NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 L 4.3738 8.0433 122.7573 54.9728 43.6449 175.1326 2 K 4.9080 8.5038 125.7190 54.4615 35.9081 174.6684 3 C 5.4210 9.6556 121.1441 55.0641 44.4635 172.9297 4 N 5.0473 9.0320 117.6489 53.5713 39.5457 176.0831 5 K 4.7192 7.9929 120.7280 54.9051 34.7442 175.7036 6 L 3.8150 8.6054 120.6642 58.5806 41.9472 178.2241 7 V 4.0645 7.5146 120.5167 60.7117 31.3469 174.2424 8 P 4.3270 0.0000 0.0000 63.8648 30.7817 176.9747 9 I 4.1569 7.6739 117.8429 61.2773 38.6841 175.2196 10 A 4.7460 7.4708 120.8172 51.4703 22.3437 174.6909 11 Y 5.1661 7.9426 118.9853 55.3711 41.7277 174.5840 12 K 4.7947 8.7289 118.5398 55.3550 37.0572 175.2948 13 T 4.6034 8.4702 116.6981 63.5897 69.5023 175.8623 14 C 4.6625 8.5618 123.2580 55.8556 35.5646 172.1780 15 P 4.3896 0.0000 0.0000 62.5055 31.2721 175.2059 16 E 4.1916 8.4199 118.4115 57.8145 29.7803 177.4212 17 G 3.9940 9.0909 111.4716 44.8239 0.0000 173.1887 18 K 4.4803 7.6070 118.0417 54.9907 32.8671 175.3004 19 N 4.8385 8.7442 121.4293 53.0804 40.2297 173.9935 20 L 4.7986 7.6908 117.3435 54.3300 44.4274 174.6946 21 C 5.5539 9.4553 119.4536 55.6447 39.1463 172.5687 22 Y 5.7045 9.0865 120.0668 55.3962 41.8326 174.3493 23 K 4.5060 9.6246 120.0436 55.8952 36.2049 174.6988 24 M 5.1362 8.4804 124.1624 53.4086 35.3047 174.8877 25 F 4.9835 9.1342 120.1583 55.9390 43.0618 174.6769 26 M 4.5407 8.7604 122.6127 55.2712 32.3562 176.4655 27 M 3.9294 8.5227 120.9800 60.2083 32.5116 178.5807 28 S 4.1210 8.5074 111.8814 59.8851 61.9950 175.7524 29 D 4.6956 6.0500 118.7736 53.7829 39.5858 175.6608 30 L 4.4473 7.8133 120.5427 56.3217 42.3940 178.3478 31 T 4.1956 7.7838 114.3278 64.6408 68.9591 174.6128 32 I 4.4787 7.4024 121.1676 58.5457 39.6314 173.4397 33 P 4.1073 0.0000 0.0000 62.8468 31.7375 176.0512 34 V 4.3064 8.0708 117.8504 62.2741 33.6087 176.4451 35 K 4.6159 7.3730 118.4480 54.6543 36.7445 176.3116 36 R 4.0877 8.0996 122.4448 55.8471 33.2208 174.0492 37 G 4.0358 6.9489 114.4638 46.2983 0.0000 170.6881 38 C 5.8918 9.3408 119.3524 55.6472 38.8815 172.9066 39 I 4.5211 9.2323 120.8754 60.6724 41.4991 174.9065 40 D 4.4734 8.7785 122.0327 54.5677 40.3747 176.7775 41 V 4.2914 7.2669 118.2537 59.9832 33.6294 175.3504 42 C 4.4809 8.5406 125.4247 55.5279 43.7030 171.7758 43 P 4.4373 0.0000 0.0000 61.8647 31.6889 176.4294 44 K 3.9927 8.0211 120.8912 56.4133 32.5800 176.9716 45 N 4.6923 8.3914 120.9118 52.5700 39.9900 174.0812 46 S 4.8519 8.6038 114.5577 56.4609 65.9371 174.4385 47 L 4.4417 8.4532 117.7899 55.4452 41.8213 177.2367 48 L 4.6499 7.8549 118.2192 55.9862 43.7769 176.8667 49 V 4.9449 7.9900 110.7580 59.3183 36.0561 174.2863 50 K 5.0525 9.2054 124.7860 55.0939 34.4500 174.3668 51 Y 5.2468 9.0312 124.3901 56.5081 40.1058 175.4152 52 V 4.6147 9.3276 122.8494 61.5602 35.0239 173.8152 53 C 5.6752 8.8628 124.4888 55.9974 41.3770 171.8677 54 C 5.0682 9.4365 113.7354 54.7320 44.6854 174.1323 55 N 4.7937 8.9518 118.3679 52.7804 37.5062 174.6447 56 T 4.4137 7.4484 108.9086 60.6233 70.6564 173.9193 57 D 4.6859 8.3126 121.7085 54.2790 41.8586 176.1832 58 R 3.8006 8.4650 117.1896 56.2794 28.4794 175.9880 59 C 4.4267 8.3633 113.3955 57.4235 43.0652 173.0945 60 N 4.5087 7.9453 122.4460 52.2663 37.1249 174.1976 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 L 8.04 4.37 0.00 1.79 1.66 1.01 0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 2 K 8.50 4.91 0.00 1.82 1.92 0.00 1.59 0.00 0.00 1.84 0.00 0.00 3.12 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.51 1.65 7.81 3 C 9.66 5.42 0.00 2.84 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 N 9.03 5.05 0.00 2.72 2.78 0.00 0.00 7.51 8.31 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 5 K 7.99 4.72 0.00 1.77 1.77 0.00 1.77 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.51 7.81 6 L 8.61 3.81 0.00 1.56 1.70 0.87 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 7 V 7.51 4.06 2.06 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 0.90 0.00 0.00 0.91 0.00 0.00 8 P 0.00 4.33 0.00 2.08 2.07 0.00 3.70 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 2.01 2.04 0.00 9 I 7.67 4.16 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.66 0.90 0.00 0.00 10 A 7.47 4.75 1.13 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 0.00 0.00 11 Y 7.94 5.17 0.00 3.03 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 12 K 8.73 4.79 0.00 1.72 1.75 0.00 1.64 0.00 0.00 1.64 0.00 0.00 2.78 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.28 1.37 7.81 13 T 8.47 4.60 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 