NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 25 A 4.1578 8.2649 123.5810 51.4765 20.3977 177.2481 26 T 3.4996 8.1615 113.4434 62.3083 65.4613 169.0285 27 L 4.9771 8.4909 126.1912 54.0693 44.9022 175.6470 28 K 4.5960 8.3447 116.4771 57.3953 40.3500 174.7851 29 Y 4.5981 7.6803 115.4522 57.7283 41.6628 174.5977 30 I 4.7117 8.1250 118.3825 62.4722 42.6890 174.8411 31 C 4.6348 8.7207 122.3310 57.2664 31.5520 174.5790 32 A 4.1661 8.5548 121.4072 55.1769 18.5296 179.0941 33 E 4.1047 8.3178 114.2961 59.4849 29.9825 177.6683 34 C 4.3393 7.8649 110.9306 61.4399 30.8336 175.0178 35 S 5.0481 7.9541 115.2087 58.8998 60.7521 170.7361 36 S 4.4341 8.1591 114.9402 57.7154 64.0304 173.5533 37 K 4.5809 8.6477 126.6306 55.9182 31.7812 176.6581 38 L 4.4201 8.3134 126.0422 53.7420 44.1577 175.6974 39 S 5.4253 8.1768 112.6069 58.7970 64.9025 175.9038 40 L 4.5400 8.6601 126.3947 53.9221 45.8913 174.6365 41 S 4.6289 8.3476 114.2269 56.7508 64.0708 173.4676 42 R 3.8074 8.3084 120.6468 57.7629 29.0925 176.3463 43 T 3.4228 8.8254 118.3058 63.7243 65.7151 171.3770 44 D 4.5933 8.4248 119.6517 53.2148 40.5685 175.6361 45 A 3.7714 7.3210 119.1898 50.1886 17.6626 177.9580 46 V 4.0896 7.0996 116.0551 62.4658 34.2528 170.3937 47 R 5.1303 8.0504 121.3776 54.2306 31.6017 175.2661 48 C 4.8080 8.0615 125.2430 56.5225 43.6615 175.0521 49 K 4.4863 8.4744 108.5230 54.0468 32.1563 173.4638 50 D 4.9916 8.3009 118.3327 54.8295 40.7894 174.9342 51 C 4.7049 8.0279 114.1872 55.0838 37.5495 174.0687 52 G 3.5028 8.0828 111.8666 47.6507 0.0000 170.5295 53 H 4.5622 8.7860 118.7210 55.9812 27.6505 177.6078 54 R 3.7857 9.1659 125.9228 57.5371 30.9252 178.1257 55 I 3.6691 8.5086 113.1811 60.1524 36.5147 174.3569 56 L 4.3663 9.1789 119.9705 54.6133 42.5316 173.6195 57 L 4.8805 8.1204 120.7228 53.3877 45.8574 176.4365 58 K 3.9196 8.4525 118.1829 55.7462 32.6209 174.1423 59 A 3.8654 7.4096 116.1250 51.4323 19.7501 174.9227 60 R 4.8697 8.2060 115.9909 55.4160 32.5261 175.5853 61 T 4.6940 8.2091 111.4165 62.2178 72.2042 173.7974 62 K 4.4019 8.3841 120.8680 56.5968 32.6640 177.2924 63 R 4.4713 8.4585 115.0654 60.1264 30.1097 176.8473 64 L 3.3635 7.0301 116.8531 53.2097 42.5460 176.0405 65 V 4.1293 7.8117 113.0813 59.4318 34.4786 174.9448 66 Q 4.1774 8.2869 125.4103 54.4012 29.8271 174.4899 67 F 5.2340 8.1107 123.9554 55.4601 41.5830 174.9134 68 E 4.2592 8.8868 121.6438 55.8132 30.3168 176.8004 69 A 4.5961 8.4395 127.0560 50.0535 18.6225 176.3903 70 R 4.2244 7.9978 118.9781 56.3719 30.8840 175.9178 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 4.16 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 26 T 8.16 3.50 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 27 L 8.49 4.98 0.00 1.69 1.60 0.91 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 28 K 8.34 4.60 0.00 1.87 2.07 0.00 1.76 0.00 0.00 1.86 0.00 0.00 2.88 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.35 1.49 7.81 29 Y 7.68 4.60 0.00 2.79 2.89 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 0.00 0.00 0.00 30 I 8.13 4.71 1.91 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 1.55 0.93 0.00 0.00 31 C 8.72 4.63 0.00 3.03 3.11 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 0.00 0.00 0.00 0.00 32 A 8.55 4.17 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 33 E 8.32 4.10 0.00 1.98 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 2.26 2.14 0.00 34 C 7.86 4.34 0.00 3.08 3.05 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 35 S 7.95 5.05 0.00 3.95 4.28 0.00 0.00 0.00 0.00 0.00 0.00 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 8.16 4.43 0.00 3.92 3.74 0.00 0.00 0.00 0.00 0.00 0.00 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 8.65 4.58 0.00 1.70 1.80 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.48 7.81 38 L 8.31 4.42 0.00 1.73 1.65 1.