NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 T 4.3564 8.0333 117.3742 63.1640 70.0693 174.5470 5 N 4.0567 8.4218 119.5493 54.6821 38.6963 169.9845 6 V 3.7955 7.1724 118.5199 64.2189 32.0045 175.6692 7 G 3.8883 8.8737 115.6318 45.3863 0.0000 172.1681 8 R 4.1298 7.7756 120.5445 55.4182 30.6767 175.0973 9 E 4.6251 8.6432 125.9560 54.8753 31.1065 175.5344 10 C 5.0395 8.4109 121.8710 55.2543 44.0982 174.3923 11 C 4.6688 8.6033 120.1938 55.9077 40.0008 173.9244 12 L 4.0538 8.5072 126.0039 57.1612 41.6346 177.6548 13 E 4.5255 7.5159 114.9621 54.5811 33.5173 174.3899 14 Y 4.8428 8.0839 119.6935 57.6127 39.0513 175.2385 15 F 4.3570 9.5001 126.5464 58.4568 40.0569 174.3810 16 K 4.2998 9.0596 125.3958 54.4895 34.0845 176.0729 17 G 3.4709 8.1900 109.8617 43.3989 0.0000 171.9153 18 A 4.2812 8.3383 123.8133 51.1220 18.9002 177.5463 19 I 3.6992 8.3640 125.1545 60.7645 37.4145 175.0103 20 P 4.4662 0.0000 0.0000 61.3860 30.3991 176.4203 21 L 3.8194 8.2411 128.9877 58.4001 42.3279 179.4628 22 R 4.0557 7.7997 113.2918 58.5502 29.6409 177.4853 23 K 4.1918 8.0712 117.6564 57.5558 32.5327 176.7692 24 L 4.3975 7.6644 119.9768 54.7562 42.0660 175.8837 25 K 4.4435 9.1077 125.1101 58.1894 33.8273 175.3612 26 T 4.9447 7.6573 111.9807 61.3704 71.0104 171.3225 27 W 5.8561 8.2906 118.1236 55.7159 31.1130 173.3370 28 Y 4.3883 8.8131 118.2103 55.7433 41.4223 173.0772 29 Q 5.1188 8.5778 121.7283 54.6272 30.6948 175.3781 30 T 4.4546 8.3146 116.8707 60.9240 70.3346 174.1409 31 S 4.1614 8.8315 116.3101 58.5619 62.6521 174.9395 32 E 4.0352 8.9424 124.7839 59.2880 29.0990 177.5615 33 D 4.6285 7.9933 117.1996 54.8211 41.4564 176.2529 34 C 4.4649 7.8127 117.2309 56.7454 40.8600 173.8496 35 S 4.1413 8.7554 117.4531 61.0169 62.2045 174.7709 36 R 4.4853 7.5803 117.9698 54.2134 31.1927 175.6356 37 D 4.4706 8.6619 122.3749 54.4221 42.0944 174.9163 38 A 5.0605 8.2653 126.7163 50.8223 23.4498 174.5578 39 I 4.6020 8.5886 120.8610 59.5282 39.7149 174.9311 40 V 4.4617 8.1246 127.5786 61.2436 33.2167 174.5098 41 F 5.2118 8.8316 127.2074 56.6654 40.8967 174.8219 42 V 4.9852 9.0392 123.6380 61.3725 33.7879 175.5136 43 T 4.7202 8.9432 118.8530 60.8193 70.1840 175.9867 44 V 3.6137 8.6712 122.6782 65.8923 31.4798 176.8252 45 Q 4.1817 7.9743 114.7014 56.4829 29.0163 176.1842 46 G 3.9779 8.2016 107.5622 45.3545 0.0000 173.3385 47 R 4.5244 8.1282 119.7211 55.0481 31.8548 174.9313 48 A 5.3772 8.5121 125.3966 50.2124 21.9705 175.7973 49 I 4.4251 8.5929 121.8529 59.4599 40.7715 174.3238 50 C 4.9135 8.9360 125.6943 56.9950 41.6413 173.1382 51 S 5.0582 9.2294 119.5835 56.4366 67.5721 173.1758 52 D 3.7787 7.9482 122.3254 52.9812 40.9692 175.4849 53 P 4.2745 0.0000 0.0000 64.9542 31.5005 177.0404 54 N 4.5613 8.2145 114.1436 53.7412 39.1809 175.5183 55 N 4.4381 7.9831 118.9849 52.8517 40.4474 175.3510 56 K 3.9152 8.6309 127.6926 60.4197 32.7300 179.5429 57 R 3.9022 8.0132 118.8867 58.6625 30.0314 179.1149 58 V 3.7100 7.9437 117.7622 65.9944 31.6146 178.1371 59 K 3.8387 8.1402 118.3355 59.5181 31.8128 178.7277 60 N 4.2659 8.3114 116.9509 56.6577 38.8848 176.7636 61 A 4.0276 8.0406 122.1780 55.0594 18.4306 179.8081 62 V 3.1894 7.9179 116.7167 65.9422 31.5744 178.3019 63 K 3.8879 8.0107 118.2183 59.5692 31.6614 178.3832 64 Y 4.2263 8.1280 118.8766 61.0359 38.8857 178.1087 65 L 3.7197 7.9724 119.5614 57.8097 41.5183 179.5972 66 Q 4.1737 8.4787 117.7147 58.8891 28.7062 178.7381 67 S 4.2947 7.8793 114.2409 59.1503 63.4152 176.0633 68 L 4.2571 7.8349 118.3966 54.4235 40.8405 176.7247 69 E 4.0623 9.2921 129.9103 57.5304 29.4000 175.8936 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 4 T 8.03 4.36 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 1.23 0.00 0.00 5 N 8.42 4.06 0.00 2.83 2.87 0.00 0.00 6.44 6.79 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 6 V 7.17 3.80 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 0.73 0.00 0.00 0.93 0.00 0.00 7 G 8.87 3.89 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 0.00 0.00 0.00 8 R 7.78 4.13 0.00 1.98 1.96 0.00 3.26 0.00 0.00 3.17 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.58 0.00 9 E 8.64 4.63 0.00 1.99 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 2.36 2.46 0.00 10 C 8.41 5.04 0.00 2.95 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 11 C 8.60 4.67 0.00 2.95 3.01 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 12 L 8.51 4.05 0.00 1.61 1.69 0.90 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 13 E 7.52 4.53 0.00 1.88 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.24 0.00 14 Y 8.08 4.84 0.00 2.91 2.78 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 15 F 9.50 4.36 0.00 3.06 3.20 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 0.00 0.00 0.00 16 K 9.06 4.30 0.00 1.45 1.54 0.00 1.76 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.32 1.40 7.81 17 G 8.19 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 A 8.34 4.28 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 