NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3188 8.1627 120.3399 54.8411 32.9364 174.4182 2 K 3.8543 8.4193 128.3092 56.9429 33.1237 175.3577 3 G 3.9059 9.0611 112.9956 45.9237 0.0000 174.1673 4 M 3.9292 7.6705 120.1901 58.4702 32.3023 178.3783 5 S 4.0886 8.1469 111.5521 60.9000 62.7721 175.0510 6 K 4.4172 7.6444 116.5361 56.0461 32.3963 176.4664 7 M 4.3241 7.9409 119.9348 53.8646 32.5286 174.4976 8 P 4.3206 0.0000 0.0000 63.0206 31.8935 175.9537 9 Q 4.6741 8.3589 119.6904 54.7184 30.9385 174.5362 10 F 4.6192 8.2290 119.3756 57.0110 42.3343 172.9381 11 N 4.5831 7.6253 125.3984 51.8032 39.4273 175.0184 12 L 4.3112 8.0152 123.1476 54.3890 42.5883 177.4577 13 R 4.4461 8.0458 119.3810 54.3416 31.3914 174.3009 14 W 5.1841 8.1263 121.1217 53.2118 33.1134 174.3780 15 P 4.4568 0.0000 0.0000 62.4973 32.3883 177.6311 16 R 3.9999 8.7900 121.9211 59.5730 30.2038 178.8647 17 E 3.9903 8.2796 116.6260 59.6938 29.3599 179.3544 18 V 3.5969 7.7443 118.6427 65.5904 31.6883 177.6391 19 L 4.2274 8.2876 120.1373 58.2725 41.8058 178.6753 20 D 4.3980 8.7033 119.5474 57.1115 40.6247 178.4191 21 L 3.9554 7.8038 120.5592 58.1390 42.0235 179.2205 22 V 3.6505 7.9477 118.2544 65.9897 31.4387 178.2687 23 R 3.9552 8.3550 118.3142 59.0553 29.9092 179.1592 24 K 3.9306 8.3219 118.4784 59.6067 32.1241 179.6249 25 V 3.6113 8.1062 118.4551 65.8874 31.3324 177.8668 26 A 4.3113 8.3920 122.3547 54.4654 18.2151 179.2099 27 E 3.8727 8.1951 118.0546 59.4673 29.5847 178.8892 28 E 4.0559 7.9705 116.2106 59.3371 29.5771 177.7784 29 N 4.8291 8.0355 115.0628 52.0115 38.7074 175.0383 30 G 4.0339 7.9250 107.5637 46.6596 0.0000 173.8026 31 R 4.7150 8.0976 116.9314 53.2474 33.8574 176.1149 32 S 4.5407 8.1658 113.9094 57.6445 65.4879 175.3366 33 V 3.5621 8.2019 121.9091 66.1034 31.2399 177.3322 34 N 4.2207 8.2563 116.3468 57.3223 38.6657 176.8027 35 S 4.2191 8.1623 116.1046 61.3739 62.6064 176.1658 36 E 4.0184 8.5995 122.5354 59.4150 29.3138 179.1284 37 I 3.8269 8.2024 120.0787 64.4382 37.2214 177.4859 38 Y 4.1589 8.2512 120.5626 61.0807 38.5163 178.3161 39 Q 3.9700 8.7303 118.9965 59.2157 28.8385 179.3225 40 R 3.8673 7.8703 118.4667 59.0004 30.0707 179.3192 41 V 3.2575 7.8146 118.0820 66.1620 31.4951 177.8223 42 M 4.0179 8.0102 118.7994 58.5283 31.7754 178.4244 43 E 3.9311 8.2728 119.6069 59.1679 29.5614 178.9842 44 S 4.0524 7.7820 113.4270 61.3879 63.2026 176.2585 45 F 4.6239 7.8217 121.4395 60.2726 38.8015 177.3002 46 K 3.8887 8.5220 119.6493 59.7742 31.7055 178.6066 47 K 4.1932 8.0652 116.7279 58.2105 32.1170 178.0401 48 E 4.4930 8.3532 117.7486 55.6484 29.9711 176.8871 49 G 3.9588 7.8216 107.3404 45.6875 0.0000 174.7925 50 R 4.1210 7.8263 117.6152 57.4301 30.4793 177.1290 51 I 4.4786 7.7549 117.2348 61.0304 37.8954 175.4369 52 G 4.0486 7.7903 107.5217 45.0667 0.0000 174.2951 53 A 4.0744 7.7179 128.3040 52.6163 19.0055 177.1866 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 M 8.16 4.32 0.00 1.95 1.87 0.00 0.00 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 2 K 8.42 3.85 0.00 1.82 1.67 0.00 1.90 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.40 1.48 7.81 3 G 9.06 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 0.00 0.00 0.00 4 M 7.67 3.93 0.00 2.10 2.06 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.46 0.00 5 S 8.15 4.09 0.00 4.00 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 6 K 7.64 4.42 0.00 1.78 1.86 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.37 7.81 7 M 7.94 4.32 0.00 1.97 2.13 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.45 0.00 8 P 0.00 4.32 0.00 2.21 2.09 0.00 3.74 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 9 Q 8.36 4.67 0.00 2.17 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.67 0.00 0.00 0.00 0.00 0.00 2.24 2.31 0.00 10 F 8.23 4.62 0.00 3.00 2.91 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 11 N 7.63 4.58 0.00 2.38 2.53 0.00 0.00 7.09 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 12 L 8.02 