NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3492 8.2649 123.5889 52.2292 20.3101 176.5691 3 R 4.4852 7.7139 119.9706 54.4932 32.6465 176.0409 4 K 3.8053 9.3222 124.1707 59.7718 33.3924 178.2932 5 A 3.9829 8.2773 120.1173 55.4530 18.1181 178.2375 6 L 4.6665 8.0756 113.3192 55.1147 41.5970 177.1692 7 I 4.6910 7.8483 119.4019 60.6271 37.9936 176.8064 8 E 4.2524 8.2662 118.6395 56.9969 30.0797 176.6088 9 K 3.7063 7.6543 121.3157 60.0044 31.8816 177.7281 10 A 3.8740 8.0354 118.9732 55.0134 18.1876 178.8477 11 K 4.0127 8.7009 116.1623 55.4468 32.9950 179.2163 12 R 3.5957 8.6482 122.9493 57.7498 30.1823 178.5815 13 T 3.5135 9.0118 103.8033 64.0549 65.7628 169.8221 14 P 4.2914 0.0000 0.0000 64.9786 32.0058 178.3555 15 K 3.9111 9.7442 118.1018 55.6509 31.6683 176.0048 16 F 4.6067 7.5223 114.0358 56.4340 42.4375 174.7498 17 K 4.0996 9.1041 125.8882 59.0187 32.6181 177.3293 18 V 4.3952 7.3720 114.1114 61.1286 31.3773 176.6172 19 R 4.6826 7.7538 114.1016 55.5633 33.6206 176.0598 20 A 4.2502 7.9922 121.5662 52.5601 19.4774 177.7421 21 Y 4.8976 7.9968 117.9455 57.8830 38.0583 177.0126 22 T 2.9873 8.5243 108.4276 59.4308 71.7032 173.6817 23 R 4.2149 8.1348 121.5863 54.7470 30.5125 175.0992 24 C 4.7685 8.1393 119.0781 58.1923 32.4758 174.5537 25 V 3.8698 8.5011 125.6632 62.7804 30.5223 175.7334 26 R 4.4459 7.0833 117.6311 57.7144 31.8941 175.3993 27 C 4.2488 7.9626 112.5492 58.3811 30.7134 174.6170 28 G 4.4077 8.1032 107.9654 46.6324 0.0000 176.3268 29 R 4.4080 7.1264 117.2758 54.3968 29.4066 178.2981 30 A 5.5266 8.4563 127.3901 53.6322 18.0671 177.9616 31 R 4.1581 7.8873 115.3160 58.9562 30.3486 176.8422 32 S 4.7962 7.7602 111.8899 57.1554 63.3445 174.3900 33 V 3.9258 8.2716 114.3958 63.7228 31.9768 176.8248 34 Y 4.3952 9.9014 126.3295 61.8648 38.0290 180.4497 35 R 2.9806 8.1907 115.8593 56.4566 31.9601 178.2488 36 F 3.8290 8.5169 133.0603 60.8855 40.4985 175.7977 37 F 4.7512 9.0946 117.8838 56.8710 41.4221 176.9794 38 G 3.9394 8.6010 107.4050 45.2087 0.0000 172.7554 39 L 4.8530 7.5136 119.7310 53.5130 43.5780 175.6790 40 C 4.5805 8.1627 116.0734 56.9758 32.2886 174.5653 41 R 3.5695 8.5441 119.0965 59.9364 28.5596 179.0405 42 I 3.5658 7.5819 119.4342 64.3239 37.3774 177.7235 43 C 4.0102 8.0420 117.1671 62.9474 28.0545 176.2342 44 L 3.9029 8.0019 121.2418 58.4983 39.7357 179.1852 45 R 3.8140 7.2509 119.1659 58.6464 30.2213 178.2330 46 E 3.9609 8.1192 118.5598 59.4083 29.4912 179.3605 47 L 4.0205 8.3883 119.1037 57.6636 41.4788 179.1854 48 A 3.9336 7.6716 119.5891 55.7261 18.3058 179.1060 49 H 4.3242 7.8903 113.5114 59.1430 28.7578 177.7722 50 K 4.2344 7.5017 119.1509 57.8538 32.4293 178.1290 51 G 4.4151 8.3069 118.5516 46.1765 0.0000 174.3171 52 Q 3.9427 7.8603 119.5828 58.4462 28.7384 176.8393 53 L 4.5882 7.2204 116.3654 51.9637 41.5704 174.4019 54 P 4.2738 0.0000 0.0000 63.7338 31.7214 178.1775 55 G 4.0073 8.7525 107.7674 46.3314 0.0000 174.7342 56 V 3.9386 7.3462 120.5561 61.7190 29.7453 175.1136 57 R 4.2988 7.6327 124.1797 54.5614 31.4928 175.4855 58 K 4.2109 8.3571 119.9786 55.3257 32.6014 177.3240 59 A 4.2664 8.5817 127.3354 52.4832 19.0525 176.5581 60 S 4.6777 8.3300 113.2594 57.4135 65.4135 175.1643 61 W 4.2618 8.3790 123.5068 57.4002 27.2081 174.0538 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 2 A 8.26 4.35 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.71 4.49 0.00 2.08 1.85 0.00 3.23 0.00 0.00 3.36 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.79 0.00 4 K 9.32 3.81 0.00 1.82 1.90 0.00 1.69 0.00 0.00 1.83 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.55 1.48 7.81 5 A 8.28 3.98 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 6 L 8.08 4.67 0.00 1.76 1.78 0.95 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 7 I 7.85 4.69 1.95 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.97 0.90 0.00 0.00 8 E 8.27 4.25 0.00 2.15 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 2.32 2.31 0.00 9 K 7.65 3.71 0.00 1.35 1.59 0.00 1.44 0.00 0.00 1.47 0.00 0.00 2.78 0.00 0.00 2.99 0.00 0.00 0.00 0.00 0.93 0.54 7.81 10 A 8.04 3.87 1.27 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 0.00 0.00 0.00 0.00 0.00 11 K 8.70 4.01 0.00 1.80 1.93 0.00 1.73 0.00 0.00 1.62 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.62 1.42 7.81 12 R 8.65 3.60 0.00 1.90 1.40 0.00 3.49 0.00 0.00 3.21 7.