NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 25 A 4.1409 8.2649 123.5828 52.5903 18.8136 177.0599 26 T 3.3519 8.5044 118.6649 61.0070 67.4414 169.4331 27 L 4.3449 8.6464 118.5708 58.4136 44.4758 181.2098 28 K 3.4201 6.7183 115.5608 54.5879 35.2887 173.8563 29 Y 4.7576 7.6190 120.7596 56.3840 41.6269 174.4417 30 I 4.7712 7.9744 119.2337 60.0559 42.2233 174.8471 31 C 4.7515 8.7228 123.9649 55.6516 44.3784 173.2548 32 A 3.5986 9.2919 129.5004 56.0872 17.2020 178.4755 33 E 3.9148 8.4365 114.5877 59.0445 30.0843 177.5205 34 C 4.3119 7.8066 116.2835 58.8287 30.6521 173.7868 35 S 4.1247 9.0049 112.9601 58.6088 60.6284 168.8961 36 S 4.3900 7.8816 112.6980 56.1221 64.7881 173.2814 37 K 4.0080 8.8543 125.3468 56.9797 32.7314 175.9285 38 L 4.4436 9.0644 132.6914 55.0592 41.1366 176.6046 39 S 5.0838 7.7647 118.2711 58.0018 63.2457 174.1583 40 L 4.6454 7.3688 127.9813 54.6551 46.5655 174.4192 41 S 4.5212 8.6130 120.2953 59.1211 67.8472 177.1037 42 R 4.4790 9.0237 113.2870 55.6259 31.9345 175.5479 43 T 3.3918 8.4944 116.0292 64.4167 66.4345 172.0446 44 D 4.5154 7.6885 120.0310 53.8152 42.7344 174.8110 45 A 4.0196 8.0876 116.7710 51.8610 17.9754 178.5749 46 V 4.3826 7.7966 103.2551 61.4475 34.4542 173.9790 47 R 4.6731 7.7051 123.2322 56.3965 30.4296 176.8273 48 C 4.5272 8.1162 116.7438 56.7327 45.4504 173.9624 49 K 4.3721 7.6096 104.9073 54.1621 34.9207 173.4236 50 D 4.6013 7.8683 117.5093 53.9249 39.3883 176.4166 51 C 4.7795 7.9719 115.2309 56.3846 32.1663 174.2790 52 G 4.0585 8.5553 113.4875 46.1532 0.0000 172.8327 53 H 4.7405 8.0743 117.9066 54.3944 29.4396 176.8151 54 R 4.5546 8.7368 123.3956 56.6696 29.6055 175.3898 55 I 4.6002 8.1713 117.8080 58.9977 39.8593 174.5912 56 L 5.2783 8.6371 126.2567 52.8702 45.3827 176.4040 57 L 4.5504 9.1835 123.6399 53.7312 42.3811 178.2872 58 K 3.6885 8.4640 124.5964 57.0960 32.5134 173.6841 59 A 3.8106 7.5549 128.4657 51.4636 19.3436 177.1682 60 R 4.3699 8.2431 122.2686 54.8955 31.4201 176.2634 61 T 4.0930 8.1234 113.3746 61.6909 69.3299 174.5209 62 K 4.1705 8.4007 121.5410 58.0731 32.6691 178.1429 63 R 3.9661 7.8814 114.8734 56.3046 29.6597 175.5821 64 L 4.6706 8.1228 121.0008 53.5521 44.1420 175.9081 65 V 4.3029 7.9602 115.0639 59.4370 34.9500 174.9433 66 Q 4.6032 8.0147 123.5534 54.3352 32.0337 174.2183 67 F 4.9234 8.1699 118.3481 56.3548 42.8821 174.5789 68 E 4.2704 8.9867 121.4335 55.9478 30.2172 176.0867 69 A 3.7635 8.0987 120.0529 53.5497 16.1086 177.2860 70 R 4.2371 8.0303 123.6528 57.6719 30.7535 176.2043 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 25 A 8.26 4.14 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 26 T 8.50 3.35 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 27 L 8.65 4.34 0.00 1.68 1.70 0.91 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 28 K 6.72 3.42 0.00 1.88 2.25 0.00 1.97 0.00 0.00 2.02 0.00 0.00 2.88 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.37 1.50 7.81 29 Y 7.62 4.76 0.00 2.73 2.81 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 30 I 7.97 4.77 2.04 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 1.25 1.02 0.93 0.00 0.00 31 C 8.72 4.75 0.00 3.03 2.98 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 32 A 9.29 3.60 1.35 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 0.00 0.00 0.00 33 E 8.44 3.91 0.00 1.96 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 2.30 2.18 0.00 34 C 7.81 4.31 0.00 3.09 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 