NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 79 A 4.3232 8.1233 123.5819 51.9946 20.1473 178.3829 80 M 3.7900 8.9015 122.0062 56.4116 32.5491 176.0963 81 S 4.4312 8.7436 115.8153 60.7483 62.9189 175.6836 82 K 4.0863 7.8052 119.3701 58.2602 31.7938 178.1103 83 L 4.5135 7.6281 117.5581 54.0015 42.0547 177.2605 84 G 3.9121 8.2462 107.8662 45.1870 0.0000 173.6454 85 L 4.5377 7.9258 121.2611 54.2536 42.9502 175.9379 86 R 4.7721 8.8574 124.1299 54.1867 32.1006 175.8163 87 Q 3.6463 8.7614 125.9481 56.1303 30.0814 175.8856 88 V 3.9413 9.0805 128.3817 62.2864 32.2894 175.4314 89 T 3.7386 8.3962 119.5276 62.9557 69.0378 174.7312 90 G 3.8236 8.8937 113.1516 45.4948 0.0000 173.1447 91 V 3.7288 7.2912 119.1539 62.9354 31.5116 175.7358 92 T 4.5820 8.1920 116.2674 61.5827 70.1438 174.1896 93 R 4.7047 7.5299 120.1076 55.5683 33.2933 173.7409 94 V 4.6199 8.8157 126.0882 61.2136 34.6086 174.1653 95 T 5.2161 8.6090 116.8684 59.9731 71.9270 173.3795 96 I 4.5133 8.9046 124.1804 59.7695 40.7385 174.2490 97 R 4.8072 8.6320 128.3890 55.0228 30.4803 175.8587 98 K 4.1563 8.9243 128.8718 58.8098 31.9083 176.3268 99 S 4.6893 7.2516 108.5838 58.4219 65.9103 174.2627 100 K 4.6807 7.6844 120.5731 55.3517 37.5664 176.5988 101 N 4.9072 8.1414 114.4768 53.2577 42.2841 174.1510 102 I 4.4387 7.6075 119.6267 59.9153 39.8063 174.3121 103 L 5.0370 8.5934 131.0847 53.2862 44.9737 175.0162 104 F 4.9780 9.2590 126.1514 56.8006 40.8044 175.0096 105 V 4.7714 9.0101 122.8543 61.2088 34.8165 174.1102 106 I 5.0569 9.2819 129.4800 59.2830 38.3011 176.3819 107 T 4.2040 8.6670 117.4339 62.4942 69.9675 174.8936 108 K 4.7680 7.5828 122.4149 54.2695 30.8209 173.4449 109 P 4.9382 0.0000 0.0000 62.2331 33.8255 176.9475 110 D 4.7707 9.2820 120.4300 52.8149 44.1274 174.1488 111 V 5.0644 8.2981 126.1090 61.3224 34.4015 173.7028 112 Y 5.1614 9.3377 125.0926 56.0603 41.6557 174.2680 113 K 4.5871 8.9776 124.9481 54.4811 35.2545 175.7778 114 S 4.6523 8.2698 121.7672 56.4325 61.9579 172.9833 115 P 4.3300 0.0000 0.0000 65.0461 31.2489 177.2916 116 A 4.4021 7.7760 118.8160 52.4311 19.5199 176.2918 117 S 4.6148 8.2320 109.9430 56.9925 65.0695 173.0087 118 D 5.0455 8.6125 116.9677 53.7743 39.9466 175.4814 119 T 4.8385 7.1907 112.6718 63.1246 71.7480 173.3168 120 Y 5.0357 8.7359 121.7493 56.2669 41.3378 174.8292 121 I 4.3151 9.1885 124.4649 59.4640 39.8430 174.6964 122 V 4.6343 8.1553 126.7761 61.2757 33.0488 174.5074 123 F 4.7935 10.3876 128.2016 55.6208 40.6813 175.1816 124 G 4.5850 8.7766 110.4889 43.5330 0.0000 172.4747 125 E 4.0521 8.3954 121.5122 56.1086 30.0916 176.0930 126 A 5.0000 8.4657 125.6260 50.7390 20.5869 176.2029 127 K 4.7557 9.1952 119.8510 55.1562 36.4935 174.7816 128 I 4.5912 8.2704 121.3900 59.7968 38.6958 175.0494 129 E 4.7153 9.2862 126.6029 54.5024 32.8090 174.2774 130 D 5.0679 8.4658 121.7961 51.9170 42.9156 176.8127 131 L 4.6193 8.8159 130.9972 53.6997 40.0289 177.1633 132 S 4.1461 7.7088 116.5298 58.6381 63.1330 174.2376 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 79 A 8.12 4.32 1.21 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 0.00 0.00 80 M 8.90 3.79 0.00 1.78 2.11 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 2.33 0.00 81 S 8.74 4.43 0.00 3.94 3.88 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 0.00 0.00 0.00 82 K 7.81 4.09 0.00 1.97 1.85 0.00 1.74 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.48 7.81 83 L 7.63 4.51 0.00 1.74 1.67 0.88 0.91 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 84 G 8.25 3.91 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 0.00 0.00 0.00 85 L 7.93 4.54 0.00 1.83 1.76 0.88 0.69 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 86 R 8.86 4.77 0.00 1.72 1.85 0.00 3.32 0.00 0.00 3.11 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.70 0.00 87 Q 8.76 3.65 0.00 1.83 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 7.10 0.00 0.00 0.00 0.00 0.00 2.06 1.58 0.00 88 V 9.08 3.94 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 0.95 0.00 0.00 1.05 0.00 0.00 89 T 8.40 3.74 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 1.24 0.00 0.00 90 G 8.89 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 