NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 T 4.2717 8.1744 117.3728 62.7705 69.9133 173.0742 4 Q 3.9508 8.5579 124.0369 56.4320 29.3512 174.9567 5 L 4.3936 9.2685 125.8535 53.8669 44.1012 176.8455 6 M 4.2347 8.2636 122.2915 58.5305 31.8764 179.1207 7 G 3.7821 7.9232 106.2477 47.1305 0.0000 175.4854 8 E 4.0402 8.0706 120.8423 59.3420 29.4530 179.5616 9 R 3.9929 7.9160 117.7287 59.0830 30.0360 179.0548 10 I 3.7471 7.7574 119.7132 64.4097 37.1497 178.4398 11 R 4.1656 8.4496 120.6218 58.8568 29.9670 178.2862 12 A 4.0009 8.2132 120.6690 55.2248 18.5210 179.5576 13 R 3.8693 8.0974 117.1868 59.6121 29.6653 178.6754 14 R 3.9442 8.3930 118.8481 59.4600 30.1512 178.6904 15 K 4.0486 8.3528 118.4537 59.0562 31.7874 178.9780 16 K 3.8459 7.8898 119.2159 59.8215 32.1882 178.4205 17 L 4.1247 7.7082 116.1009 54.9230 41.9094 176.8918 18 K 3.9005 7.8389 116.9566 57.7119 29.6687 175.5591 19 I 4.5988 7.1620 109.5793 58.4300 40.3968 176.0723 20 R 4.2062 8.1824 118.8266 55.9666 31.5089 177.6021 21 Q 3.9490 8.6071 118.5281 59.2606 28.6311 179.0416 22 A 3.9494 8.0424 120.9197 55.1313 18.3995 179.4294 23 A 3.9288 7.8624 118.7737 54.9423 18.6407 179.3524 24 L 3.9804 7.9725 119.0541 58.2460 42.1128 179.1307 25 G 3.8204 8.2487 107.3989 47.0170 0.0000 175.1300 26 K 3.8703 8.0024 121.1149 59.6662 32.2654 178.3655 27 M 4.1912 7.8013 117.2060 58.1613 31.8912 178.3397 28 V 4.0511 7.7963 117.4064 63.3135 31.9408 176.7313 29 G 4.0727 8.9871 106.5142 45.3617 0.0000 172.9075 30 V 4.5126 7.4630 111.5471 58.0781 35.4853 175.0999 31 S 4.4502 8.1143 116.2295 57.8379 64.9806 174.7217 32 N 4.2042 8.5336 120.0577 56.1110 36.7491 177.2971 33 V 3.4194 7.6618 119.7382 65.7355 31.5568 177.5882 34 A 3.9729 7.3494 121.5177 54.4715 17.9863 179.7077 35 I 3.1292 6.7928 117.4740 64.2093 37.0777 178.4396 36 S 4.0255 7.9336 114.1253 61.5584 62.0597 176.1288 37 Q 3.9860 8.4413 120.8270 58.9121 28.4702 179.1845 38 W 4.7165 8.0848 121.3916 59.4985 28.7221 178.4671 39 E 4.3132 8.6545 118.8316 59.2828 28.6560 178.6711 40 R 4.4358 8.0469 115.3296 55.2678 30.1966 176.4618 41 S 3.8526 7.8804 113.0341 59.3876 61.2331 173.3432 42 E 4.1125 8.3081 123.6377 59.0470 29.2646 176.6285 43 T 4.8069 7.6891 106.4715 60.3366 72.0292 171.8262 44 E 4.5690 8.3521 120.8952 53.2787 32.0953 174.6335 45 P 3.8309 0.0000 0.0000 62.4961 31.7789 176.7609 46 N 4.7365 8.4494 118.8229 52.0665 40.0792 176.0963 47 G 3.4970 8.4305 105.8742 48.1526 0.0000 175.2802 48 E 3.9558 8.0741 122.0764 58.9204 29.7012 178.5230 49 N 4.4378 9.0886 116.9003 56.0627 38.5657 177.2057 50 L 3.6613 8.3213 122.1901 57.9651 42.2211 179.0947 51 L 3.9420 7.7961 118.3471 57.7679 41.6079 179.3451 52 A 4.0288 8.1106 120.7405 54.9423 18.2928 179.4348 53 L 4.0069 8.3678 119.5766 58.3402 42.2979 179.3593 54 S 4.1722 8.1976 114.2547 61.3309 62.6219 176.5970 55 K 3.9095 7.8099 120.7473 59.2853 31.9641 178.7827 56 A 4.1474 7.8979 119.3890 54.7710 18.3603 178.7712 57 L 4.3344 7.9271 114.7697 53.9219 42.4993 176.5580 58 Q 3.5088 7.9599 116.9417 57.1492 26.6915 172.3467 59 C 4.9074 7.8731 110.8834 55.8254 33.2363 173.4096 60 S 4.6639 8.2259 113.7908 56.8941 65.4621 173.0218 61 P 4.2475 0.0000 0.0000 66.0258 31.0191 178.7470 62 D 4.3496 8.0562 117.1822 57.3938 40.8120 177.9275 63 Y 4.0242 8.1669 120.0292 60.5902 38.6715 178.1811 64 L 3.7421 7.7373 119.3445 57.8111 41.5551 179.6451 65 L 3.9150 7.6982 117.2743 57.1005 41.7188 178.2421 66 K 4.2703 8.2414 115.8127 55.1089 34.5621 177.4233 67 G 3.4008 7.5181 106.1524 44.5305 0.0000 173.2512 68 D 4.5833 8.5933 118.4048 54.6428 41.0220 176.3675 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 3 T 8.17 4.27 4.22 0.00 0.00 0.00 0.00 0.00 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 4 Q 8.56 3.95 0.00 2.08 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.92 0.00 0.00 0.00 0.00 0.00 2.31 2.43 0.00 5 L 9.27 4.39 0.00 1.71 1.54 0.92 0.53 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 6 M 8.26 4.23 0.00 2.01 2.05 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.43 0.00 7 G 7.92 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 0.00 0.00 0.00 8 E 8.07 4.04 0.00 2.12 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 2.34 2.35 0.00 9 R 7.92 3.99 0.00 1.91 1.88 0.00 2.21 0.00 0.00 3.10 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.61 0.00 10 I 7.76 3.75 2.13 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.90 1.13 0.00 0.00 11 R 8.45 4.17 0.00 1.92 1.96 0.00 3.17 0.00 0.00 3.28 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.53 0.00 12 A 8.21 4.00 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 0.00 0.00 13 R 8.10 3.87 0.00 2.27 2.14 0.00 3.18 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.72 0.00 14 R 8.39 3.94 0.00 1.95 2.08 0.00 3.41 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.70 0.00 15 K 8.35 4.05 0.00 1.95 1.85 0.00 1.77 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.68 1.58 7.81 16 K 7.89 3.85 0.00 1.99 1.95 