710 60.7626 32.4563 175.5500 17 A 4.6526 7.5517 120.8238 49.9929 23.0234 176.7048 18 N 4.3878 8.7187 119.6578 56.3924 38.8354 177.3685 19 N 4.2636 8.3239 118.0696 56.6001 37.0315 175.8183 20 Y 4.2290 8.1824 121.1860 60.7811 38.8021 178.6829 21 C 3.7684 8.0253 116.6458 59.9181 34.6671 175.4129 22 D 4.3564 8.7583 120.2033 57.6533 40.7635 178.3231 23 N 4.2438 8.1565 117.0297 56.8779 38.8061 176.2516 24 Q 3.8035 7.5648 119.5050 59.2236 29.3115 177.0806 25 C 4.0692 8.4582 117.5888 60.3810 35.3409 175.9175 26 K 3.6916 7.7592 119.8375 60.4325 31.4433 178.0519 27 M 3.9950 7.7574 117.9354 58.0255 32.4984 177.5273 28 K 4.3789 8.4720 119.1123 57.4776 32.6641 176.8019 29 K 3.7703 7.5412 114.4282 57.0706 31.5403 173.9487 30 A 4.6344 7.2634 120.1166 50.5613 20.9076 177.1335 31 S 4.3364 8.5932 108.8738 59.1225 66.1379 174.6828 32 G 3.9751 8.3410 108.3033 44.3347 0.0000 171.1883 33 G 4.5630 8.4456 112.7361 44.7409 0.0000 169.6351 34 H 5.2623 8.6352 120.6911 53.9242 33.0151 171.6356 35 C 5.1247 9.0451 119.8928 55.4661 45.1709 172.2407 36 Y 4.4019 9.0172 128.1506 56.5101 40.5075 175.3784 37 A 3.7750 9.2137 130.8391 54.0715 16.2624 176.8961 38 M 3.4959 8.1014 115.3240 55.9444 30.4708 176.5166 39 S 5.3960 8.0816 115.3982 56.7509 65.8061 172.8170 40 C 5.0222 9.1149 124.8646 56.7898 39.3320 171.7366 41 Y 4.6668 8.5762 125.3021 56.2305 41.9270 172.7838 42 C 5.6781 7.9099 123.3698 54.4305 40.4663 172.5724 43 E 4.5223 8.5995 124.0766 57.8649 30.7167 175.0986 44 G 3.7880 9.0575 116.8177 45.2987 0.0000 173.0558 45 L 4.2506 7.9064 120.7849 53.5817 42.3122 175.2841 46 P 4.4116 0.0000 0.0000 62.2979 31.9324 177.0947 47 E 3.6880 8.8200 121.7675 58.7752 29.4998 177.2081 48 N 4.8209 7.8889 113.7950 52.3147 37.6664 174.7406 49 A 4.1215 8.3412 121.9589 53.0524 19.1799 178.7788 50 K 4.4644 8.2270 122.0240 54.7725 30.9936 175.1080 51 V 4.9374 7.6794 116.0539 59.1571 35.6275 174.8406 52 S 4.6888 9.0443 118.3074 57.0557 64.0451 173.1278 53 D 5.0969 8.3546 118.9542 52.2888 39.4407 175.3864 54 S 4.4817 7.3947 112.5624 58.5324 65.9192 173.3870 55 A 4.1512 8.3411 121.5565 51.9586 18.2678 177.1838 56 T 4.5671 7.4576 107.4464 61.1500 71.6956 172.7923 57 N 5.0017 8.4877 121.0275 51.4197 40.6926 174.5881 58 I 4.2607 7.8312 117.6776 60.4598 36.1261 175.4906 59 C 4.5870 8.6014 122.1075 55.3159 45.0883 173.4293 60 G 3.7565 8.4309 109.8625 45.8091 0.0000 173.5758 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 K 8.17 4.38 0.00 1.82 2.01 0.00 1.38 0.00 0.00 1.79 0.00 0.00 3.15 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.50 1.41 7.81 2 D 9.05 4.90 0.00 2.70 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 G 6.61 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 0.00 0.00 0.00 4 Y 8.12 5.21 0.00 3.06 2.99 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 0.00 0.00 0.00 5 P 0.00 4.78 0.00 2.09 2.11 0.00 3.87 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.91 0.00 6 V 8.67 5.58 2.22 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 0.91 0.00 0.00 0.98 0.00 0.00 7 D 8.14 5.13 0.00 2.90 2.85 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 8 S 8.71 4.19 0.00 4.00 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 0.00 9 K 8.25 4.14 0.00 1.74 2.02 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.36 1.42 7.81 10 G 8.37 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.72 4.76 0.00 3.39 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 12 K 8.46 4.49 0.00 1.75 1.80 0.00 1.56 0.00 0.00 1.31 0.00 0.00 2.95 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.49 1.42 7.81 13 L 8.42 4.27 0.00 1.87 1.65 1.07 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.91 4.84 0.00 3.82 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 15 C 9.06 5.23 0.00 3.29 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 16 V 8.40 4.22 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 0.63 0.00 0.00 0.90 0.00 0.00 17 A 7.55 4.65 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 