NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2158 8.2644 123.5775 52.6936 19.1812 176.0829 2 V 2.9848 8.4312 124.5746 63.8961 30.3425 170.7872 3 A 4.5760 8.3500 125.9918 51.2605 21.3317 177.8406 4 Q 4.3697 8.6045 117.5911 56.8474 29.3154 177.3951 5 S 4.7699 7.6515 112.5142 58.0602 63.5548 174.5066 6 F 5.0135 8.2592 116.2315 57.1978 38.3300 176.8478 7 N 4.8316 8.2153 117.4812 56.4249 40.9081 176.3238 8 M 4.1574 8.0918 115.5365 58.5991 32.3363 177.8219 9 Q 3.9639 8.0692 117.8172 58.9183 29.4871 176.0458 10 Q 4.4746 8.0306 120.8707 55.2769 28.9803 174.4930 11 Q 5.0077 8.6623 119.3135 56.7436 34.6729 176.9333 12 R 3.9844 8.2700 118.8551 58.8534 29.9100 178.4743 13 R 3.8728 7.9276 117.3337 59.2703 30.0643 178.7817 14 F 4.2664 8.0034 116.9591 60.7375 38.9268 176.7281 15 Y 4.1054 8.3617 119.1146 60.8159 38.3397 177.9752 16 E 3.8404 8.4420 118.6021 59.3010 29.8813 178.2753 17 A 4.1147 7.9653 119.6320 54.9357 18.4807 179.1682 18 L 4.0324 8.0020 118.1679 58.1892 43.6169 178.3983 19 H 4.6290 7.9305 116.3075 53.5603 26.3838 177.1376 20 D 4.6710 7.1322 119.4239 52.0563 42.1743 172.4127 21 P 4.3839 0.0000 0.0000 64.8496 32.2154 178.4558 22 N 4.3654 8.3681 116.0222 56.1683 38.4892 175.2948 23 L 4.1210 7.4663 117.2274 54.0752 41.9628 177.0503 24 N 4.5422 8.5399 121.3719 52.5629 38.3030 174.6100 25 E 4.6465 8.3495 120.8605 54.2210 27.9820 173.7491 26 E 4.7953 7.6423 127.9801 55.7692 36.2385 177.8600 27 Q 3.9580 7.9062 117.7467 58.8159 28.9490 178.1187 28 R 3.8803 8.0662 119.8697 59.6849 29.9737 177.9467 29 N 4.3039 8.1812 115.7987 56.6593 38.7798 176.3677 30 A 3.9973 7.9945 121.1930 55.0583 18.7061 179.3847 31 K 4.0444 8.1917 116.9002 59.6555 32.0157 179.4033 32 I 3.9201 7.6612 119.6125 64.2279 37.9264 177.7404 33 K 4.5575 8.1248 118.4219 54.8222 29.3279 175.6405 34 S 4.8092 7.5229 118.1383 59.5872 69.9501 176.7353 35 I 3.4419 7.9937 120.3749 64.4041 37.0287 177.8674 36 R 4.2570 8.1254 115.6338 59.3122 29.6761 177.3485 37 D 4.5425 7.1715 120.3519 51.5594 39.5751 175.6128 38 D 4.1938 7.5220 121.9618 53.2411 39.0710 176.1256 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 4.22 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.43 2.98 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 0.70 0.00 0.00 0.93 0.00 0.00 3 A 8.35 4.58 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 4 Q 8.60 4.37 0.00 2.22 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 7.22 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 5 S 7.65 4.77 0.00 3.98 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 6 F 8.26 5.01 0.00 3.43 3.24 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 0.00 0.00 0.00 0.00 7 N 8.22 4.83 0.00 2.46 2.66 0.00 0.00 6.04 5.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 M 8.09 4.16 0.00 2.00 2.11 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.49 0.00 9 Q 8.07 3.96 0.00 2.03 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 7.03 0.00 0.00 0.00 0.00 0.00 2.38 2.48 0.00 10 Q 8.03 4.47 0.00 2.51 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.77 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 11 Q 8.66 5.01 0.00 2.27 2.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.27 6.89 0.00 0.00 0.00 0.00 0.00 2.61 2.39 0.00 12 R 8.27 3.98 0.00 1.95 2.00 0.00 3.32 0.00 0.00 3.28 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.84 0.00 13 R 7.93 3.87 0.00 1.55 1.74 0.00 3.18 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.73 0.00 14 F 8.00 4.27 0.00 3.31 3.09 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.36 4.11 0.00 3.16 3.20 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 16 E 8.44 3.84 0.00 2.22 2.11 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 2.36 2.39 0.00 17 A 7.97 4.11 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 18 L 8.00 4.03 0.00 1.73 1.92 0.91 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 19 H 7.93 4.63 0.00 2.67 3.02 0.00 5.70 0.00 0.00 0.00 0.00 8.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 D 7.13 4.67 0.00 2.71 2.66 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 0.00 0.00 0.00 0.00 21 P 0.00 4.38 0.00 2.20 2.14 0.00 3.82 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.97 0.00 22 N 8.37 4.37 0.00 2.85 2.93 0.00 0.00 7.29 7.85 0.00 0.00 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 L 7.47 4.12 0.00 1.83 1.62 0.92 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 24 N 8.54 4.54 0.00 2.86 2.94 0.00 0.00 5.87 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 25 E 8.35 4.65 0.00 1.94 1.92 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 2.29 2.29 0.00 26 E 7.64 4.80 0.00 2.02 1.82 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 2.18 2.28 0.00 27 Q 7.91 3.96 0.00 2.10 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.62 0.00 0.00 0.00 0.00 0.00 2.53 2.35 0.00 28 R 8.07 3.88 0.00 2.12 1.97 0.00 3.09 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.78 0.00 29 N 8.18 4.30 0.00 2.88 2.98 0.00 0.00 7.02 8.25 0.00 0.00 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 A 7.99 4.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.19 4.04 0.00 2.02 1.87 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.65 7.81 32 I 7.66 3.92 2.11 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.01 1.06 0.00 0.00 33 K 8.12 4.56 0.00 1.82 1.83 0.00 1.76 0.00 0.00 1.65 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.48 7.81 34 S 7.52 4.81 0.00 3.88 3.96 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.99 3.44 1.48 0.00 0.00 0.67 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 0.65 -0.15 0.00 0.00 36 R 8.13 4.26 0.00 2.12 2.54 0.00 3.14 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.64 0.00 37 D 7.17 4.54 0.00 2.49 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.52 4.19 0.00 2.72 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00