NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 4.9427 8.1200 121.8647 55.1229 34.2499 174.8357 3 V 4.2873 7.9499 116.1914 59.3163 34.0495 173.1194 4 R 4.3162 8.0547 122.7074 56.1203 33.6102 174.5409 5 A 3.8580 8.8609 120.3154 54.6232 18.7086 177.8889 6 S 4.5289 7.8696 111.6675 56.6980 63.6570 173.4516 7 V 4.2793 8.2350 125.6461 60.9261 32.7915 174.5909 8 K 4.7121 8.0747 126.9502 55.3653 35.0119 175.5050 9 R 4.6816 8.4134 118.0984 55.8348 32.0425 176.0320 10 I 4.5999 8.0606 117.9875 61.0059 39.5606 175.1091 11 C 4.7357 7.6976 117.5203 58.7939 31.0034 172.6032 12 D 4.9159 8.8194 117.6926 53.8510 40.8123 176.3133 13 K 4.6590 7.2028 120.2091 53.2244 32.6839 172.7887 14 C 4.7582 7.8405 110.7575 57.4919 32.1238 174.1237 15 K 4.3425 8.8529 124.6091 54.7708 33.5937 177.3360 16 V 4.2622 7.7127 124.4343 61.8057 29.2398 175.9363 17 I 3.8225 7.5271 124.0254 61.7977 38.9697 176.9418 18 R 4.7934 8.6666 126.1071 54.2733 31.2436 173.5844 19 R 4.4758 8.4899 121.1547 55.3548 31.6916 175.7812 20 H 4.0767 9.1086 120.0356 57.0082 25.1505 177.5262 21 G 4.0440 8.3838 107.5052 46.0522 0.0000 174.4955 22 R 4.2420 7.9127 119.7492 55.0574 31.0734 175.7707 23 V 4.2346 8.1731 123.1640 62.5081 31.4335 174.8455 24 Y 4.6611 8.5621 126.3910 56.9407 40.4203 175.4483 25 V 4.6284 9.0554 119.9468 62.0985 35.0446 173.3914 26 I 4.8850 8.6454 128.6926 59.7967 40.1710 174.3195 27 C 5.2872 8.3563 124.6436 56.6143 34.9817 173.5754 28 E 4.0290 9.0014 121.0505 58.8667 29.4866 176.3912 29 N 4.6841 7.8938 116.8881 50.8418 38.6042 173.9952 30 P 4.2274 0.0000 0.0000 65.3832 31.3035 178.3064 31 K 4.0908 7.9964 117.2095 58.9323 32.0195 177.0401 32 H 4.6905 8.1231 114.3729 55.4030 29.4790 174.6521 33 K 4.2361 7.8786 120.2531 57.4616 32.5183 175.8169 34 Q 5.1937 9.0506 124.3891 54.2306 31.7535 174.8765 35 R 4.5982 9.1172 121.2368 54.8841 34.7680 173.0322 36 Q 4.8370 7.8857 121.2516 54.2871 31.2852 175.3344 37 G 3.7352 8.5833 114.9909 46.5405 0.0000 172.5330 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 2 K 8.12 4.94 0.00 1.83 1.64 0.00 1.71 0.00 0.00 2.01 0.00 0.00 2.85 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.42 1.24 7.81 3 V 7.95 4.29 2.06 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 0.84 0.00 0.00 0.90 0.00 0.00 4 R 8.05 4.32 0.00 1.99 1.98 0.00 2.82 0.00 0.00 3.16 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.60 0.00 5 A 8.86 3.86 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 6 S 7.87 4.53 0.00 3.96 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 7 V 8.24 4.28 2.06 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 0.88 0.00 0.00 0.89 0.00 0.00 8 K 8.07 4.71 0.00 1.77 1.69 0.00 1.72 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.35 1.36 7.81 9 R 8.41 4.68 0.00 1.77 1.82 0.00 3.15 0.00 0.00 3.22 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.62 0.00 10 I 8.06 4.60 1.36 0.00 0.00 0.74 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 0.49 0.77 0.00 0.00 11 C 7.70 4.74 0.00 2.94 2.92 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.82 4.92 0.00 2.74 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 K 7.20 4.66 0.00 1.71 1.75 0.00 1.71 0.00 0.00 1.87 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.41 1.40 7.81 14 C 7.84 4.76 0.00 2.93 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 15 K 8.85 4.34 0.00 1.73 1.76 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.38 7.81 16 V 7.71 4.26 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.94 0.00 0.00 17 I 7.53 3.82 1.89 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.04 0.87 0.00 0.00 18 R 8.67 4.79 0.00 1.80 1.83 0.00 3.19 0.00 0.00 3.30 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.63 0.00 19 R 8.49 4.48 0.00 1.61 1.71 0.00 2.37 0.00 0.00 2.82 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 1.14 0.00 20 H 9.11 4.08 0.00 3.56 3.54 0.00 5.73 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 G 8.38 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 22 R 7.91 4.24 0.00 2.30 1.65 0.00 3.30 0.00 0.00 3.01 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.80 0.00 23 V 8.17 4.23 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 1.01 0.00 0.00 24 Y 8.56 4.66 0.00 2.83 2.90 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 25 V 9.06 4.63 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 0.99 0.00 0.00 1.00 0.00 0.00 26 I 8.65 4.89 1.88 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.69 0.92 0.00 0.00 27 C 8.36 5.29 0.00 2.98 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 E 9.00 4.03 0.00 1.97 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 2.29 2.24 0.00 29 N 7.89 4.68 0.00 2.87 2.86 0.00 0.00 5.90 7.76 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 30 P 0.00 4.23 0.00 2.24 2.37 0.00 3.67 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.00 0.00 31 K 8.00 4.09 0.00 1.72 1.95 0.00 1.73 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.45 1.46 7.81 32 H 8.12 4.69 0.00 3.22 3.31 0.00 5.69 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 K 7.88 4.24 0.00 1.98 1.85 0.00 1.65 0.00 0.00 1.69 0.00 0.00 2.83 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.51 1.47 7.81 34 Q 9.05 5.19 0.00 2.01 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.57 0.00 0.00 0.00 0.00 0.00 2.27 2.41 0.00 35 R 9.12 4.60 0.00 1.57 1.54 0.00 2.62 0.00 0.00 2.90 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.50 0.00 36 Q 7.89 4.84 0.00 2.08 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.80 0.00 0.00 0.00 0.00 0.00 2.17 2.44 0.00 37 G 8.58 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00