18 N 8.72 4.39 0.00 2.79 2.92 0.00 0.00 6.63 6.94 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 19 N 8.32 4.26 0.00 2.96 3.14 0.00 0.00 5.86 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 Y 8.18 4.23 0.00 3.07 3.32 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 21 C 8.03 3.77 0.00 3.11 3.04 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.76 4.36 0.00 2.74 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 23 N 8.16 4.24 0.00 2.91 2.86 0.00 0.00 6.88 6.01 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 24 Q 7.56 3.80 0.00 1.62 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.59 0.00 0.00 0.00 0.00 0.00 2.18 2.33 0.00 25 C 8.46 4.07 0.00 2.96 3.08 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 0.00 0.00 0.00 26 K 7.76 3.69 0.00 2.08 1.92 0.00 1.53 0.00 0.00 1.63 0.00 0.00 3.06 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.54 7.81 27 M 7.76 4.00 0.00 2.03 2.31 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.60 0.00 28 K 8.47 4.38 0.00 1.84 1.73 0.00 1.91 0.00 0.00 1.50 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.37 1.39 7.81 29 K 7.54 3.77 0.00 1.81 1.76 0.00 1.77 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.34 1.34 7.81 30 A 7.26 4.63 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 31 S 8.59 4.34 0.00 3.83 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 32 G 8.34 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 33 G 8.45 4.56 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 0.00 0.00 0.00 34 H 8.64 5.26 0.00 3.35 3.41 0.00 5.25 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 C 9.05 5.12 0.00 3.31 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 36 Y 9.02 4.40 0.00 3.17 2.89 0.00 0.00 0.00 0.00 0.00 0.00 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 A 9.21 3.78 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.10 3.50 0.00 2.28 2.18 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.52 0.00 39 S 8.08 5.40 0.00 4.01 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 40 C 9.11 5.02 0.00 3.27 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 41 Y 8.58 4.67 0.00 2.56 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 0.00 0.00 0.00 42 C 7.91 5.68 0.00 2.67 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 43 E 8.60 4.52 0.00 2.18 1.96 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 2.30 2.54 0.00 44 G 9.06 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 0.00 0.00 0.00 45 L 7.91 4.25 0.00 1.64 1.54 0.72 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 46 P 0.00 4.41 0.00 2.19 2.14 0.00 3.66 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.91 0.00 47 E 8.82 3.69 0.00 1.93 2.04 0.00 0.00 0.00 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 2.31 0.00 48 N 7.89 4.82 0.00 2.84 2.85 0.00 0.00 5.99 7.25 0.00 0.00 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 A 8.34 4.12 1.21 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 50 K 8.23 4.46 0.00 1.83 1.69 0.00 1.66 0.00 0.00 1.82 0.00 0.00 2.82 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.44 7.81 51 V 7.68 4.94 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 0.65 0.00 0.00 0.90 0.00 0.00 52 S 9.04 4.69 0.00 3.88 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 53 D 8.35 5.10 0.00 2.79 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 54 S 7.39 4.48 0.00 4.07 3.84 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 55 A 8.34 4.15 1.16 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 56 T 7.46 4.57 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 1.18 0.00 0.00 57 N 8.49 5.00 0.00 2.79 2.84 0.00 0.00 6.04 7.81 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 58 I 7.83 4.26 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 1.30 0.90 0.91 0.00 0.00 59 C 8.60 4.59 0.00 3.16 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 60 G 8.43 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