NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 T 4.7109 7.5974 116.7689 65.9352 69.2602 172.4563 5 G 4.1877 8.8731 118.1252 44.8974 0.0000 174.6347 6 K 4.4174 8.1379 124.3776 55.2654 33.3264 175.0762 7 E 4.1256 8.7583 117.2066 56.3913 30.6714 175.8656 8 L 5.1765 8.5138 123.3151 53.1623 44.9022 175.7548 9 V 4.9711 8.8322 114.9343 59.5479 36.0606 174.1188 10 L 4.9534 8.5457 125.2311 53.5015 44.5086 175.3839 11 V 4.2620 8.4147 126.6934 62.4358 31.9352 176.5688 12 L 3.8710 9.0565 129.4775 57.3068 41.9783 177.1037 13 Y 5.0394 7.4985 113.4310 55.8817 42.3659 175.0530 14 D 4.8464 9.0413 122.0154 53.7197 40.1945 174.8590 15 Y 4.8214 8.9837 125.5278 55.9190 41.3171 173.8176 16 Q 4.7326 7.2782 125.9100 53.5381 31.0735 174.8659 17 E 4.2069 8.4307 125.1464 57.0426 29.6853 177.2292 18 K 4.5225 9.1990 119.4129 56.0913 34.4173 175.8503 19 S 4.6637 7.5502 112.2337 55.8155 66.0523 172.8668 20 P 4.2488 0.0000 0.0000 65.5700 31.2462 178.1386 21 R 4.1285 7.5208 113.3826 57.6733 29.9472 176.2589 22 E 5.6319 7.4993 117.6882 55.2470 30.8855 175.2239 23 L 5.0231 8.5400 119.6318 53.5066 46.0354 175.9508 24 T 4.9417 8.5255 116.5593 61.9373 70.6443 174.0781 25 I 4.8307 8.8946 118.6702 58.9813 41.8379 173.8692 26 K 4.9791 7.9989 123.6766 54.0280 35.0313 175.1745 27 K 4.2777 8.7542 128.3523 57.9826 32.1069 176.4929 28 G 4.0848 8.6614 114.6689 45.3013 0.0000 173.2556 29 D 4.7704 8.0248 120.1235 53.4877 42.7595 175.6166 30 I 4.8564 8.2969 123.2646 60.0881 38.5796 174.8598 31 L 4.8496 8.7363 126.7446 53.0235 45.6437 175.3759 32 T 4.7581 7.8563 116.0725 62.7027 70.1743 174.1318 33 L 4.4541 8.8459 128.6829 54.2054 42.4824 175.8462 34 L 4.4298 8.9617 126.6794 56.3978 43.4194 177.0381 35 N 4.8342 7.5761 116.9947 52.0666 42.3436 174.9256 36 S 4.0723 8.2198 119.5944 57.8036 63.9139 175.1257 37 T 4.0098 8.6762 114.4391 65.0536 68.7424 174.7644 38 N 4.7282 8.1787 119.5617 53.0201 39.6994 174.9144 39 K 4.3453 8.8560 123.9955 58.8602 32.6686 177.5058 40 D 4.5743 8.3582 116.8701 53.8856 43.3872 176.3199 41 W 5.3399 8.6547 117.9188 54.5670 32.4137 174.9183 42 W 5.2753 9.1935 124.6051 54.7372 32.0090 174.6947 43 K 3.9548 8.8619 126.4880 55.8822 33.0144 176.0853 44 V 4.8643 8.3663 120.8676 58.6634 34.6621 173.5601 45 E 4.9004 8.4551 120.6771 55.2910 32.7979 174.8797 46 V 4.5617 8.0708 125.7494 61.9537 35.7273 174.4153 47 N 4.1675 9.4382 125.0378 54.3821 37.4092 174.7759 48 D 4.6042 9.3620 120.6090 56.2406 43.1109 176.6884 49 R 4.6979 7.6430 115.8934 54.3757 33.2482 174.1994 50 Q 4.9363 8.0840 117.6862 54.7232 30.9210 175.3797 51 G 4.1136 8.1783 108.2046 46.4581 0.0000 171.5914 52 F 5.4781 8.7213 118.9400 56.2282 40.8107 175.8045 53 I 5.3264 8.7770 115.4799 58.2896 41.7549 172.9681 54 P 3.6006 0.0000 0.0000 62.2627 31.5916 177.6713 55 A 2.9005 8.0623 126.4134 54.5936 18.2221 179.5271 56 A 3.8172 7.2699 117.4844 54.9842 18.8017 177.7628 57 Y 4.3396 8.0561 112.5110 58.7600 38.2925 174.7931 58 L 5.3449 7.4069 119.5215 52.6095 45.4759 175.7874 59 K 4.5974 8.7604 123.6618 54.1551 34.6423 175.0738 60 K 4.3431 9.0318 129.5714 56.8093 32.8193 176.2935 61 L 4.5096 8.5575 128.7588 53.4207 41.8550 176.5790 62 D 4.4974 8.3701 122.5129 54.1836 41.1010 176.8390 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 7.60 4.71 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 1.20 0.00 0.00 5 G 8.87 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 0.00 0.00 0.00 6 K 8.14 4.42 0.00 1.83 1.67 0.00 1.64 0.00 0.00 1.67 0.00 0.00 2.77 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.37 1.56 7.81 7 E 8.76 4.13 0.00 1.85 1.82 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 2.33 2.26 0.00 8 L 8.51 5.18 0.00 1.53 1.54 0.96 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 9 V 8.83 4.97 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 0.76 0.00 0.00 1.05 0.00 0.00 10 L 8.55 4.95 0.00 1.77 1.50 0.96 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 11 V 8.41 4.26 2.25 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 1.04 0.00 0.00 1.06 0.00 0.00 12 L 9.06 3.87 0.00 0.67 0.78 0.73 0.60 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 13 Y 7.50 5.04 0.00 2.85 2.79 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 14 D 9.04 4.85 0.00 2.85 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 15 Y 8.98 4.82 0.00 2.76 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 16 Q 7.28 4.73 0.00 1.89 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.68 0.00 0.00 0.00 0.00 0.00 2.11 2.20 0.00 17 E 8.43 4.21 0.00 2.04 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 2.26 