NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 21 S 4.4042 8.3193 115.2898 58.3613 63.6979 173.1341 22 T 4.5509 7.9218 116.4778 58.7679 72.9300 173.3191 23 A 4.1493 8.9082 124.2808 54.0224 18.9247 179.9845 24 A 4.4247 7.8524 118.1622 53.9620 19.5874 179.2459 25 G 3.6615 7.7484 103.1078 47.7249 0.0000 175.8720 26 Q 3.7816 8.0220 121.8905 58.4956 29.2655 176.8814 27 E 4.1139 8.0683 116.0593 56.9737 28.7604 176.8849 28 R 4.2803 7.5441 117.2238 58.2353 30.4516 177.5446 29 R 4.3519 7.8276 116.6954 58.0022 30.7857 177.8784 30 E 4.1378 7.8174 117.6837 58.1060 29.7131 178.2139 31 K 4.1650 7.9381 117.0178 57.2084 32.0580 178.1822 32 L 4.2951 7.4125 119.5090 56.6501 41.5839 177.8846 33 T 4.6797 7.3349 108.2370 61.4275 67.4820 175.5289 34 E 4.3397 7.5858 120.9395 57.6773 30.6405 176.6877 35 E 3.8213 7.6894 116.0433 57.6056 29.7904 178.3103 36 T 4.1177 7.4401 117.6594 66.3776 69.0213 176.4165 37 D 4.5349 7.9882 119.3530 56.6004 40.7657 178.3016 38 D 4.5068 7.5991 118.8193 56.5355 40.9506 178.1680 39 L 4.1722 7.4479 120.1234 57.6077 42.1884 178.7331 40 L 4.0452 8.5179 119.3078 57.1284 41.3101 178.4660 41 D 4.5599 7.4994 116.6413 55.8145 40.9078 177.7816 42 E 4.1787 7.8187 118.4861 58.2871 29.5337 178.5744 43 I 3.6883 7.8769 120.4752 64.6186 37.2026 177.4128 44 D 4.7042 7.7617 115.8773 55.2247 40.7645 177.3294 45 D 4.6634 7.5288 117.8906 54.8811 41.1852 177.4960 46 V 4.1354 7.4177 118.4868 63.8694 32.2906 176.9613 47 L 3.9874 7.9269 116.7816 55.8915 41.8719 177.4516 48 E 4.5094 8.1093 115.8310 56.4972 30.9318 176.6455 49 E 4.4119 8.0439 116.1802 56.7097 30.5496 176.1841 50 N 4.6307 7.5151 116.6486 53.7930 39.3200 174.2025 51 A 4.3208 7.7700 126.9794 52.9956 19.4391 176.6644 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 21 S 8.32 4.40 0.00 3.85 3.83 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 0.00 0.00 0.00 0.00 22 T 7.92 4.55 4.24 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 1.21 0.00 0.00 23 A 8.91 4.15 1.31 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 24 A 7.85 4.42 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.75 3.66 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 0.00 0.00 0.00 26 Q 8.02 3.78 0.00 2.18 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 6.75 0.00 0.00 0.00 0.00 0.00 2.35 2.29 0.00 27 E 8.07 4.11 0.00 2.06 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 2.26 2.29 0.00 28 R 7.54 4.28 0.00 2.06 1.89 0.00 3.13 0.00 0.00 3.17 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.65 0.00 29 R 7.83 4.35 0.00 1.89 1.95 0.00 3.17 0.00 0.00 3.34 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.87 0.00 30 E 7.82 4.14 0.00 2.12 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.51 0.00 31 K 7.94 4.17 0.00 1.79 1.83 0.00 1.75 0.00 0.00 1.82 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.51 7.81 32 L 7.41 4.30 0.00 1.76 1.69 0.95 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 33 T 7.33 4.68 4.24 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 1.21 0.00 0.00 34 E 7.59 4.34 0.00 2.37 1.95 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 2.22 2.36 0.00 35 E 7.69 3.82 0.00 2.18 1.96 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 2.30 2.44 0.00 36 T 7.44 4.12 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 37 D 7.99 4.53 0.00 2.72 2.71 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 0.00 0.00 0.00 0.00 38 D 7.60 4.51 0.00 2.70 2.70 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 39 L 7.45 4.17 0.00 1.97 1.80 0.92 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 40 L 8.52 4.05 0.00 1.68 1.70 0.92 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 41 D 7.50 4.56 0.00 2.75 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 42 E 7.82 4.18 0.00 2.08 1.93 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 2.29 2.34 0.00 43 I 7.88 3.69 2.00 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 1.30 1.05 0.91 0.00 0.00 44 D 7.76 4.70 0.00 2.67 2.70 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 45 D 7.53 4.66 0.00 2.80 2.70 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 46 V 7.42 4.14 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 1.06 0.00 0.00 0.99 0.00 0.00 47 L 7.93 3.99 0.00 1.66 1.70 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 48 E 8.11 4.51 0.00 2.10 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 49 E 8.04 4.41 0.00 2.13 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.34 0.00 50 N 7.52 4.63 0.00 2.68 2.87 0.00 0.00 6.97 7.84 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 51 A 7.77 4.32 1.22 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 0.00 0.00 0.00 0.00 0.00 0.00