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 39 S 8.18 5.43 0.00 3.93 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 40 L 8.66 4.54 0.00 1.58 1.47 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 41 S 8.35 4.63 0.00 3.98 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 42 R 8.31 3.81 0.00 1.91 2.01 0.00 3.12 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.78 0.00 43 T 8.83 3.42 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 8.42 4.59 0.00 2.54 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 7.32 3.77 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.10 4.09 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 0.70 0.00 0.00 0.87 0.00 0.00 47 R 8.05 5.13 0.00 1.87 2.00 0.00 3.25 0.00 0.00 3.13 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.60 0.00 48 C 8.06 4.81 0.00 2.91 2.82 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 0.00 0.00 0.00 0.00 49 K 8.47 4.49 0.00 1.73 1.69 0.00 1.78 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.33 1.34 7.81 50 D 8.30 4.99 0.00 2.69 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 51 C 8.03 4.70 0.00 3.18 3.26 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 52 G 8.08 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.79 4.56 0.00 3.17 3.29 0.00 5.65 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 R 9.17 3.79 0.00 1.77 1.93 0.00 3.17 0.00 0.00 3.27 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.64 0.00 55 I 8.51 3.67 1.89 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 1.48 0.54 0.93 0.00 0.00 56 L 9.18 4.37 0.00 1.89 1.93 0.81 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 57 L 8.12 4.88 0.00 1.89 1.54 0.94 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 58 K 8.45 3.92 0.00 1.64 1.70 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.57 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.88 1.13 7.81 59 A 7.41 3.87 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 60 R 8.21 4.87 0.00 1.70 1.80 0.00 3.21 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.64 0.00 61 T 8.21 4.69 4.21 0.00 0.00 0.00 0.00 0.00 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 62 K 8.38 4.40 0.00 1.83 1.79 0.00 1.51 0.00 0.00 1.84 0.00 0.00 3.04 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.44 7.81 63 R 8.46 4.47 0.00 1.88 1.98 0.00 3.02 0.00 0.00 3.20 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.61 0.00 64 L 7.03 3.36 0.00 1.65 1.74 0.89 0.64 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 65 V 7.81 4.13 1.66 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 0.64 0.00 0.00 0.81 0.00 0.00 66 Q 8.29 4.18 0.00 1.86 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.77 0.00 0.00 0.00 0.00 0.00 2.21 2.25 0.00 67 F 8.11 5.23 0.00 3.19 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 68 E 8.89 4.26 0.00 2.09 2.00 0.00 0.00 0.00 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 2.42 0.00 69 A 8.44 4.60 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.00 4.22 0.00 1.77 1.79 0.00 3.25 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 1.59 0.00