NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 4.0040 8.2127 109.7435 45.5326 0.0000 173.5249 2 I 3.2212 8.1410 118.9660 62.5071 37.6959 173.8541 3 V 3.4653 8.3512 119.9452 65.9590 31.7139 177.0604 4 E 3.9504 8.0874 116.4218 59.6439 28.7686 178.8614 5 Q 4.1331 8.4164 119.4591 58.7630 29.0533 176.4975 6 C 4.7456 8.4049 115.4509 56.1716 41.2976 173.9806 7 C 4.3835 7.9779 117.0449 60.0941 29.2823 175.3352 8 T 4.1317 8.0134 116.4404 65.6587 68.1108 174.6451 9 S 4.7403 7.4024 114.3608 55.9533 66.3163 173.0381 10 I 4.1491 8.1710 122.1297 61.3846 37.2328 176.9436 11 C 4.7687 8.6184 123.5356 56.2627 40.5337 174.3418 12 S 4.5070 9.2153 119.4458 57.9719 64.7738 175.5666 13 L 4.0423 8.4459 121.9639 58.0982 41.0823 179.2239 14 Y 4.1469 7.9672 118.1880 60.7161 39.1989 177.3866 15 Q 4.1081 8.2211 119.0179 59.1578 28.7957 178.9224 16 L 4.2487 8.0392 119.7739 58.0504 41.6807 179.4486 17 E 3.9043 8.0634 118.1199 58.9020 29.0309 178.6694 18 N 3.9948 7.5124 116.5758 56.2411 38.7590 175.3631 19 Y 4.4343 7.7369 116.2348 57.4191 38.3429 175.4087 20 C 4.4011 7.1384 118.1844 59.4333 28.9931 173.5053 21 N 4.5271 8.5504 118.0801 53.7684 38.1742 175.3203 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 8.21 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.14 3.22 0.56 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.85 0.63 0.00 0.00 3 V 8.35 3.47 2.04 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 0.98 0.00 0.00 0.87 0.00 0.00 4 E 8.09 3.95 0.00 2.11 2.02 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 2.33 2.44 0.00 5 Q 8.42 4.13 0.00 2.19 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.66 0.00 0.00 0.00 0.00 0.00 2.42 2.45 0.00 6 C 8.40 4.75 0.00 2.97 3.06 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 0.00 0.00 0.00 0.00 7 C 7.98 4.38 0.00 3.12 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 8 T 8.01 4.13 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 1.22 0.00 0.00 9 S 7.40 4.74 0.00 4.14 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 10 I 8.17 4.15 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 1.42 0.54 0.92 0.00 0.00 11 C 8.62 4.77 0.00 3.00 3.07 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 0.00 0.00 0.00 0.00 12 S 9.22 4.51 0.00 4.09 4.06 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 0.00 0.00 0.00 0.00 13 L 8.45 4.04 0.00 1.77 1.81 0.95 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 14 Y 7.97 4.15 0.00 2.97 3.04 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 15 Q 8.22 4.11 0.00 2.40 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.55 0.00 0.00 0.00 0.00 0.00 2.47 2.54 0.00 16 L 8.04 4.25 0.00 1.92 1.79 0.95 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.06 3.90 0.00 1.97 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.41 0.00 18 N 7.51 3.99 0.00 2.35 1.99 0.00 0.00 7.16 7.52 0.00 0.00 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 Y 7.74 4.43 0.00 3.16 2.96 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 20 C 7.14 4.40 0.00 3.01 2.85 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 0.00 0.00 0.00 0.00 21 N 8.55 4.53 0.00 2.71 2.73 0.00 0.00 6.80 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00