NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 4.2390 8.2549 120.8559 55.7044 31.2556 174.8437 2 V 3.7257 8.0004 114.1319 59.3856 32.0865 174.7813 3 K 4.2764 8.2616 120.1670 57.8801 35.1620 176.2548 4 R 4.0861 7.4920 115.1626 55.9656 31.1955 172.7064 5 V 4.0537 7.9893 124.3612 62.7692 32.6103 175.1454 6 W 4.9210 7.2359 122.6688 54.5411 30.4137 175.1795 7 P 4.5514 0.0000 0.0000 64.8543 31.1680 177.8192 8 L 4.4450 7.7974 117.4037 57.5657 41.4214 178.3898 9 V 3.6133 7.9073 118.5231 66.2365 31.2998 177.8135 10 I 3.8728 7.6782 119.4380 64.5563 37.1051 178.4001 11 R 3.6154 7.7576 118.9915 59.1149 29.6310 178.6434 12 T 3.9821 7.8562 109.7845 64.8952 69.2521 177.1917 13 V 3.7264 7.7882 121.2879 65.3335 31.6210 177.8956 14 I 3.8317 8.7661 120.3192 63.9575 36.9068 177.3424 15 A 4.5356 7.9180 118.4435 52.7223 18.6235 178.2955 16 G 4.1711 7.8107 102.7154 44.8570 0.0000 174.2766 17 Y 4.6956 7.8887 115.4768 58.3896 40.7308 175.2312 18 N 5.0548 8.3990 115.2203 53.0073 40.6365 174.7079 19 L 4.4841 7.9515 116.8254 56.3945 43.0299 176.3706 20 Y 4.6815 7.4968 113.8847 58.3376 39.8459 177.8301 21 R 3.7916 6.6232 118.0698 58.4591 30.3641 178.6151 22 A 4.0552 7.2066 119.3296 55.1995 18.3789 179.3437 23 I 3.6337 7.7683 117.7372 64.9152 37.0408 178.6053 24 K 4.0048 8.1439 117.5539 58.6326 32.1714 177.8764 25 K 4.5318 7.7533 118.5074 56.0914 33.1756 176.4964 26 K 4.1208 7.6646 125.6690 56.7502 32.1265 176.0460 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 R 8.25 4.24 0.00 1.74 1.88 0.00 3.23 0.00 0.00 3.19 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.67 0.00 2 V 8.00 3.73 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 0.60 0.00 0.00 0.81 0.00 0.00 3 K 8.26 4.28 0.00 1.81 1.88 0.00 1.61 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.29 1.32 7.81 4 R 7.49 4.09 0.00 1.72 1.82 0.00 3.21 0.00 0.00 3.14 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.54 0.00 5 V 7.99 4.05 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 1.02 0.00 0.00 0.71 0.00 0.00 6 W 7.24 4.92 0.00 3.48 2.94 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 0.00 0.00 0.00 7 P 0.00 4.55 0.00 2.07 2.14 0.00 3.77 0.00 0.00 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.19 0.00 8 L 7.80 4.44 0.00 1.93 1.94 0.93 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 9 V 7.91 3.61 2.40 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 0.87 0.00 0.00 0.81 0.00 0.00 10 I 7.68 3.87 2.04 0.00 0.00 0.65 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 1.14 0.93 0.00 0.00 11 R 7.76 3.62 0.00 2.22 2.13 0.00 3.11 0.00 0.00 3.25 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 12 T 7.86 3.98 4.27 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 13 V 7.79 3.73 2.19 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 1.12 0.00 0.00 1.11 0.00 0.00 14 I 8.77 3.83 1.95 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 1.69 1.05 0.93 0.00 0.00 15 A 7.92 4.54 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.81 4.17 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 0.00 0.00 0.00 17 Y 7.89 4.70 0.00 3.11 2.71 0.00 0.00 0.00 0.00 0.00 0.00 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 8.40 5.05 0.00 2.62 2.82 0.00 0.00 7.04 7.05 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 19 L 7.95 4.48 0.00 1.85 1.88 1.04 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 20 Y 7.50 4.68 0.00 3.12 3.11 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 21 R 6.62 3.79 0.00 1.53 1.91 0.00 3.40 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.82 0.00 22 A 7.21 4.06 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 23 I 7.77 3.63 1.91 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 1.74 1.49 0.93 0.00 0.00 24 K 8.14 4.00 0.00 1.89 1.93 0.00 1.78 0.00 0.00 1.76 0.00 0.00 3.09 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.53 1.70 7.81 25 K 7.75 4.53 0.00 1.99 1.80 0.00 1.78 0.00 0.00 1.60 0.00 0.00 3.08 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.40 1.46 7.81 26 K 7.66 4.12 0.00 1.89 1.69 0.00 1.72 0.00 0.00 1.74 0.00 0.00 3.32 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.45 1.42 7.81