19 I 8.36 3.70 1.75 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.63 0.47 0.00 0.00 20 P 0.00 4.47 0.00 2.17 2.18 0.00 3.51 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.83 0.00 21 L 8.24 3.82 0.00 1.56 1.50 0.74 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 22 R 7.80 4.06 0.00 1.96 2.03 0.00 3.07 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.64 0.00 23 K 8.07 4.19 0.00 2.00 1.87 0.00 1.64 0.00 0.00 1.63 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.39 7.81 24 L 7.66 4.40 0.00 1.81 1.71 0.58 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 25 K 9.11 4.44 0.00 1.84 2.01 0.00 1.82 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.40 1.39 7.81 26 T 7.66 4.94 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 1.26 0.00 0.00 27 W 8.29 5.86 0.00 3.18 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 Y 8.81 4.39 0.00 2.89 2.80 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 29 Q 8.58 5.12 0.00 2.36 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.09 0.00 0.00 0.00 0.00 0.00 2.33 2.56 0.00 30 T 8.31 4.45 4.31 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 1.30 0.00 0.00 31 S 8.83 4.16 0.00 3.91 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 32 E 8.94 4.04 0.00 2.13 2.12 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 2.30 2.37 0.00 33 D 7.99 4.63 0.00 2.71 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 C 7.81 4.46 0.00 3.20 3.03 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 35 S 8.76 4.14 0.00 3.81 3.87 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 36 R 7.58 4.49 0.00 1.84 1.75 0.00 3.02 0.00 0.00 2.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.46 0.00 37 D 8.66 4.47 0.00 2.67 2.65 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.27 5.06 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 39 I 8.59 4.60 1.49 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.79 0.11 0.00 0.00 40 V 8.12 4.46 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 0.00 0.00 1.01 0.00 0.00 0.65 0.00 0.00 41 F 8.83 5.21 0.00 3.09 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 42 V 9.04 4.99 2.18 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 1.13 0.00 0.00 1.09 0.00 0.00 43 T 8.94 4.72 4.48 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 1.24 0.00 0.00 44 V 8.67 3.61 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 0.81 0.00 0.00 1.02 0.00 0.00 45 Q 7.97 4.18 0.00 2.21 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.70 0.00 0.00 0.00 0.00 0.00 2.31 2.30 0.00 46 G 8.20 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 0.00 0.00 0.00 47 R 8.13 4.52 0.00 1.92 1.78 0.00 3.02 0.00 0.00 3.12 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.57 0.00 48 A 8.51 5.38 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 49 I 8.59 4.43 1.96 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.70 0.67 0.00 0.00 50 C 8.94 4.91 0.00 3.03 3.20 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 0.00 0.00 0.00 51 S 9.23 5.06 0.00 3.79 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 52 D 7.95 3.78 0.00 1.58 2.16 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.27 0.00 2.05 2.05 0.00 3.68 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.06 0.00 54 N 8.21 4.56 0.00 2.80 2.83 0.00 0.00 6.92 7.52 0.00 0.00 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 N 7.98 4.44 0.00 2.67 2.75 0.00 0.00 6.82 6.60 0.00 0.00 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 K 8.63 3.92 0.00 1.96 2.03 0.00 1.56 0.00 0.00 1.79 0.00 0.00 2.91 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.46 7.81 57 R 8.01 3.90 0.00 2.04 1.99 0.00 3.11 0.00 0.00 3.24 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.66 0.00 58 V 7.94 3.71 2.31 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 1.09 0.00 0.00 1.06 0.00 0.00 59 K 8.14 3.84 0.00 1.97 1.80 0.00 1.69 0.00 0.00 1.53 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.60 7.81 60 N 8.31 4.27 0.00 2.82 2.96 0.00 0.00 7.12 8.07 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 61 A 8.04 4.03 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 V 7.92 3.19 1.85 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 -0.17 0.00 0.00 0.32 0.00 0.00 63 K 8.01 3.89 0.00 2.09 1.86 0.00 1.72 0.00 0.00 1.57 0.00 0.00 2.86 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.55 7.81 64 Y 8.13 4.23 0.00 2.81 3.27 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 65 L 7.97 3.72 0.00 2.01 1.89 1.35 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 66 Q 8.48 4.17 0.00 2.19 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 7.01 0.00 0.00 0.00 0.00 0.00 2.72 2.61 0.00 67 S 7.88 4.29 0.00 4.08 4.13 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.83 4.26 0.00 1.60 0.77 0.57 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 69 E 9.29 4.06 0.00 1.91 1.87 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 2.31 2.36 0.00