NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 28 S 4.4173 8.1933 115.2898 58.2326 63.7963 173.1710 29 N 4.7780 8.3574 118.8599 53.3586 37.7957 176.2368 30 R 4.0936 8.0388 120.1593 58.3562 29.9035 177.7006 31 R 4.1193 7.8445 117.3325 58.1202 30.5864 177.7739 32 L 4.1030 8.0467 120.9315 57.4861 42.8357 178.0870 33 Q 3.9922 7.8347 117.6436 59.1257 28.5539 179.2708 34 Q 4.0649 7.9901 118.0740 59.4394 29.0172 178.3708 35 T 4.4412 7.3428 119.3320 65.6423 68.2913 176.3946 36 Q 3.8888 8.3563 121.8550 59.1780 29.1624 177.6965 37 A 3.9859 7.9618 121.8465 55.6490 18.3657 179.3927 38 Q 3.9565 8.5181 115.7866 59.5699 28.3729 179.3120 39 V 3.5612 7.8935 119.8572 65.9044 31.6152 177.5609 40 D 4.3600 8.3323 119.0161 57.4243 40.5534 178.6228 41 E 3.8976 8.1942 119.5827 59.4002 29.7153 179.0527 42 V 3.5750 7.7477 118.1965 65.9336 31.3968 178.1344 43 V 3.6328 7.9331 118.2583 65.9512 31.3344 177.8299 44 D 4.3349 8.0920 118.6520 57.3612 40.6041 178.7271 45 I 3.6850 8.0420 120.6206 64.6621 37.0410 178.4849 46 M 4.0098 8.4770 119.7880 58.3319 31.7077 178.4215 47 R 3.9137 8.2198 119.3560 59.7719 30.0863 178.5676 48 V 3.5884 7.7602 117.5257 65.9811 31.4904 177.5301 49 N 4.2710 8.2975 116.5322 56.5889 38.5800 177.3198 50 V 3.6168 8.6237 120.2332 66.3821 31.4035 177.1615 51 D 4.3006 7.8312 117.9492 57.0903 41.0789 177.9924 52 K 3.8500 8.4234 118.8692 59.7928 32.1121 179.4981 53 V 3.5912 8.2148 118.5831 66.0585 31.5935 178.2003 54 L 4.0420 7.8454 118.1558 57.3972 41.3597 179.2567 55 E 3.9001 8.1280 119.7060 59.3114 29.6490 178.8021 56 R 3.9249 8.3465 119.1371 59.1921 30.0119 178.0041 57 D 4.2816 8.3709 118.5612 57.3580 41.1810 177.6713 58 Q 3.8995 7.9662 119.7870 59.2535 29.0403 178.2119 59 K 3.8793 8.1989 119.1358 59.7448 32.1970 179.2946 60 L 4.0220 8.3651 119.3818 57.9086 41.3675 179.6016 61 S 4.1775 8.0633 113.1456 61.1766 62.2554 175.8140 62 E 3.9305 8.5163 122.7206 58.9311 29.2552 178.4936 63 L 4.0263 8.3051 121.0215 57.8620 42.0935 178.2047 64 D 4.1270 8.6687 118.3608 57.2077 40.9317 178.1771 65 D 4.3598 7.8570 119.5208 57.2799 41.0057 178.8535 66 R 3.8924 7.7999 117.9378 59.1958 30.0779 178.9033 67 A 3.9787 8.7712 121.1762 55.3003 18.3772 179.2454 68 D 4.2629 7.9678 116.4266 57.3897 41.3248 178.3368 69 A 4.0247 8.3022 121.7547 54.8224 18.3031 179.4173 70 L 3.8719 8.5777 119.3373 58.4709 42.1752 179.0838 71 Q 4.0092 8.2610 119.2705 58.8844 29.0325 178.0748 72 A 4.0715 8.1468 122.1681 55.1536 18.4840 179.9145 73 G 3.5675 8.6568 104.5259 47.7289 0.0000 175.8238 74 A 4.1180 8.7285 123.5115 55.1024 18.4470 179.5785 75 S 4.0526 8.3240 111.8469 61.7181 62.5531 176.2474 76 Q 4.0290 8.1530 121.8601 58.7593 28.7610 177.9072 77 F 4.4329 8.2433 122.1702 61.0783 39.4279 176.4442 78 E 3.5760 8.4797 119.4359 59.8187 29.3906 178.8607 79 T 3.8487 7.9322 115.3745 66.9619 68.4478 176.7673 80 S 4.1167 7.9591 116.2947 61.2838 62.8722 176.3620 81 A 3.8337 8.1681 123.6529 55.2371 18.1013 179.4076 82 A 3.9058 8.2089 119.4692 55.3408 18.3439 179.9520 83 K 3.9104 7.9912 116.8208 59.4094 32.1220 179.2823 84 L 4.0132 8.0757 120.5973 58.0740 42.0898 178.5850 85 K 3.9605 8.6350 119.9122 59.8822 32.0922 178.4129 86 R 4.1074 8.6282 118.9597 59.3116 29.9549 178.3089 87 K 3.9528 8.4955 119.7389 60.0070 32.2367 178.5011 88 Y 4.0746 8.2654 116.5567 60.2069 37.7417 177.9511 89 W 4.2613 8.6664 130.0642 60.1689 30.7386 177.8425 90 W 3.4526 8.5201 128.4011 59.9243 30.1344 178.2395 91 K 3.6831 8.1589 118.4716 59.3607 31.3214 178.4387 92 