91 V 7.29 3.73 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 0.81 0.00 0.00 0.93 0.00 0.00 92 T 8.19 4.58 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 1.24 0.00 0.00 93 R 7.53 4.70 0.00 1.80 1.79 0.00 3.18 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.60 0.00 94 V 8.82 4.62 2.09 0.00 0.00 0.00 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 0.93 0.00 0.00 95 T 8.61 5.22 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 1.22 0.00 0.00 96 I 8.90 4.51 2.04 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.77 0.98 0.00 0.00 97 R 8.63 4.81 0.00 1.82 1.84 0.00 3.22 0.00 0.00 3.14 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.76 0.00 98 K 8.92 4.16 0.00 1.93 1.85 0.00 1.85 0.00 0.00 1.80 0.00 0.00 3.12 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.54 1.67 7.81 99 S 7.25 4.69 0.00 3.97 3.78 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 0.00 100 K 7.68 4.68 0.00 1.70 1.81 0.00 1.70 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.34 1.40 7.81 101 N 8.14 4.91 0.00 2.60 2.75 0.00 0.00 6.77 7.32 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 0.00 102 I 7.61 4.44 1.76 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 1.41 0.81 0.00 0.00 103 L 8.59 5.04 0.00 1.69 1.39 0.97 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 104 F 9.26 4.98 0.00 3.08 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 V 9.01 4.77 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 1.06 0.00 0.00 0.94 0.00 0.00 106 I 9.28 5.06 1.90 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 1.02 1.02 0.00 0.00 107 T 8.67 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 0.00 108 K 7.58 4.77 0.00 1.75 1.74 0.00 1.79 0.00 0.00 1.77 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.33 1.42 7.81 109 P 0.00 4.94 0.00 2.15 2.06 0.00 3.83 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 1.92 0.00 110 D 9.28 4.77 0.00 2.91 2.88 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 0.00 0.00 0.00 111 V 8.30 5.06 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 1.09 0.00 0.00 0.96 0.00 0.00 112 Y 9.34 5.16 0.00 3.02 2.88 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 0.00 0.00 0.00 113 K 8.98 4.59 0.00 1.35 1.47 0.00 1.15 0.00 0.00 0.61 0.00 0.00 2.73 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.07 1.27 7.81 114 S 8.27 4.65 0.00 4.01 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 0.00 115 P 0.00 4.33 0.00 2.04 2.15 0.00 3.84 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 116 A 7.78 4.40 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 0.00 117 S 8.23 4.61 0.00 3.69 3.69 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 0.00 118 D 8.61 5.05 0.00 2.86 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 0.00 119 T 7.19 4.84 4.21 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 1.21 0.00 0.00 120 Y 8.74 5.04 0.00 2.74 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 0.00 121 I 9.19 4.32 1.77 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.77 0.02 0.00 0.00 122 V 8.16 4.63 2.02 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 0.83 0.00 0.00 0.93 0.00 0.00 123 F 10.39 4.79 0.00 3.29 2.95 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 0.00 124 G 8.78 4.59 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 0.00 0.00 0.00 125 E 8.40 4.05 0.00 2.08 1.93 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 2.43 2.34 0.00 126 A 8.47 5.00 1.29 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 0.00 0.00 127 K 9.20 4.76 0.00 1.79 1.92 0.00 1.30 0.00 0.00 1.67 0.00 0.00 2.83 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.52 1.39 7.81 128 I 8.27 4.59 1.80 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.70 0.60 0.00 0.00 129 E 9.29 4.72 0.00 1.91 1.77 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 0.00 2.20 2.19 0.00 130 D 8.47 5.07 0.00 2.61 2.50 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 0.00 0.00 0.00 0.00 131 L 8.82 4.62 0.00 1.51 1.61 0.90 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 132 S 7.71 4.15 0.00 3.96 3.74 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