NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4709 8.3044 120.6141 55.3338 33.4246 173.9890 2 K 4.3046 8.1142 124.8588 53.7712 34.2524 170.3175 3 V 4.6502 9.2178 129.3930 61.3481 31.9567 174.6913 4 R 4.6195 8.3203 126.5913 54.7082 31.9985 176.8007 5 S 4.2569 8.6677 113.8517 58.9309 62.7216 173.8005 6 S 4.4129 7.7772 113.1989 57.3884 63.1259 173.3296 7 V 4.2072 7.8903 129.1730 60.7822 30.8346 175.0733 8 K 4.8775 8.0220 128.0335 55.1185 34.6770 175.5036 9 K 4.5619 8.4813 117.1858 55.7208 33.9779 175.7614 10 M 4.7167 7.9179 120.7030 54.5676 33.1372 175.5872 11 C 4.6908 6.9965 111.9362 58.5860 33.0215 172.1962 12 D 5.0297 8.6742 112.9857 53.7485 40.6779 176.3071 13 N 4.9919 7.7348 112.6340 52.8930 43.0298 175.0269 14 C 3.6406 8.2219 116.2557 60.1247 28.8074 174.2017 15 K 4.3635 8.4766 125.0514 54.5364 31.5825 174.1316 16 V 4.0144 8.0171 122.2186 62.7723 32.1945 174.7351 17 V 4.5354 9.2166 127.9837 61.2767 35.3981 175.2891 18 R 5.1484 8.1899 121.8828 55.2322 32.7978 175.6136 19 R 4.5329 7.9043 130.5024 55.3731 28.6249 178.9895 20 H 3.9142 9.2695 130.7988 58.3649 29.2664 175.7581 21 G 3.8444 8.3935 119.9734 45.7740 0.0000 172.2884 22 R 4.5673 7.2901 119.4975 54.8992 34.0353 174.5374 23 V 5.0428 7.8270 121.9360 61.0389 31.2586 175.9461 24 L 4.3077 7.5543 121.2657 55.4303 43.1712 178.0091 25 V 4.7533 8.5170 122.6798 60.3892 33.9094 175.4838 26 I 4.8392 8.2354 120.0277 60.1706 35.9249 174.8015 27 C 4.5608 7.9405 121.7743 59.3070 32.9942 172.9318 28 S 4.2408 8.8269 118.4339 61.4648 62.3229 174.8972 29 N 4.6117 7.9657 117.4450 52.9319 39.7050 174.4406 30 V 4.0885 8.1184 114.2959 63.2002 32.7145 178.5932 31 K 4.3376 8.0086 114.7144 57.3779 31.2224 176.8368 32 H 5.0233 7.8020 116.4350 55.8675 30.7016 174.8998 33 K 4.2322 8.4796 119.7296 56.9212 32.9397 176.3327 34 Q 4.9564 8.2788 122.8740 54.4217 33.6481 174.0972 35 R 4.6872 8.1700 117.9578 55.2929 33.3998 174.0410 36 Q 4.7142 9.5637 126.0796 52.0670 28.4980 175.5178 37 G 3.6163 7.9439 110.4751 45.8498 0.0000 170.2941 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 M 8.30 4.47 0.00 2.03 2.06 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.61 0.00 2 K 8.11 4.30 0.00 1.77 1.66 0.00 1.84 0.00 0.00 1.67 0.00 0.00 2.83 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.34 1.45 7.81 3 V 9.22 4.65 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 1.32 0.00 0.00 0.97 0.00 0.00 4 R 8.32 4.62 0.00 1.84 1.83 0.00 3.26 0.00 0.00 3.16 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.61 0.00 5 S 8.67 4.26 0.00 3.83 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 6 S 7.78 4.41 0.00 3.81 3.73 0.00 0.00 0.00 0.00 0.00 0.00 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 7.89 4.21 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 0.92 0.00 0.00 0.98 0.00 0.00 8 K 8.02 4.88 0.00 1.86 1.76 0.00 1.59 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.29 1.41 7.81 9 K 8.48 4.56 0.00 1.70 1.71 0.00 1.56 0.00 0.00 1.69 0.00 0.00 3.06 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.33 1.46 7.81 10 M 7.92 4.72 0.00 2.06 2.04 0.00 0.00 0.00 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.49 0.00 11 C 7.00 4.69 0.00 3.05 2.98 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 12 D 8.67 5.03 0.00 2.58 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 0.00 0.00 0.00 0.00 13 N 7.73 4.99 0.00 2.58 2.77 0.00 0.00 7.19 7.66 0.00 0.00 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 C 8.22 3.64 0.00 2.81 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 15 K 8.48 4.36 0.00 1.70 1.74 0.00 1.68 0.00 0.00 1.74 0.00 0.00 2.82 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.77 1.36 7.81 16 V 8.02 4.01 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 0.73 0.00 0.00 0.92 0.00 0.00 17 V 9.22 4.54 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 0.93 0.00 0.00 0.98 0.00 0.00 18 R 8.19 5.15 0.00 1.78 1.81 0.00 3.67 0.00 0.00 3.87 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.54 0.00 19 R 7.90 4.53 0.00 1.81 1.41 0.00 3.23 0.00 0.00 3.16 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 20 H 9.27 3.91 0.00 3.06 3.30 0.00 5.98 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 G 8.39 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 0.00 0.00 0.00 22 R 7.29 4.57 0.00 2.01 1.71 0.00 3.19 0.00 0.00 3.29 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.68 0.00 23 V 7.83 5.04 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 0.85 0.00 0.00 0.93 0.00 0.00 24 L 7.55 4.31 0.00 1.69 1.58 0.93 0.76 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 25 V 8.52 4.75 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 1.05 0.00 0.00 0.98 0.00 0.00 26 I 8.24 4.84 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 1.23 0.90 0.91 0.00 0.00 27 C 7.94 4.56 0.00 2.92 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 28 S 8.83 4.24 0.00 4.03 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 N 7.97 4.61 0.00 2.73 2.69 0.00 0.00 6.91 7.71 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 30 V 8.12 4.09 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 0.71 0.00 0.00 0.92 0.00 0.00 31 K 8.01 4.34 0.00 1.66 1.80 0.00 1.57 0.00 0.00 1.68 0.00 0.00 3.11 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.51 7.81 32 H 7.80 5.02 0.00 3.05 3.28 0.00 5.73 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 K 8.48 4.23 0.00 1.78 1.76 0.00 1.61 0.00 0.00 1.65 0.00 0.00 2.85 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.44 7.81 34 Q 8.28 4.96 0.00 1.99 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.68 0.00 0.00 0.00 0.00 0.00 2.27 2.54 0.00 35 R 8.17 4.69 0.00 1.85 1.71 0.00 3.13 0.00 0.00 3.27 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 36 Q 9.56 4.71 0.00 2.01 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.05 0.00 0.00 0.00 0.00 0.00 2.23 2.31 0.00 37 G 7.94 3.62 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00