1.24 0.00 0.00 14 C 8.56 4.66 0.00 2.94 3.19 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 15 P 0.00 4.39 0.00 2.23 2.25 0.00 3.76 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.07 0.00 16 E 8.42 4.19 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 2.33 2.26 0.00 17 G 9.09 3.99 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 0.00 0.00 0.00 18 K 7.61 4.48 0.00 1.79 1.93 0.00 1.68 0.00 0.00 1.76 0.00 0.00 2.73 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.39 1.33 7.81 19 N 8.74 4.84 0.00 2.64 2.80 0.00 0.00 7.19 7.79 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 20 L 7.69 4.80 0.00 1.93 1.61 1.03 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 21 C 9.46 5.55 0.00 3.08 3.13 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 22 Y 9.09 5.70 0.00 3.03 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 23 K 9.62 4.51 0.00 1.35 1.70 0.00 1.30 0.00 0.00 1.72 0.00 0.00 2.95 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.73 1.88 7.81 24 M 8.48 5.14 0.00 1.38 1.67 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 1.54 0.00 25 F 9.13 4.98 0.00 2.83 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 26 M 8.76 4.54 0.00 1.91 2.00 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 2.57 2.56 0.00 27 M 8.52 3.93 0.00 1.94 2.17 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.78 0.00 28 S 8.51 4.12 0.00 3.84 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 29 D 6.05 4.70 0.00 2.84 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.81 4.45 0.00 1.69 1.70 0.98 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 31 T 7.78 4.20 4.26 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 1.23 0.00 0.00 32 I 7.40 4.48 2.02 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.90 0.91 0.00 0.00 33 P 0.00 4.11 0.00 1.77 1.40 0.00 3.61 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.14 0.00 34 V 8.07 4.31 2.01 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 0.55 0.00 0.00 0.88 0.00 0.00 35 K 7.37 4.62 0.00 1.56 1.71 0.00 1.71 0.00 0.00 1.78 0.00 0.00 2.83 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.31 1.36 7.81 36 R 8.10 4.09 0.00 1.44 1.61 0.00 3.10 0.00 0.00 3.04 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.29 0.00 37 G 6.95 4.04 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 0.00 0.00 0.00 38 C 9.34 5.89 0.00 2.92 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 39 I 9.23 4.52 1.50 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.15 0.97 0.00 0.00 40 D 8.78 4.47 0.00 2.81 2.93 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 41 V 7.27 4.29 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 0.75 0.00 0.00 0.91 0.00 0.00 42 C 8.54 4.48 0.00 2.99 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 43 P 0.00 4.44 0.00 1.83 1.80 0.00 3.84 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.12 0.00 44 K 8.02 3.99 0.00 1.57 1.64 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.91 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.34 1.36 7.81 45 N 8.39 4.69 0.00 2.77 2.93 0.00 0.00 6.85 7.60 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 46 S 8.60 4.85 0.00 4.05 4.03 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 47 L 8.45 4.44 0.00 1.69 1.76 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 48 L 7.85 4.65 0.00 1.73 1.71 0.97 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 49 V 7.99 4.94 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 0.81 0.00 0.00 50 K 9.21 5.05 0.00 1.84 1.70 0.00 1.63 0.00 0.00 1.63 0.00 0.00 2.82 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.39 1.51 7.81 51 Y 9.03 5.25 0.00 3.12 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 52 V 9.33 4.61 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.95 0.00 0.00 53 C 8.86 5.68 0.00 2.95 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 54 C 9.44 5.07 0.00 2.93 3.16 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 55 N 8.95 4.79 0.00 2.84 2.95 0.00 0.00 6.09 7.72 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 56 T 7.45 4.41 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 1.21 0.00 0.00 57 D 8.31 4.69 0.00 2.58 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 58 R 8.46 3.80 0.00 1.70 1.85 0.00 2.45 0.00 0.00 2.86 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.99 0.00 59 C 8.36 4.43 0.00 3.08 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 60 N 7.95 4.51 0.00 2.67 2.84 0.00 0.00 5.99 7.50 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