35 S 9.00 4.12 0.00 4.06 4.15 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 36 S 7.88 4.39 0.00 3.97 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 0.00 37 K 8.85 4.01 0.00 1.78 1.88 0.00 1.75 0.00 0.00 1.64 0.00 0.00 2.73 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.47 1.47 7.81 38 L 9.06 4.44 0.00 1.61 1.47 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 39 S 7.76 5.08 0.00 4.03 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 40 L 7.37 4.65 0.00 1.54 1.48 0.94 0.93 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 41 S 8.61 4.52 0.00 3.91 3.17 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 42 R 9.02 4.48 0.00 1.77 1.85 0.00 3.41 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 1.53 1.67 0.00 43 T 8.49 3.39 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 1.20 0.00 0.00 44 D 7.69 4.52 0.00 2.52 2.63 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 0.00 0.00 0.00 0.00 45 A 8.09 4.02 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 46 V 7.80 4.38 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 0.57 0.00 0.00 0.91 0.00 0.00 47 R 7.71 4.67 0.00 1.72 1.14 0.00 3.22 0.00 0.00 3.30 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.65 0.00 48 C 8.12 4.53 0.00 2.92 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 K 7.61 4.37 0.00 1.79 1.68 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.77 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.26 1.43 7.81 50 D 7.87 4.60 0.00 2.72 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 51 C 7.97 4.78 0.00 3.05 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 52 G 8.56 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 0.00 0.00 0.00 53 H 8.07 4.74 0.00 3.20 3.24 0.00 5.62 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 R 8.74 4.55 0.00 1.80 1.93 0.00 3.18 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.65 0.00 55 I 8.17 4.60 1.87 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 1.22 0.79 0.92 0.00 0.00 56 L 8.64 5.28 0.00 1.54 1.65 0.92 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 57 L 9.18 4.55 0.00 1.55 1.61 0.93 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 58 K 8.46 3.69 0.00 1.67 1.75 0.00 1.75 0.00 0.00 1.56 0.00 0.00 2.97 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.85 1.32 7.81 59 A 7.55 3.81 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 60 R 8.24 4.37 0.00 1.77 1.82 0.00 3.26 0.00 0.00 3.29 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 61 T 8.12 4.09 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 1.19 0.00 0.00 62 K 8.40 4.17 0.00 1.76 1.90 0.00 1.75 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.41 7.81 63 R 7.88 3.97 0.00 1.89 1.93 0.00 2.99 0.00 0.00 3.13 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 64 L 8.12 4.67 0.00 1.59 1.55 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 65 V 7.96 4.30 1.72 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 0.62 0.00 0.00 0.91 0.00 0.00 66 Q 8.01 4.60 0.00 1.87 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.74 0.00 0.00 0.00 0.00 0.00 2.15 2.30 0.00 67 F 8.17 4.92 0.00 2.94 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 68 E 8.99 4.27 0.00 1.97 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 2.38 0.00 69 A 8.10 3.76 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 R 8.03 4.24 0.00 1.79 1.80 0.00 3.26 0.00 0.00 3.27 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.75 0.00