NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 17 R 4.2494 8.2544 119.0784 55.9365 30.9293 174.6354 18 D 4.4460 8.8059 123.8423 52.6214 40.9708 173.6660 19 L 4.3518 8.2570 126.5135 54.7029 43.0696 178.3473 20 S 4.2647 8.3743 116.6731 60.7779 62.8812 175.7623 21 Y 4.2560 7.8798 121.4131 59.8655 37.4285 177.8611 22 L 3.9505 7.0067 120.4843 57.2244 41.3974 178.6709 23 L 3.9964 7.5046 116.7352 55.9545 41.9409 178.1949 24 K 4.2913 7.6908 117.0762 56.0798 32.7660 177.0954 25 I 3.9352 6.7453 121.0637 61.0371 37.7559 176.1066 26 K 4.0597 8.8145 126.7144 59.2379 32.5856 177.2175 27 E 4.6038 7.7863 118.1561 54.6753 32.2869 176.8938 28 L 3.9418 8.3235 124.0435 58.2387 42.4475 179.5920 29 K 3.9906 7.9835 118.0129 59.4213 32.0780 179.0662 30 E 3.9768 8.1477 118.1450 59.4152 29.4708 179.0796 31 A 4.0809 8.2491 120.9490 55.0765 18.3240 179.8771 32 K 4.0100 8.3190 117.1119 59.6197 32.1504 179.7866 33 K 4.0339 8.0431 118.4373 59.5424 31.8207 179.3174 34 E 4.0744 8.4281 118.9416 59.2026 29.2717 179.2574 35 F 4.1389 8.4638 120.9377 61.3386 39.5537 176.7968 36 E 3.7374 8.6108 119.2630 58.9924 29.3214 178.8031 37 K 3.9374 8.0388 119.9733 59.5232 32.3906 178.9203 38 I 3.9892 7.5101 113.2556 63.4050 37.5350 177.9587 39 F 3.8493 7.9636 122.8923 61.2764 39.1329 177.1560 40 I 3.6178 7.8615 119.3782 64.2776 36.8778 178.2294 41 E 3.8953 8.1763 119.4123 59.4048 29.2779 179.0225 42 E 3.7630 8.0444 119.1204 59.2832 29.6998 179.0667 43 K 3.6318 7.7917 118.4854 59.0644 31.9035 179.3822 44 L 3.7726 7.8917 119.5413 57.6877 41.6634 179.4912 45 R 3.2219 7.3816 118.4827 59.2173 29.7564 178.1360 46 E 3.7386 7.7907 118.0425 58.5838 29.7420 177.3488 47 Y 4.7263 7.5466 115.4338 57.2217 38.8062 175.4062 48 D 4.3241 8.1958 116.7709 56.0027 38.9799 173.5166 49 Y 3.4633 8.1834 112.6452 58.9883 36.2590 171.1519 50 D 4.6331 8.0239 120.1970 53.4248 41.3714 176.2078 51 L 4.0184 8.4099 128.4866 57.4770 41.6882 179.0577 52 K 3.8710 8.1390 119.4152 59.6771 32.0643 178.8451 53 R 3.8411 8.5151 116.4110 59.4221 29.5132 178.6342 54 T 3.6389 8.0948 116.4277 66.2582 68.4358 176.2532 55 A 3.9712 8.0746 122.4066 55.3570 17.9594 179.5250 56 E 3.8982 7.8485 116.9598 59.6066 29.2696 179.5529 57 E 3.9295 8.1637 118.2926 58.9006 29.6175 178.5990 58 I 4.3392 7.6161 109.9498 60.4375 38.3702 175.7261 59 G 3.8150 7.8670 107.9229 46.8623 0.0000 173.1931 60 I 4.6872 7.4558 110.9692 57.6263 41.0306 174.8614 61 D 4.5613 8.2926 119.2526 53.6344 43.1171 176.5398 62 L 3.9744 8.4272 126.3127 58.4102 42.2378 179.5632 63 S 4.2036 8.0690 113.7149 61.4020 62.9123 175.8712 64 N 4.3138 8.1146 120.1865 56.3000 38.8305 176.3451 65 L 3.9860 8.2075 122.0297 58.5727 42.3441 178.4577 66 Y 4.0846 8.2708 119.3053 60.5403 38.6616 177.8584 67 R 3.9219 8.0207 119.5477 59.2004 30.1180 178.6785 68 K 4.0133 8.2423 118.4621 59.2485 32.0416 179.3588 69 I 3.6493 7.8192 120.1793 64.2562 37.1573 178.6080 70 K 3.7999 7.5246 118.6100 59.5829 31.7139 179.3104 71 S 4.1045 7.8617 111.8426 60.9877 62.3699 175.2752 72 L 4.3677 8.0577 118.7407 53.5584 42.1341 175.9339 73 N 4.1098 7.7560 114.9882 54.2519 36.3059 174.8652 74 I 3.9713 7.7128 119.4612 60.2633 37.3823 176.7770 75 R 4.0617 8.4909 125.4345 56.5339 29.3853 177.3260 76 V 3.9713 7.9698 115.5965 61.5523 32.7077 175.4877 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 17 R 8.25 4.25 0.00 1.85 1.81 0.00 3.23 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 1.45 1.20 0.00 18 D 8.81 4.45 0.00 2.77 2.74 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 19 L 8.26 4.35 0.00 1.70 1.52 0.97 0.75 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 20 S 8.37 4.26 0.00 4.07 4.17 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 21 Y 7.88 4.26 0.00 3.27 3.29 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 22 L 7.01 3.95 0.00 1.60 1.67 0.92 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 23 L 7.50 4.00 0.00 1.72 1.69 0.89 0.99 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 24 K 7.69 4.29 0.00 1.96 1.89 0.00 1.78 0.00 0.00 1.75 0.00 0.00 3.08 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.47 1.66 7.81 25 I 6.75 3.94 2.03 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.77 1.01 0.00 0.00 26 K 8.81 4.06 0.00 1.73 1.84 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.46 7.81 27 E 7.79 4.60 0.00 2.05 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 0.00 2.34 2.35 0.00 28 L 8.32 3.94 0.00 1.74 1.65 0.89 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 29 K 7.98 3.99 0.00 1.81 1.85 0.00 1.75 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.53 