4.31 0.00 1.16 0.73 1.04 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 13 R 8.05 4.45 0.00 1.79 1.87 0.00 3.13 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.55 0.00 14 W 8.13 5.18 0.00 3.33 2.92 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 15 P 0.00 4.46 0.00 2.19 2.11 0.00 3.68 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.21 0.00 16 R 8.79 4.00 0.00 1.88 2.03 0.00 3.16 0.00 0.00 3.41 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.75 0.00 17 E 8.28 3.99 0.00 2.17 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 0.00 2.39 2.33 0.00 18 V 7.74 3.60 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 1.00 0.00 0.00 0.88 0.00 0.00 19 L 8.29 4.23 0.00 2.08 1.73 0.91 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 20 D 8.70 4.40 0.00 3.03 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 21 L 7.80 3.96 0.00 1.81 1.93 0.93 0.76 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 22 V 7.95 3.65 2.38 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 1.16 0.00 0.00 1.21 0.00 0.00 23 R 8.36 3.96 0.00 2.08 1.98 0.00 3.20 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 2.01 0.00 24 K 8.32 3.93 0.00 1.93 1.87 0.00 1.68 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.47 1.77 7.81 25 V 8.11 3.61 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 1.07 0.00 0.00 1.01 0.00 0.00 26 A 8.39 4.31 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.20 3.87 0.00 2.15 2.27 0.00 0.00 0.00 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 28 E 7.97 4.06 0.00 2.19 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 0.00 2.41 2.36 0.00 29 N 8.04 4.83 0.00 2.98 2.89 0.00 0.00 7.05 7.82 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 30 G 7.92 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.10 4.71 0.00 1.77 1.85 0.00 3.41 0.00 0.00 3.33 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.75 0.00 32 S 8.17 4.54 0.00 4.04 3.98 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.20 3.56 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 1.11 0.00 0.00 0.94 0.00 0.00 34 N 8.26 4.22 0.00 2.85 2.80 0.00 0.00 7.19 7.63 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 35 S 8.16 4.22 0.00 3.95 3.95 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 36 E 8.60 4.02 0.00 2.19 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 2.46 0.00 37 I 8.20 3.83 2.08 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.72 1.04 0.00 0.00 38 Y 8.25 4.16 0.00 3.15 3.19 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.73 3.97 0.00 2.26 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.58 0.00 0.00 0.00 0.00 0.00 2.80 2.63 0.00 40 R 7.87 3.87 0.00 2.00 1.94 0.00 3.17 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.83 0.00 41 V 7.81 3.26 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 0.68 0.00 0.00 0.96 0.00 0.00 42 M 8.01 4.02 0.00 1.89 2.05 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.89 0.00 43 E 8.27 3.93 0.00 2.16 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 2.28 2.33 0.00 44 S 7.78 4.05 0.00 3.89 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 45 F 7.82 4.62 0.00 3.29 2.99 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 0.00 0.00 0.00 46 K 8.52 3.89 0.00 2.02 2.00 0.00 1.79 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.52 7.81 47 K 8.07 4.19 0.00 1.92 1.85 0.00 1.72 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.64 7.81 48 E 8.35 4.49 0.00 2.17 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 0.00 2.31 2.51 0.00 49 G 7.82 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 0.00 0.00 0.00 50 R 7.83 4.12 0.00 1.75 1.73 0.00 3.40 0.00 0.00 3.05 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.66 0.00 51 I 7.75 4.48 1.92 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.00 0.93 0.00 0.00 52 G 7.79 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 53 A 7.72 4.07 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00