NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.3096 8.1631 117.3743 63.2498 69.6412 173.2498 2 G 3.5809 8.3971 116.3312 44.3138 0.0000 172.4641 3 A 4.3196 8.2198 125.2656 53.1333 20.8965 176.1819 4 G 4.3359 7.3297 108.6883 44.8856 0.0000 176.1311 5 T 3.8798 9.1038 122.4731 66.0990 67.9228 173.3158 6 P 4.3431 0.0000 0.0000 65.4261 31.3110 177.9857 7 S 4.3647 7.9505 113.5873 59.9888 62.6970 175.2782 8 Q 4.2448 7.6752 120.1122 56.7946 29.0780 177.5753 9 G 3.8102 7.8328 108.4017 47.2115 0.0000 175.3893 10 K 4.3664 7.3236 117.6158 56.7602 32.1476 178.5660 11 K 4.4162 7.5688 120.3959 55.3894 30.8157 176.8034 12 N 5.1301 7.6810 116.4217 52.7264 37.9360 175.0550 13 T 4.6743 7.6789 112.8782 62.7969 72.1670 174.1523 14 T 4.5606 8.4042 120.5454 62.1378 69.9044 172.4351 15 T 4.4250 7.7174 114.8576 62.9253 71.3308 172.7526 16 H 5.0246 8.0329 121.6270 54.5939 29.8260 174.3262 17 T 4.7916 9.2962 113.8753 58.9385 72.7063 173.1663 18 K 4.4137 8.5994 123.5083 56.7714 32.5240 176.1127 19 C 4.1691 8.7724 128.1044 59.4955 32.4726 174.5178 20 R 3.6889 8.0554 123.8064 59.2237 30.1289 177.9702 21 R 3.6447 7.1615 116.4047 58.9757 30.3145 176.5677 22 C 4.2458 7.8984 110.2788 58.8589 30.8056 174.6422 23 G 3.9855 7.6336 104.0510 44.7182 0.0000 172.5182 24 E 4.5601 7.8517 118.5212 53.5390 31.8375 176.5293 25 K 4.5167 8.1881 124.1581 56.9446 29.5136 176.8427 26 S 4.8610 7.8945 113.6903 58.3529 66.1479 174.6382 27 Y 4.6406 8.6587 123.9186 57.0286 39.5814 174.3616 28 H 4.5977 8.5838 128.9190 55.5697 29.7780 175.8056 29 T 3.8873 8.8525 121.6917 63.7239 67.4311 175.0261 30 K 4.2792 7.9620 118.7543 57.6957 32.8265 177.3233 31 K 4.1005 7.5260 116.4660 55.4680 32.8128 177.1147 32 K 3.8254 8.4394 117.7096 56.7490 30.5015 174.1956 33 V 4.7230 6.6769 117.2991 61.1607 34.6955 173.8682 34 C 5.2046 9.2483 128.7405 59.0328 32.4676 174.0471 35 S 4.4698 9.2031 120.4261 59.8667 63.1587 175.0330 36 S 4.5412 8.4151 114.5738 60.0681 63.0921 174.3322 37 C 4.4152 8.1310 113.1742 57.6499 30.7327 174.8156 38 G 4.2281 8.3923 108.6103 46.7726 0.0000 172.5903 39 F 4.5516 8.2038 122.4491 59.2736 39.7308 176.0313 40 G 3.7707 8.7614 115.9953 46.0352 0.0000 173.2758 41 K 4.3607 7.9170 118.3147 57.0548 34.0940 175.8593 42 S 4.7975 7.9953 110.4569 56.0721 65.7316 173.9218 43 A 4.1083 8.5443 124.2588 54.5233 18.5240 178.1437 44 K 4.3951 7.1253 111.7273 55.6591 33.8020 175.6371 45 R 4.6830 8.0083 118.1855 54.8514 31.7480 176.9436 46 R 3.9410 8.6196 124.6498 56.2555 30.0163 174.9780 47 D 4.9411 7.9986 125.2065 52.7328 45.0458 174.2305 48 Y 4.4412 9.1217 120.0235 56.1391 41.8839 176.5208 49 E 4.0502 8.6550 122.6645 58.5065 30.1819 177.7949 50 W 4.7044 7.5535 114.7022 56.8996 28.6146 177.2408 51 Q 4.5884 7.7730 117.4432 56.9468 28.3890 175.8920 52 S 4.7053 7.5771 110.9020 56.1294 66.3054 174.2315 53 K 3.8515 9.2753 121.7421 58.2333 32.1248 178.6623 54 A 3.7191 7.7892 126.8130 54.7795 19.6333 178.9550 55 G 4.1029 7.7368 103.0015 45.2285 0.0000 173.2844 56 E 4.1840 8.1378 126.5516 56.1927 29.8893 174.3170 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 T 8.16 4.31 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 2 G 8.40 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 A 8.22 4.32 1.29 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 0.00 0.00 0.00 4 G 7.33 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 T 9.10 3.88 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 6 P 0.00 4.34 0.00 2.26 2.30 0.00 3.60 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.05 0.00 7 S 7.95 4.36 0.00 4.12 3.94 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 0.00 0.00 0.00 8 Q 7.68 4.24 0.00 2.11 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.01 0.00 0.00 0.00 0.00 0.00 2.64 2.51 0.00 9 G 7.83 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.32 4.37 0.00 1.81 1.84 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.47 1.41 7.81 11 K 7.57 4.42 0.00 1.91 1.77 0.00 1.64 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.41 1.36 7.81 12 N 7.68 5.13 0.00 2.78 2.82 0.00 0.00 6.15 7.71 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 13 T 7.68 4.67 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 