1.48 7.81 30 E 8.15 3.98 0.00 2.20 2.03 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 2.42 2.39 0.00 31 A 8.25 4.08 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 32 K 8.32 4.01 0.00 1.98 1.91 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.66 7.81 33 K 8.04 4.03 0.00 1.88 1.89 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.72 7.81 34 E 8.43 4.07 0.00 2.25 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 2.41 2.58 0.00 35 F 8.46 4.14 0.00 3.13 3.21 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 0.00 36 E 8.61 3.74 0.00 2.19 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 0.00 2.34 2.36 0.00 37 K 8.04 3.94 0.00 1.90 1.98 0.00 1.80 0.00 0.00 1.73 0.00 0.00 3.12 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.45 7.81 38 I 7.51 3.99 1.88 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 1.45 0.77 1.06 0.00 0.00 39 F 7.96 3.85 0.00 2.27 2.86 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 0.00 0.00 0.00 40 I 7.86 3.62 1.95 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.71 0.92 0.00 0.00 41 E 8.18 3.90 0.00 1.98 1.99 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 2.36 2.47 0.00 42 E 8.04 3.76 0.00 1.95 2.05 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 2.02 2.05 0.00 43 K 7.79 3.63 0.00 1.71 1.82 0.00 1.65 0.00 0.00 1.25 0.00 0.00 2.20 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.64 1.02 7.81 44 L 7.89 3.77 0.00 1.58 1.09 0.99 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 45 R 7.38 3.22 0.00 1.72 1.86 0.00 3.07 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.59 0.00 46 E 7.79 3.74 0.00 1.70 1.44 0.00 0.00 0.00 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 1.99 0.00 47 Y 7.55 4.73 0.00 3.00 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 48 D 8.20 4.32 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 Y 8.18 3.46 0.00 3.11 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 50 D 8.02 4.63 0.00 2.78 2.75 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 0.00 0.00 0.00 51 L 8.41 4.02 0.00 1.83 1.76 1.09 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 52 K 8.14 3.87 0.00 1.80 1.93 0.00 1.70 0.00 0.00 1.85 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.60 1.49 7.81 53 R 8.52 3.84 0.00 1.91 2.22 0.00 2.80 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.25 0.00 54 T 8.09 3.64 4.38 0.00 0.00 0.00 0.00 0.00 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 55 A 8.07 3.97 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 7.85 3.90 0.00 2.05 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 2.29 2.37 0.00 57 E 8.16 3.93 0.00 1.72 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.47 0.00 58 I 7.62 4.34 2.14 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.65 1.08 0.00 0.00 59 G 7.87 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 60 I 7.46 4.69 1.90 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.81 0.95 0.00 0.00 61 D 8.29 4.56 0.00 2.78 2.59 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 0.00 0.00 0.00 0.00 62 L 8.43 3.97 0.00 1.80 1.65 0.95 0.81 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 63 S 8.07 4.20 0.00 4.12 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 64 N 8.11 4.31 0.00 2.88 3.04 0.00 0.00 6.85 6.66 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 65 L 8.21 3.99 0.00 1.84 1.91 0.97 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 66 Y 8.27 4.08 0.00 3.12 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 R 8.02 3.92 0.00 2.10 2.12 0.00 3.16 0.00 0.00 3.20 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 68 K 8.24 4.01 0.00 2.03 1.85 0.00 1.76 0.00 0.00 1.88 0.00 0.00 3.16 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.62 7.81 69 I 7.82 3.65 1.81 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.01 0.84 0.00 0.00 70 K 7.52 3.80 0.00 1.67 1.75 0.00 1.61 0.00 0.00 1.51 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.16 1.01 7.81 71 S 7.86 4.10 0.00 3.87 3.96 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 72 L 8.06 4.37 0.00 1.69 1.68 0.93 0.93 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 73 N 7.76 4.11 0.00 2.91 2.90 0.00 0.00 6.94 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 I 7.71 3.97 1.87 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 1.30 0.48 0.95 0.00 0.00 75 R 8.49 4.06 0.00 1.80 1.90 0.00 3.16 0.00 0.00 3.21 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 76 V 7.97 3.97 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 0.85 0.00 0.00 0.99 0.00 0.00