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.71 0.00 13 T 9.01 3.51 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 1.18 0.00 0.00 14 P 0.00 4.29 0.00 2.42 2.21 0.00 3.74 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.96 0.00 15 K 9.74 3.91 0.00 1.79 2.20 0.00 1.82 0.00 0.00 1.85 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 0.57 1.14 7.81 16 F 7.52 4.61 0.00 3.16 2.85 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 0.00 0.00 0.00 0.00 17 K 9.10 4.10 0.00 1.87 1.99 0.00 1.48 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.45 1.60 7.81 18 V 7.37 4.40 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 0.74 0.00 0.00 0.95 0.00 0.00 19 R 7.75 4.68 0.00 1.97 2.02 0.00 3.63 0.00 0.00 3.36 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.74 0.00 20 A 7.99 4.25 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 21 Y 8.00 4.90 0.00 2.99 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 22 T 8.52 2.99 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 23 R 8.13 4.21 0.00 1.96 2.03 0.00 3.52 0.00 0.00 3.60 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.39 0.00 24 C 8.14 4.77 0.00 3.04 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 25 V 8.50 3.87 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 0.80 0.00 0.00 0.94 0.00 0.00 26 R 7.08 4.45 0.00 1.75 1.81 0.00 3.23 0.00 0.00 3.27 7.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.57 0.00 27 C 7.96 4.25 0.00 3.16 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 28 G 8.10 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.13 4.41 0.00 1.78 1.50 0.00 3.49 0.00 0.00 3.25 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.78 0.00 30 A 8.46 5.53 1.42 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 0.00 0.00 0.00 0.00 0.00 31 R 7.89 4.16 0.00 1.79 2.01 0.00 3.25 0.00 0.00 3.28 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.70 0.00 32 S 7.76 4.80 0.00 4.13 3.93 0.00 0.00 0.00 0.00 0.00 0.00 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 8.27 3.93 2.19 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 0.86 0.00 0.00 1.05 0.00 0.00 34 Y 9.90 4.40 0.00 3.18 3.31 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 35 R 8.19 2.98 0.00 2.02 2.10 0.00 3.18 0.00 0.00 3.29 7.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.64 0.00 36 F 8.52 3.83 0.00 2.89 2.90 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 37 F 9.09 4.75 0.00 3.32 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 38 G 8.60 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 0.00 0.00 0.00 39 L 7.51 4.85 0.00 1.75 1.53 0.85 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 40 C 8.16 4.58 0.00 3.19 3.09 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.54 3.57 0.00 2.05 2.33 0.00 2.79 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.75 0.00 42 I 7.58 3.57 1.85 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 1.62 0.57 0.89 0.00 0.00 43 C 8.04 4.01 0.00 3.11 2.96 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 44 L 8.00 3.90 0.00 1.28 1.71 0.54 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 45 R 7.25 3.81 0.00 1.67 1.98 0.00 3.09 0.00 0.00 3.12 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.48 0.00 46 E 8.12 3.96 0.00 2.15 1.97 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 2.32 2.49 0.00 47 L 8.39 4.02 0.00 1.60 1.66 0.89 0.69 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 48 A 7.67 3.93 1.24 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 0.00 0.00 49 H 7.89 4.32 0.00 3.33 3.34 0.00 5.66 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 K 7.50 4.23 0.00 2.02 1.82 0.00 1.78 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.65 7.81 51 G 8.31 4.42 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 0.00 0.00 0.00 0.00 0.00 0.00 52 Q 7.86 3.94 0.00 2.05 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.91 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 53 L 7.22 4.59 0.00 1.72 1.82 0.48 1.05 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 54 P 0.00 4.27 0.00 2.26 2.22 0.00 3.94 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.02 0.00 55 G 8.75 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.35 3.94 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 1.29 0.00 0.00 57 R 7.63 4.30 0.00 1.84 1.85 0.00 3.31 0.00 0.00 3.25 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 58 K 8.36 4.21 0.00 1.82 1.78 0.00 1.84 0.00 0.00 1.75 0.00 0.00 3.04 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.45 1.46 7.81 59 A 8.58 4.27 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.33 4.68 0.00 3.86 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 61 W 8.38 4.26 0.00 3.39 3.06 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