1.22 0.00 0.00 14 T 8.40 4.56 4.26 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 1.23 0.00 0.00 15 T 7.72 4.43 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 16 H 8.03 5.02 0.00 3.07 3.58 0.00 5.64 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 T 9.30 4.79 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 18 K 8.60 4.41 0.00 1.81 1.78 0.00 1.78 0.00 0.00 1.62 0.00 0.00 2.80 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.40 1.45 7.81 19 C 8.77 4.17 0.00 3.19 2.84 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 0.00 0.00 0.00 0.00 20 R 8.06 3.69 0.00 1.45 1.39 0.00 3.18 0.00 0.00 3.10 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.47 0.00 21 R 7.16 3.64 0.00 0.67 1.51 0.00 3.24 0.00 0.00 3.24 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.34 0.00 22 C 7.90 4.25 0.00 3.08 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.63 3.99 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 0.00 0.00 0.00 24 E 7.85 4.56 0.00 1.94 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.25 0.00 25 K 8.19 4.52 0.00 1.80 1.79 0.00 1.74 0.00 0.00 1.73 0.00 0.00 3.20 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.62 1.51 7.81 26 S 7.89 4.86 0.00 3.88 3.90 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.66 4.64 0.00 3.12 3.08 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 0.00 0.00 0.00 28 H 8.58 4.60 0.00 3.10 3.04 0.00 5.66 0.00 0.00 0.00 0.00 6.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 T 8.85 3.89 4.33 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 1.26 0.00 0.00 30 K 7.96 4.28 0.00 1.73 1.78 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.47 7.81 31 K 7.53 4.10 0.00 1.54 1.66 0.00 1.70 0.00 0.00 1.72 0.00 0.00 2.84 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.24 0.85 7.81 32 K 8.44 3.83 0.00 1.78 1.83 0.00 1.75 0.00 0.00 1.59 0.00 0.00 2.85 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.30 1.49 7.81 33 V 6.68 4.72 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 0.96 0.00 0.00 0.94 0.00 0.00 34 C 9.25 5.20 0.00 3.49 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 35 S 9.20 4.47 0.00 4.00 4.10 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 0.00 0.00 0.00 36 S 8.42 4.54 0.00 3.90 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 37 C 8.13 4.42 0.00 3.16 3.18 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.39 4.23 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 0.00 39 F 8.20 4.55 0.00 3.09 3.15 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 0.00 0.00 0.00 40 G 8.76 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 K 7.92 4.36 0.00 1.70 1.95 0.00 1.77 0.00 0.00 1.81 0.00 0.00 2.92 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.32 1.39 7.81 42 S 8.00 4.80 0.00 3.96 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 43 A 8.54 4.11 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 44 K 7.13 4.40 0.00 1.74 1.74 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.42 1.39 7.81 45 R 8.01 4.68 0.00 1.64 1.80 0.00 3.35 0.00 0.00 3.16 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.52 0.00 46 R 8.62 3.94 0.00 1.82 2.00 0.00 3.34 0.00 0.00 3.35 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.68 0.00 47 D 8.00 4.94 0.00 2.52 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 0.00 0.00 0.00 48 Y 9.12 4.44 0.00 1.87 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 8.65 4.05 0.00 2.00 2.06 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 2.28 2.25 0.00 50 W 7.55 4.70 0.00 3.45 3.30 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 51 Q 7.77 4.59 0.00 2.15 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.64 0.00 0.00 0.00 0.00 0.00 2.31 1.76 0.00 52 S 7.58 4.71 0.00 4.02 3.79 0.00 0.00 0.00 0.00 0.00 0.00 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 K 9.28 3.85 0.00 1.83 1.83 0.00 1.73 0.00 0.00 1.86 0.00 0.00 2.94 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.57 1.42 7.81 54 A 7.79 3.72 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 55 G 7.74 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 56 E 8.14 4.18 0.00 1.92 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.26 0.00