2.28 0.00 18 K 9.20 4.52 0.00 1.78 1.85 0.00 1.92 0.00 0.00 1.94 0.00 0.00 3.13 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.33 1.54 7.81 19 S 7.55 4.66 0.00 3.86 3.85 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 0.00 0.00 0.00 0.00 20 P 0.00 4.25 0.00 2.01 2.15 0.00 3.60 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.06 0.00 21 R 7.52 4.13 0.00 1.86 2.02 0.00 2.21 0.00 0.00 2.54 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.37 0.00 22 E 7.50 5.63 0.00 2.07 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 2.71 2.00 0.00 23 L 8.54 5.02 0.00 1.59 1.62 0.96 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 24 T 8.53 4.94 4.25 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 1.29 0.00 0.00 25 I 8.89 4.83 1.97 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.93 0.99 0.00 0.00 26 K 8.00 4.98 0.00 1.98 1.95 0.00 1.67 0.00 0.00 1.60 0.00 0.00 2.83 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.36 1.38 7.81 27 K 8.75 4.28 0.00 1.89 1.77 0.00 1.86 0.00 0.00 1.74 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.54 7.81 28 G 8.66 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 29 D 8.02 4.77 0.00 2.70 2.60 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 0.00 30 I 8.30 4.86 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 1.35 0.82 0.91 0.00 0.00 31 L 8.74 4.85 0.00 1.58 1.77 0.97 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 32 T 7.86 4.76 4.23 0.00 0.00 0.00 0.00 0.00 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 33 L 8.85 4.45 0.00 1.51 1.57 0.93 0.58 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 34 L 8.96 4.43 0.00 1.52 1.63 0.93 0.92 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 35 N 7.58 4.83 0.00 2.69 2.54 0.00 0.00 6.70 7.63 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 36 S 8.22 4.07 0.00 2.72 2.66 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 0.00 0.00 0.00 0.00 37 T 8.68 4.01 4.30 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 1.21 0.00 0.00 38 N 8.18 4.73 0.00 2.97 3.41 0.00 0.00 7.00 6.68 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 39 K 8.86 4.35 0.00 1.85 1.89 0.00 1.82 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.54 1.55 7.81 40 D 8.36 4.57 0.00 2.62 2.36 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 41 W 8.65 5.34 0.00 3.47 3.58 0.00 0.00 0.00 0.00 0.00 0.00 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 W 9.19 5.28 0.00 3.23 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 43 K 8.86 3.95 0.00 0.79 1.40 0.00 1.55 0.00 0.00 1.57 0.00 0.00 2.84 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.18 0.93 7.81 44 V 8.37 4.86 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 0.97 0.00 0.00 1.04 0.00 0.00 45 E 8.46 4.90 0.00 1.97 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.30 0.00 46 V 8.07 4.56 2.11 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 0.89 0.00 0.00 0.97 0.00 0.00 47 N 9.44 4.17 0.00 2.91 2.64 0.00 0.00 7.07 8.06 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 48 D 9.36 4.60 0.00 2.67 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 49 R 7.64 4.70 0.00 1.82 1.83 0.00 3.28 0.00 0.00 3.36 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.56 0.00 50 Q 8.08 4.94 0.00 1.95 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.95 0.00 0.00 0.00 0.00 0.00 2.28 2.35 0.00 51 G 8.18 4.11 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 0.00 0.00 0.00 52 F 8.72 5.48 0.00 3.06 3.25 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 53 I 8.78 5.33 1.87 0.00 0.00 0.81 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 0.82 1.08 0.00 0.00 54 P 0.00 3.60 0.00 1.78 1.25 0.00 2.42 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.75 0.00 55 A 8.06 2.90 -0.31 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 0.00 0.00 0.00 56 A 7.27 3.82 1.12 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 0.00 0.00 57 Y 8.06 4.34 0.00 3.00 2.98 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 58 L 7.41 5.34 0.00 1.69 1.72 1.17 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 59 K 8.76 4.60 0.00 1.77 1.63 0.00 1.61 0.00 0.00 1.55 0.00 0.00 2.81 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.34 1.35 7.81 60 K 9.03 4.34 0.00 1.89 1.74 0.00 1.26 0.00 0.00 1.33 0.00 0.00 3.01 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.52 1.45 7.81 61 L 8.56 4.51 0.00 1.70 1.62 0.92 1.10 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 62 D 8.37 4.50 0.00 2.64 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 0.00 0.00 0.00 0.00