N 4.1144 8.0779 116.2103 56.9136 38.7230 176.0369 93 L 3.7577 7.4616 121.2615 58.0610 41.8029 179.0321 94 K 3.6634 7.2697 116.9048 58.4176 31.9128 178.1381 95 M 4.3263 7.1791 117.5413 55.3159 32.0985 176.0017 96 M 4.1176 7.3671 124.8266 55.4988 32.2905 175.9801 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 28 S 8.19 4.42 0.00 3.87 3.80 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 29 N 8.36 4.78 0.00 2.87 2.79 0.00 0.00 6.82 6.78 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 30 R 8.04 4.09 0.00 1.80 1.85 0.00 3.31 0.00 0.00 3.17 8.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.81 0.00 31 R 7.84 4.12 0.00 1.85 1.99 0.00 3.11 0.00 0.00 3.26 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.71 0.00 32 L 8.05 4.10 0.00 1.69 1.83 0.92 1.05 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 33 Q 7.83 3.99 0.00 2.26 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.60 0.00 0.00 0.00 0.00 0.00 2.38 2.77 0.00 34 Q 7.99 4.06 0.00 2.28 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.90 0.00 0.00 0.00 0.00 0.00 2.50 2.44 0.00 35 T 7.34 4.44 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 1.21 0.00 0.00 36 Q 8.36 3.89 0.00 2.14 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.71 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 37 A 7.96 3.99 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 38 Q 8.52 3.96 0.00 2.26 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.55 2.36 0.00 39 V 7.89 3.56 2.29 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 1.10 0.00 0.00 1.02 0.00 0.00 40 D 8.33 4.36 0.00 2.87 2.71 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.19 3.90 0.00 2.04 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 0.00 2.30 2.31 0.00 42 V 7.75 3.58 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 0.93 0.00 0.00 0.99 0.00 0.00 43 V 7.93 3.63 2.30 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 1.06 0.00 0.00 0.99 0.00 0.00 44 D 8.09 4.33 0.00 2.90 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 I 8.04 3.68 2.01 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 1.52 0.91 0.91 0.00 0.00 46 M 8.48 4.01 0.00 1.98 2.17 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.81 0.00 47 R 8.22 3.91 0.00 2.10 1.95 0.00 3.09 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 48 V 7.76 3.59 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 0.98 0.00 0.00 0.95 0.00 0.00 49 N 8.30 4.27 0.00 2.98 2.86 0.00 0.00 6.67 8.51 0.00 0.00 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 V 8.62 3.62 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.98 0.00 0.00 51 D 7.83 4.30 0.00 2.84 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 52 K 8.42 3.85 0.00 1.98 1.87 0.00 1.72 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.67 7.81 53 V 8.21 3.59 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 1.11 0.00 0.00 0.99 0.00 0.00 54 L 7.85 4.04 0.00 1.90 1.70 0.92 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 55 E 8.13 3.90 0.00 2.05 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 2.30 2.31 0.00 56 R 8.35 3.92 0.00 1.99 2.04 0.00 3.15 0.00 0.00 3.09 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.64 0.00 57 D 8.37 4.28 0.00 2.92 2.83 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.97 3.90 0.00 2.19 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.52 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 59 K 8.20 3.88 0.00 1.85 1.86 0.00 1.72 