NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9442 8.3544 109.7364 45.4291 0.0000 171.0040 2 K 4.6023 8.2802 120.7973 54.5562 34.1199 174.7917 3 I 4.3821 7.9287 118.0396 58.7964 39.1840 174.0379 4 P 4.6236 0.0000 0.0000 62.3671 27.5906 176.8120 5 V 3.6363 7.4742 122.7841 66.4896 32.1372 176.9575 6 K 3.9635 8.1154 117.1730 58.6295 31.8249 178.5417 7 A 4.1676 7.7168 120.8023 54.3995 19.2296 179.0754 8 I 3.7289 7.4693 117.2139 63.5742 37.7560 178.2216 9 K 3.8919 8.0925 120.4563 59.3582 32.5155 178.3163 10 K 3.9936 7.7943 119.8411 59.4741 32.0140 178.5888 11 A 4.0908 8.1177 121.2014 55.0527 18.4242 179.6496 12 G 3.7041 8.0877 102.9378 46.6509 0.0000 175.6514 13 A 3.9564 7.7206 123.0038 55.0306 18.5864 179.4804 14 A 3.9008 7.7984 118.3732 55.5752 18.8278 179.8406 15 I 3.8083 7.9124 118.3795 64.2880 37.0916 179.0574 16 G 4.1174 7.8545 107.6707 47.1536 0.0000 175.4478 17 K 4.0512 8.4473 122.6360 59.1233 31.9875 179.1435 18 G 3.5757 7.9247 105.8179 47.8660 0.0000 175.6889 19 L 4.0233 7.8250 121.4777 57.3443 41.5546 179.5816 20 R 3.8759 8.0978 118.5177 59.3954 30.0187 178.3454 21 A 4.0105 7.8067 120.4470 55.3974 18.1427 179.7048 22 I 3.7372 7.3045 117.1475 64.6546 37.2860 178.0127 23 N 4.4597 8.0482 117.5875 55.9423 38.5668 177.1113 24 I 3.6690 8.0632 114.3944 64.3903 37.3431 178.0431 25 A 4.0033 8.0209 122.3733 55.0605 18.1943 179.4249 26 S 4.2553 8.4179 111.7175 61.4018 62.2999 176.4859 27 T 3.8833 7.7450 118.0050 66.1476 68.3398 176.3444 28 A 4.0761 7.8843 123.1594 55.8066 18.2374 179.4904 29 H 4.5586 8.2923 112.8461 58.9578 28.6576 177.1468 30 D 4.0627 7.3683 120.3488 57.5876 41.0169 177.4584 31 V 3.4219 8.5616 120.1456 64.4495 30.9483 177.1250 32 Y 4.7651 8.6371 117.3336 61.1304 37.6548 178.8061 33 S 3.3637 7.4035 115.9593 60.7588 62.9096 175.8286 34 F 4.9159 7.9801 119.1223 58.0962 39.2385 177.2762 35 F 4.8001 7.9481 121.4071 60.3038 40.0058 177.7114 36 K 3.8704 7.7967 119.8841 59.2567 31.9825 176.6531 37 P 4.3468 0.0000 0.0000 63.8687 31.1677 175.6918 38 K 4.2493 8.9011 117.0825 56.2809 34.2375 177.8254 39 H 3.8720 8.2118 114.2314 57.0916 28.1415 174.5560 40 K 4.3384 8.4035 119.1503 55.8482 32.0265 174.7518 41 K 3.9872 7.9945 120.9212 55.1577 31.7142 175.6567 42 K 4.1591 8.4824 118.3874 57.3103 32.6195 176.8889 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 G 8.35 3.94 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 0.00 0.00 0.00 2 K 8.28 4.60 0.00 1.75 1.70 0.00 1.61 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.30 1.58 7.81 3 I 7.93 4.38 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 1.47 0.67 0.91 0.00 0.00 4 P 0.00 4.62 0.00 2.26 2.22 0.00 3.69 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.01 0.00 5 V 7.47 3.64 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 1.23 0.00 0.00 0.99 0.00 0.00 6 K 8.12 3.96 0.00 1.84 1.85 0.00 1.71 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.53 1.51 7.81 7 A 7.72 4.17 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 0.00 0.00 0.00 0.00 0.00 0.00 8 I 7.47 3.73 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 1.41 1.32 0.97 0.00 0.00 9 K 8.09 3.89 0.00 1.84 1.81 0.00 1.87 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.44 7.81 10 K 7.79 3.99 0.00 2.01 1.80 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.47 7.81 11 A 8.12 4.09 1.36 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 0.00 0.00 12 G 8.09 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.72 3.96 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.80 3.90 1.32 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 0.00 0.00 15 I 7.91 3.81 2.02 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 1.45 1.39 0.91 0.00 0.00 16 G 7.85 4.12 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 K 8.45 4.05 0.00 1.79 2.07 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.61 7.81 18 G 7.92 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.82 4.02 0.00 1.84 1.73 0.92 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 20 R 8.10 3.88 0.00 1.89 2.15 0.00 3.10 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 21 A 7.81 4.01 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.30 3.74 2.04 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 1.71 0.85 0.91 0.00 0.00 23 N 8.05 4.46 0.00 2.96 2.82 0.00 0.00 6.63 6.81 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 24 I 8.06 3.67 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 1.64 0.61 1.00 0.00 0.00 25 A 8.02 4.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.42 4.26 0.00 4.11 3.91 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 27 T 7.74 3.88 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 28 A 7.88 4.08 1.43 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 0.00 0.00 29 H 8.29 4.56 0.00 3.52 3.66 0.00 5.46 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 D 7.37 4.06 0.00 2.94 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 31 V 8.56 3.42 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.14 0.00 0.00 0.92 0.00 0.00 32 Y 8.64 4.77 0.00 3.39 3.41 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.40 3.36 0.00 3.82 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 34 F 7.98 4.92 0.00 2.78 2.95 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 0.00 0.00 0.00 35 F 7.95 4.80 0.00 3.25 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 36 K 7.80 3.87 0.00 1.56 1.83 0.00 1.93 0.00 0.00 1.69 0.00 0.00 3.13 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.48 1.47 7.81 37 P 0.00 4.35 0.00 1.76 1.91 0.00 3.76 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.97 0.00 38 K 8.90 4.25 0.00 1.89 1.82 0.00 1.78 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.34 1.43 7.81 39 H 8.21 3.87 0.00 3.25 3.27 0.00 5.93 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 K 8.40 4.34 0.00 1.67 1.76 0.00 1.94 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.40 7.81 41 K 7.99 3.99 0.00 1.96 1.82 0.00 1.81 0.00 0.00 1.76 0.00 0.00 3.08 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.35 1.42 7.81 42 K 8.48 4.16 0.00 1.86 1.80 0.00 1.60 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.43 7.81