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.10 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.55 7.81 17 L 7.71 4.12 0.00 1.90 1.72 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 18 K 7.84 3.90 0.00 1.95 1.94 0.00 1.64 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.55 7.81 19 I 7.16 4.60 1.88 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 1.37 0.69 0.97 0.00 0.00 20 R 8.18 4.21 0.00 2.05 2.10 0.00 2.97 0.00 0.00 3.33 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.77 0.00 21 Q 8.61 3.95 0.00 2.08 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.44 2.42 0.00 22 A 8.04 3.95 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 23 A 7.86 3.93 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 24 L 7.97 3.98 0.00 1.82 1.84 0.99 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 25 G 8.25 3.82 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 0.00 0.00 0.00 26 K 8.00 3.87 0.00 1.82 2.05 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.15 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.55 7.81 27 M 7.80 4.19 0.00 2.09 2.27 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.57 0.00 28 V 7.80 4.05 2.22 0.00 0.00 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 1.13 0.00 0.00 29 G 8.99 4.07 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 0.00 0.00 0.00 30 V 7.46 4.51 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 1.15 0.00 0.00 0.65 0.00 0.00 31 S 8.11 4.45 0.00 3.97 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 32 N 8.53 4.20 0.00 2.87 3.07 0.00 0.00 5.55 7.68 0.00 0.00 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 7.66 3.42 1.98 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 0.96 0.00 0.00 0.87 0.00 0.00 34 A 7.35 3.97 0.76 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 0.00 0.00 35 I 6.79 3.13 1.86 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.09 0.92 0.00 0.00 36 S 7.93 4.03 0.00 3.99 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 37 Q 8.44 3.99 0.00 2.08 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.58 0.00 0.00 0.00 0.00 0.00 2.68 2.48 0.00 38 W 8.08 4.72 0.00 3.54 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 39 E 8.65 4.31 0.00 2.15 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 0.00 2.42 2.69 0.00 40 R 8.05 4.44 0.00 1.86 1.96 0.00 3.32 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 41 S 7.88 3.85 0.00 4.03 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 42 E 8.31 4.11 0.00 1.97 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 0.00 2.35 2.27 0.00 43 T 7.69 4.81 4.39 0.00 0.00 0.00 0.00 0.00 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 44 E 8.35 4.57 0.00 1.87 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 0.00 2.15 2.24 0.00 45 P 0.00 3.83 0.00 1.54 0.49 0.00 3.29 0.00 0.00 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.88 0.00 46 N 8.45 4.74 0.00 3.01 3.05 0.00 0.00 6.07 6.95 0.00 0.00 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 G 8.43 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 48 E 8.07 3.96 0.00 2.05 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 2.41 2.42 0.00 49 N 9.09 4.44 0.00 2.81 3.01 0.00 0.00 6.69 6.74 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 50 L 8.32 3.66 0.00 1.57 1.74 0.75 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 51 L 7.80 3.94 0.00 1.72 1.69 0.91 0.80 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 52 A 8.11 4.03 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 53 L 8.37 4.01 0.00 1.84 1.83 1.15 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 54 S 8.20 4.17 0.00 4.32 4.19 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 55 K 7.81 3.91 0.00 1.93 1.93 0.00 1.73 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.48 1.65 7.81 56 A 7.90 4.15 1.41 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 57 L 7.93 4.33 0.00 1.69 1.77 1.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 58 Q 7.96 3.51 0.00 2.22 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.65 0.00 0.00 0.00 0.00 0.00 2.30 2.41 0.00 59 C 7.87 4.91 0.00 3.01 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 60 S 8.23 4.66 0.00 4.09 4.05 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 61 P 0.00 4.25 0.00 2.16 2.11 0.00 3.61 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 2.10 2.17 0.00 62 D 8.06 4.35 0.00 2.72 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 63 Y 8.17 4.02 0.00 3.15 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 64 L 7.74 3.74 0.00 1.82 1.61 0.92 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 65 L 7.70 3.91 0.00 1.56 1.65 0.86 0.56 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 66 K 8.24 4.27 0.00 1.75 1.77 0.00 1.71 0.00 0.00 1.68 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.32 1.28 7.81 67 G 7.52 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.59 4.58 0.00 2.77 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