NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 5.6337 8.1232 119.9409 54.3497 42.5012 173.7356 2 K 4.8233 8.4351 121.8737 53.5926 35.3621 173.5024 3 L 3.8330 8.6051 127.7993 54.6058 41.9750 175.3441 4 I 4.1746 7.6298 120.6156 61.7840 39.8101 176.0346 5 G 3.9014 7.0397 109.5832 45.8493 0.0000 171.8044 6 S 4.9960 9.1431 116.1997 56.2958 66.2454 174.9379 7 C 5.4635 8.5764 124.3199 56.4785 34.9638 174.1051 8 V 4.1597 7.5168 118.0741 60.0578 34.0184 174.5782 9 W 2.8192 7.9245 124.2614 57.5532 28.4311 174.7065 10 G 4.0232 8.5131 108.0695 45.6794 0.0000 174.1779 11 A 4.0870 7.3291 121.7172 51.7830 19.1106 178.4687 12 V 3.6632 8.4536 121.1238 66.3723 31.8617 177.6504 13 N 4.8683 7.8617 116.1151 53.6236 39.1634 174.3076 14 Y 4.8193 7.5734 120.7079 58.4166 39.7543 175.4389 15 T 3.9997 8.5477 120.6381 61.4160 70.8092 174.1077 16 S 4.0581 8.4197 124.3948 61.4693 64.3584 175.4336 17 N 4.6341 7.6514 120.7961 51.5950 35.4473 175.5490 18 C 4.0686 7.8643 124.9679 59.9300 44.5200 173.7769 19 N 4.2885 8.2231 117.6586 56.8833 38.5389 176.4792 20 A 3.9662 7.9105 121.4503 54.9378 18.4732 178.8794 21 E 3.8244 8.3856 118.0849 59.7835 29.7009 178.5059 22 C 4.2635 8.4684 116.7789 59.9135 38.5006 176.0178 23 K 4.1882 8.3189 122.7995 58.8574 31.5140 178.8141 24 R 3.7953 8.3828 118.3045 59.6428 30.1764 178.3335 25 R 4.1794 8.0946 116.7284 59.2855 30.5550 176.0597 26 G 3.2967 6.7107 106.1715 46.1740 0.0000 172.6468 27 Y 4.7455 8.2125 116.9899 55.2385 41.4631 177.5132 28 K 3.9696 9.0184 120.7022 59.3638 32.3775 176.9952 29 G 4.0827 7.3022 108.7851 47.2360 0.0000 172.4016 30 G 4.6762 8.8277 107.6867 46.1603 0.0000 173.7135 31 H 4.9592 8.9749 115.2230 55.0232 31.6579 173.1715 32 C 5.1999 8.9739 116.1619 57.2948 36.0286 171.6557 33 G 4.3196 7.6928 108.9928 46.2604 0.0000 174.7427 34 S 4.5699 8.1985 117.8027 58.1770 63.1531 173.5687 35 F 4.9283 7.7336 125.7585 59.3254 46.6833 175.1517 36 L 4.1649 7.3946 122.0639 53.4984 40.5139 178.2763 37 N 6.0173 7.4540 114.6692 52.7352 36.8825 176.5604 38 V 4.1604 7.8271 112.7616 63.2020 34.9034 176.9107 39 N 4.8771 7.7477 116.6318 51.6650 41.1078 174.4167 40 C 4.8802 8.6700 123.2541 55.8414 39.6366 170.7119 41 W 4.9856 8.2620 123.5466 55.1777 30.3346 175.9945 42 C 4.5044 9.0238 124.5049 56.4171 36.7878 173.2671 43 E 4.7529 8.8467 124.2698 56.5878 30.1204 177.3776 44 T 4.0322 8.5176 118.4194 62.8588 67.3928 172.5150 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 1 D 8.12 5.63 0.00 2.75 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 2 K 8.44 4.82 0.00 1.64 1.72 0.00 1.81 0.00 0.00 1.93 0.00 0.00 2.93 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.64 1.81 7.81 3 L 8.61 3.83 0.00 0.76 1.40 0.17 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 4 I 7.63 4.17 1.77 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.67 0.72 0.00 0.00 5 G 7.04 3.90 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 0.00 0.00 0.00 6 S 9.14 5.00 0.00 3.72 3.63 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 7 C 8.58 5.46 0.00 2.90 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 8 V 7.52 4.16 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.00 0.00 0.74 0.00 0.00 9 W 7.92 2.82 0.00 3.01 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 10 G 8.51 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 11 A 7.33 4.09 1.25 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 0.00 0.00 0.00 12 V 8.45 3.66 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 0.92 0.00 0.00 0.92 0.00 0.00 13 N 7.86 4.87 0.00 2.71 2.73 0.00 0.00 6.89 7.43 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 14 Y 7.57 4.82 0.00 3.00 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 15 T 8.55 4.00 4.08 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 1.14 0.00 0.00 16 S 8.42 4.06 0.00 4.03 3.95 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 0.00 0.00 0.00 0.00 17 N 7.65 4.63 0.00 2.78 2.72 0.00 0.00 6.69 7.66 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 18 C 7.86 4.07 0.00 2.99 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 19 N 8.22 4.29 0.00 2.94 2.82 0.00 0.00 7.08 8.05 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 20 A 7.91 3.97 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.39 3.82 0.00 2.10 2.08 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 2.25 2.36 0.00 22 C 8.47 4.26 0.00 3.15 3.04 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 0.00 0.00 0.00 23 K 8.32 4.19 0.00 2.06 1.97 0.00 1.83 0.00 0.00 1.78 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.38 7.81 24 R 8.38 3.80 0.00 1.92 2.16 0.00 3.38 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.73 0.00 25 R 8.09 4.18 0.00 2.27 2.17 0.00 3.30 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 2.07 0.00 26 G 6.71 3.30 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 0.00 27 Y 8.21 4.75 0.00 3.06 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 28 K 9.02 3.97 0.00 1.86 1.91 0.00 1.83 0.00 0.00 1.73 0.00 0.00 2.93 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.48 1.52 7.81 29 G 7.30 4.08 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 0.00 0.00 0.00 30 G 8.83 4.68 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 H 8.97 4.96 0.00 3.28 3.47 0.00 5.44 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 C 8.97 5.20 0.00 3.22 3.32 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 33 G 7.69 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 0.00 0.00 0.00 0.00 34 S 8.20 4.57 0.00 3.86 3.90 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 35 F 7.73 4.93 0.00 2.80 2.97 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 36 L 7.39 4.16 0.00 1.79 1.61 1.04 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 37 N 7.45 6.02 0.00 2.84 2.91 0.00 0.00 6.27 7.64 0.00 0.00 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 V 7.83 4.16 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 0.58 0.00 0.00 1.01 0.00 0.00 39 N 7.75 4.88 0.00 2.19 1.80 0.00 0.00 6.93 7.59 0.00 0.00 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 C 8.67 4.88 0.00 2.83 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 41 W 8.26 4.99 0.00 3.46 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 42 C 9.02 4.50 0.00 2.19 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 0.00 0.00 0.00 43 E 8.85 4.75 0.00 1.96 1.86 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 0.00 1.88 1.99 0.00 44 T 8.52 4.03 4.60 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 0.00 0.00 0.00 1.49 0.00 0.00