NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3699 8.2649 123.5824 52.0156 19.7769 176.1046 2 I 4.5512 8.2002 123.1988 59.0672 40.9467 173.4520 3 G 3.8862 9.3556 112.4887 45.5430 0.0000 172.6688 4 N 4.0897 8.1126 115.2859 53.6081 35.1694 173.7020 5 M 3.7420 8.2208 117.9568 56.5820 32.3697 175.1995 6 E 3.6338 8.5035 129.7044 57.2148 27.9263 173.5046 7 Q 4.3503 7.6194 116.7859 53.6087 30.8193 174.6923 8 P 4.4173 0.0000 0.0000 63.1273 30.4911 175.8192 9 H 4.8370 8.4066 122.5410 53.9621 28.6673 174.7535 10 M 4.7381 7.9821 125.6925 53.7509 31.0225 178.9837 11 D 4.7308 7.4082 117.6397 53.4568 42.9371 173.9380 12 S 4.7053 8.0347 114.8491 56.5557 64.9561 174.8304 13 R 4.3902 8.4843 124.2607 57.0878 31.7700 176.0928 14 I 4.0619 7.4622 116.2942 61.3999 38.8149 174.3073 15 G 3.7301 9.4305 113.1402 45.1389 0.0000 175.5955 16 W 4.3721 8.9941 120.4351 59.9139 27.3392 178.1919 17 L 3.7560 6.5906 118.6781 56.6001 40.6090 177.7215 18 H 5.1093 8.1826 115.4319 55.3076 29.2547 174.6996 19 N 4.8390 8.0012 119.9592 54.7371 41.0386 176.6151 20 L 4.1701 8.0623 118.6193 58.8154 40.2390 179.1700 21 G 3.6893 7.4868 105.1052 46.9191 0.0000 174.5921 22 D 4.6659 7.9524 121.1032 56.4610 41.3140 178.6515 23 Q 3.9111 8.0451 116.7378 59.6996 28.5085 178.2607 24 I 3.9531 7.8394 121.2286 59.6374 37.4808 178.9833 25 G 4.3359 7.1038 109.7114 46.5343 0.0000 174.9619 26 K 4.3352 8.8035 129.5270 53.6482 31.7429 173.0303 27 P 4.4333 0.0000 0.0000 64.4488 31.5066 178.6848 28 Y 4.4458 8.3830 114.4992 57.9887 38.6218 175.3822 29 N 3.6034 8.9862 114.7280 57.0895 36.3067 173.3538 30 S 2.7900 7.8257 113.3766 59.1028 59.8614 169.3894 31 S 4.0529 6.4307 118.1087 56.0399 62.1002 171.3998 32 G 4.3143 7.3553 118.4856 46.2240 0.0000 172.9404 33 L 4.0813 7.8373 120.6393 55.3634 42.5741 176.2537 34 G 4.1383 8.1596 109.2651 44.7112 0.0000 174.4337 35 G 4.1961 8.2676 112.8805 42.1740 0.0000 170.7846 36 P 4.2049 0.0000 0.0000 66.0603 31.5904 177.7731 37 S 4.0935 8.0669 110.1951 61.6171 62.5301 176.0201 38 I 3.9820 7.7096 121.5992 64.4947 36.8311 177.9667 39 K 3.9511 7.7669 119.1677 59.6846 30.5269 177.3852 40 D 4.5762 8.1904 117.3978 56.0034 41.1285 178.0178 41 K 4.1502 8.6375 119.6195 58.4230 32.2347 176.0747 42 Y 4.2091 7.5817 119.9411 58.0446 38.1067 175.2643 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 A 8.26 4.37 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 2 I 8.20 4.55 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 1.35 0.34 0.96 0.00 0.00 3 G 9.36 3.89 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 0.00 0.00 0.00 4 N 8.11 4.09 0.00 3.01 3.06 0.00 0.00 6.75 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 M 8.22 3.74 0.00 1.97 2.05 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.50 0.00 6 E 8.50 3.63 0.00 2.10 1.94 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 2.16 2.29 0.00 7 Q 7.62 4.35 0.00 2.32 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.85 0.00 0.00 0.00 0.00 0.00 2.35 2.30 0.00 8 P 0.00 4.42 0.00 2.19 2.10 0.00 3.75 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.99 0.00 9 H 8.41 4.84 0.00 3.12 3.25 0.00 5.68 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 M 7.98 4.74 0.00 2.10 2.09 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.54 0.00 11 D 7.41 4.73 0.00 2.63 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 12 S 8.03 4.71 0.00 3.98 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 R 8.48 4.39 0.00 1.78 1.98 0.00 3.24 0.00 0.00 3.16 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 14 I 7.46 4.06 1.95 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.83 0.92 0.00 0.00 15 G 9.43 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 0.00 0.00 0.00 16 W 8.99 4.37 0.00 3.70 3.36 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 17 L 6.59 3.76 0.00 1.10 1.24 -0.08 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 18 H 8.18 5.11 0.00 3.07 3.29 0.00 5.79 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 N 8.00 4.84 0.00 2.97 2.79 0.00 0.00 7.05 6.80 0.00 0.00 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 L 8.06 4.17 0.00 1.99 1.98 0.88 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 21 G 7.49 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 22 D 7.95 4.67 0.00 2.98 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 23 Q 8.05 3.91 0.00 2.22 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 7.11 0.00 0.00 0.00 0.00 0.00 2.49 2.47 0.00 24 I 7.84 3.95 1.88 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 1.70 0.81 0.92 0.00 0.00 25 G 7.10 4.34 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 0.00 26 K 8.80 4.34 0.00 1.70 1.77 0.00 1.68 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.34 1.46 7.81 27 P 0.00 4.43 0.00 2.42 2.18 0.00 3.90 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.04 0.00 28 Y 8.38 4.45 0.00 3.05 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 N 8.99 3.60 0.00 2.72 3.10 0.00 0.00 7.34 7.57 0.00 0.00 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 S 7.83 2.79 0.00 3.76 3.61 0.00 0.00 0.00 0.00 0.00 0.00 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 6.43 4.05 0.00 3.94 3.80 0.00 0.00 0.00 0.00 0.00 0.00 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 7.36 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 0.00 0.00 0.00 0.00 33 L 7.84 4.08 0.00 1.57 1.55 0.90 0.90 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 34 G 8.16 4.14 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 0.00 35 G 8.27 4.20 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 P 0.00 4.20 0.00 2.17 2.12 0.00 3.61 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.14 0.00 37 S 8.07 4.09 0.00 3.87 3.93 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 38 I 7.71 3.98 1.98 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 1.57 0.34 0.84 0.00 0.00 39 K 7.77 3.95 0.00 1.89 1.87 0.00 1.74 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.42 7.81 40 D 8.19 4.58 0.00 2.95 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 41 K 8.64 4.15 0.00 1.93 2.19 0.00 1.64 0.00 0.00 1.69 0.00 0.00 3.15 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.23 1.36 7.81 42 Y 7.58 4.21 0.00 2.90 2.86 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