NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 V 4.0586 8.0544 114.0548 61.1917 34.0877 174.7938 9 R 4.0157 7.5765 121.1766 54.9829 31.0195 175.1729 10 S 4.2939 8.3436 121.3588 59.3945 64.3301 174.6265 11 S 4.5093 8.4433 115.7188 58.6662 63.9628 173.4346 12 A 3.8793 8.0007 124.0621 54.5170 18.5076 178.7109 13 G 3.9231 9.0243 110.2719 45.5458 0.0000 175.0253 14 A 4.0258 7.7244 123.1079 54.7399 17.9561 180.5324 15 V 3.5388 7.6075 115.8554 66.2113 32.1938 177.5980 16 R 4.0549 8.0099 117.9541 59.7642 29.7078 177.9967 17 D 4.4192 7.9997 117.0338 57.0483 40.8025 178.1245 18 A 4.2543 8.0548 120.5562 52.3237 18.2502 177.8795 19 G 4.2157 7.8049 104.6882 46.1140 0.0000 173.9309 20 G 3.9234 7.4200 107.5404 43.8429 0.0000 175.5573 21 A 3.9239 8.7797 121.1312 55.6360 18.2209 180.0873 22 F 3.9899 8.5769 115.3899 60.4911 38.8343 178.2150 23 G 3.6071 8.6890 105.7715 47.8945 0.0000 176.0920 24 K 4.0485 8.0128 121.1556 58.8797 32.0743 179.3421 25 R 3.8880 8.3849 119.7529 59.3185 29.9637 178.4476 26 E 3.9904 8.1123 117.0898 59.3747 29.6268 178.8520 27 Q 3.9436 8.0063 120.0442 59.0039 29.0607 178.2410 28 A 4.0442 7.9597 121.4526 55.0089 18.5106 179.2630 29 E 3.8945 8.4379 118.0268 59.3970 29.7508 178.8861 30 E 4.1058 8.4579 118.7927 59.4127 29.5654 178.9247 31 E 4.0670 8.2441 119.2198 59.2676 29.6914 178.5228 32 R 3.8994 8.2541 118.9938 59.7965 30.1498 177.6071 33 Y 3.8546 7.8613 118.5190 60.8511 38.8108 178.0262 34 F 4.4005 8.4278 117.6425 59.6690 39.1799 178.0853 35 R 4.0473 8.3459 118.1424 58.8670 29.7074 178.6668 36 A 3.9881 7.8029 120.4946 54.8682 18.2361 179.9444 37 R 3.8423 7.7092 116.3748 59.3306 30.0793 178.9840 38 A 4.0077 8.0390 120.5337 55.1130 18.4082 179.7769 39 K 3.8739 7.8680 116.3713 59.7608 32.1625 179.4290 40 E 3.9713 7.8844 118.7425 59.5947 29.5004 179.5268 41 Q 4.0536 8.4505 118.4099 58.7507 28.7820 178.6229 42 L 4.0550 8.2917 120.2060 57.3759 41.6703 179.3095 43 A 3.9696 7.9258 120.2051 55.1964 18.2232 179.5991 44 A 3.9980 7.9960 119.2158 55.0552 18.0667 179.5268 45 L 3.9980 7.8107 118.6526 57.8830 40.5900 179.2024 46 K 4.0453 8.1295 118.7388 59.2238 31.8188 178.9844 47 K 4.0323 7.9992 116.5761 58.2026 32.2941 178.0160 48 H 4.4697 7.8127 117.7595 58.2821 29.9638 176.0945 49 H 4.3947 7.8586 119.2939 58.9397 29.7055 174.6445 50 E 4.5829 7.4957 123.4698 57.1503 31.5073 175.9070 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 8 V 8.05 4.06 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 0.85 0.00 0.00 0.92 0.00 0.00 9 R 7.58 4.02 0.00 1.84 1.81 0.00 3.24 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.71 0.00 10 S 8.34 4.29 0.00 3.89 3.78 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 0.00 0.00 0.00 11 S 8.44 4.51 0.00 3.93 3.97 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.00 3.88 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 13 G 9.02 3.92 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 0.00 0.00 0.00 0.00 0.00 0.00 14 A 7.72 4.03 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.61 3.54 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 0.94 0.00 0.00 0.89 0.00 0.00 16 R 8.01 4.05 0.00 1.93 2.06 0.00 3.25 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.75 0.00 17 D 8.00 4.42 0.00 2.87 2.73 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 18 A 8.05 4.25 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.80 4.22 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 0.00 20 G 7.42 3.92 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 0.00 0.00 0.00 0.00 0.00 0.00 21 A 8.78 3.92 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 22 F 8.58 3.99 0.00 3.14 3.14 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 23 G 8.69 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 0.00 0.00 0.00 24 K 8.01 4.05 0.00 1.94 1.87 0.00 1.68 0.00 0.00 1.75 0.00 0.00 2.90 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.54 1.64 7.81 25 R 8.38 3.89 0.00 1.89 1.84 0.00 2.96 0.00 0.00 2.97 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.56 0.00 26 E 8.11 3.99 0.00 2.34 2.42 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 2.33 2.59 0.00 27 Q 8.01 3.94 0.00 2.14 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.84 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 28 A 7.96 4.04 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.44 3.89 0.00 2.10 2.20 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 2.31 2.39 0.00 30 E 8.46 4.11 0.00 2.31 2.22 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 2.46 2.52 0.00 31 E 8.24 4.07 0.00 2.31 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.42 0.00 32 R 8.25 3.90 0.00 2.01 2.15 0.00 3.17 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 33 Y 7.86 3.85 0.00 3.00 2.83 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 34 F 8.43 4.40 0.00 3.32 3.12 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 35 R 8.35 4.05 0.00 1.88 1.98 0.00 3.15 0.00 0.00 3.19 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.99 0.00 36 A 7.80 3.99 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 R 7.71 3.84 0.00 2.01 1.98 0.00 3.15 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 1.45 0.00 38 A 8.04 4.01 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.87 3.87 0.00 1.95 1.85 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.47 7.81 40 E 7.88 3.97 0.00 2.09 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 2.28 2.40 0.00 41 Q 8.45 4.05 0.00 2.14 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.82 0.00 0.00 0.00 0.00 0.00 2.38 2.50 0.00 42 L 8.29 4.05 0.00 1.68 1.71 0.95 0.85 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 43 A 7.93 3.97 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 44 A 8.00 4.00 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 45 L 7.81 4.00 0.00 2.03 1.76 0.91 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 46 K 8.13 4.05 0.00 2.10 1.86 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.64 7.81 47 K 8.00 4.03 0.00 1.76 1.87 0.00 1.70 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.45 7.81 48 H 7.81 4.47 0.00 3.25 3.47 0.00 5.76 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 H 7.86 4.39 0.00 3.34 3.48 0.00 5.88 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 E 7.50 4.58 0.00 1.92 1.73 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 2.06 2.03 0.00