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.46 1.76 7.81 60 L 8.37 4.02 0.00 1.85 1.72 0.92 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 61 S 8.06 4.18 0.00 4.02 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 62 E 8.52 3.93 0.00 2.16 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 2.30 2.31 0.00 63 L 8.31 4.03 0.00 1.87 1.81 0.92 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 64 D 8.67 4.13 0.00 2.90 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 65 D 7.86 4.36 0.00 2.84 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 R 7.80 3.89 0.00 1.95 1.98 0.00 3.13 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 67 A 8.77 3.98 1.32 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 68 D 7.97 4.26 0.00 2.90 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 69 A 8.30 4.02 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 70 L 8.58 3.87 0.00 1.87 1.90 0.93 0.79 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 71 Q 8.26 4.01 0.00 2.15 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.37 2.53 0.00 72 A 8.15 4.07 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 73 G 8.66 3.57 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 0.00 0.00 0.00 74 A 8.73 4.12 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 75 S 8.32 4.05 0.00 3.96 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 76 Q 8.15 4.03 0.00 2.28 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.59 0.00 0.00 0.00 0.00 0.00 2.39 2.47 0.00 77 F 8.24 4.43 0.00 3.14 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 78 E 8.48 3.58 0.00 2.10 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 0.00 2.21 2.46 0.00 79 T 7.93 3.85 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 1.20 0.00 0.00 80 S 7.96 4.12 0.00 4.11 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 81 A 8.17 3.83 0.93 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 0.00 0.00 82 A 8.21 3.91 1.30 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 83 K 7.99 3.91 0.00 2.00 1.88 0.00 1.68 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.74 1.60 7.81 84 L 8.08 4.01 0.00 2.11 1.80 1.10 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 85 K 8.64 3.96 0.00 1.84 2.00 0.00 1.65 0.00 0.00 1.55 0.00 0.00 2.85 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.49 1.53 7.81 86 R 8.63 4.11 0.00 1.97 2.18 0.00 3.12 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.90 0.00 87 K 8.50 3.95 0.00 1.88 1.90 0.00 1.57 0.00 0.00 1.31 0.00 0.00 2.59 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.86 1.32 7.81 88 Y 8.27 4.07 0.00 3.20 3.10 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 0.00 0.00 0.00 0.00 89 W 8.67 4.26 0.00 3.51 3.64 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 0.00 0.00 0.00 0.00 90 W 8.52 3.45 0.00 3.42 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 91 K 8.16 3.68 0.00 1.92 1.82 0.00 1.53 0.00 0.00 1.57 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.40 1.40 7.81 92 N 8.08 4.11 0.00 2.78 3.03 0.00 0.00 7.26 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 L 7.46 3.76 0.00 1.08 0.86 0.76 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 94 K 7.27 3.66 0.00 1.40 1.52 0.00 0.61 0.00 0.00 1.28 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 0.91 0.21 7.81 95 M 7.18 4.33 0.00 1.93 2.08 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.48 0.00 96 M 7.37 4.12 0.00 1.93 1.97 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.41 0.00