NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 48 T 4.3828 8.1749 117.3634 63.3407 69.9197 173.0529 49 F 4.2812 8.8018 124.6613 53.8379 40.0260 173.5454 50 P 4.3928 0.0000 0.0000 62.9836 32.7366 175.1025 51 T 5.0151 7.7881 109.0732 60.3101 71.5588 172.5013 52 Y 4.9354 9.1007 120.0022 55.6098 42.6599 174.7875 53 K 4.4017 8.8628 122.2513 57.1224 32.8380 177.2873 54 C 4.5783 8.7514 123.5066 55.7971 40.9512 171.7391 55 P 4.4464 0.0000 0.0000 62.4841 31.8606 177.6490 56 E 3.8517 8.6519 119.3281 59.8990 29.2912 179.8655 57 T 3.2995 7.6304 115.2208 66.3866 68.5351 176.5644 58 F 3.9473 7.9584 119.1274 60.6190 38.7829 177.0390 59 D 4.3636 8.1990 116.4024 57.1456 40.9929 178.0216 60 A 4.0027 7.7964 120.6073 54.3779 18.5311 178.7957 61 W 4.9739 7.7623 113.6213 56.9629 31.2302 176.8381 62 Y 4.3706 8.2757 119.7862 60.3115 38.4899 175.0370 63 C 4.6330 8.1540 115.7100 55.3266 41.2475 173.0073 64 L 4.5762 8.3833 123.7706 53.2286 44.0463 175.5081 65 N 3.7405 9.0429 113.5980 54.7339 35.5385 175.1104 66 D 4.3850 8.2354 112.5143 54.7228 38.5083 174.5107 67 A 4.3824 7.5066 120.8576 52.3604 19.4759 177.1949 68 H 4.9999 8.8591 116.3262 54.0800 31.5273 173.2428 69 C 5.2838 9.0077 123.7112 56.4196 45.6479 172.4695 70 F 5.4813 9.1997 119.7302 55.2551 41.5708 173.0255 71 A 5.2680 9.4333 122.4896 50.5022 21.8322 175.9879 72 V 4.9655 8.5079 113.3575 59.3746 36.2960 174.4663 73 K 4.9171 8.8248 122.9180 54.8080 34.4010 175.2071 74 I 4.3676 8.7239 128.6361 60.3532 39.3043 175.7775 75 A 3.9831 9.7659 130.5690 53.4540 15.8148 176.7270 76 D 4.5680 8.2156 116.4205 54.5171 39.0930 174.0349 77 L 4.6678 7.5526 122.4435 52.3760 44.3907 173.8381 78 P 4.6439 0.0000 0.0000 62.3992 32.3125 175.8274 79 V 3.8494 8.4205 124.2344 61.0953 34.1807 173.6327 80 Y 5.0414 7.7554 125.1934 56.7734 39.5983 175.0266 81 S 4.7778 8.5963 118.0176 57.2044 68.2502 171.9846 82 C 5.4390 8.6526 117.9507 55.2992 43.8189 173.5847 83 E 4.6146 9.6437 126.0750 55.2465 29.9321 174.7918 84 C 4.9907 8.8739 124.7080 56.3461 36.4608 174.0390 85 A 4.3427 8.6317 124.5598 51.8441 18.8054 177.2417 86 I 3.7507 8.2058 120.9764 63.2569 37.7199 176.9558 87 G 3.7667 9.3941 112.5232 44.9655 0.0000 172.6662 88 F 5.4064 7.5745 117.2209 55.8817 42.4802 173.9067 89 M 4.8277 9.6501 122.0768 54.5273 35.6212 173.6688 90 G 4.4679 9.2340 108.2136 43.8274 0.0000 174.6384 91 Q 3.9145 8.8621 120.5639 58.8676 28.9179 178.2012 92 R 4.1538 8.6095 114.5243 55.1239 30.4701 175.3404 93 C 4.5408 7.9861 114.1439 58.0781 38.2132 173.8960 94 E 3.9166 8.1317 116.7293 57.5210 30.7207 175.6849 95 Y 4.6137 8.1255 120.1386 56.4900 39.7097 175.0538 96 K 4.3086 8.9252 126.6199 55.6486 32.0706 176.1306 97 E 4.1873 8.6006 127.5214 56.1766 29.1933 176.1245 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 48 T 8.17 4.38 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 1.24 0.00 0.00 49 F 8.80 4.28 0.00 3.09 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 50 P 0.00 4.39 0.00 1.88 1.99 0.00 3.82 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.06 0.00 51 T 7.79 5.02 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 1.21 0.00 0.00 52 Y 9.10 4.94 0.00 3.00 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 53 K 8.86 4.40 0.00 1.84 1.79 0.00 1.80 0.00 0.00 1.72 0.00 0.00 2.80 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.45 1.52 7.81 54 C 8.75 4.58 0.00 2.88 2.77 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 0.00 0.00 0.00 55 P 0.00 4.45 0.00 2.12 1.91 0.00 2.65 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.96 0.00 56 E 8.65 3.85 0.00 1.88 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 2.32 2.33 0.00 57 T 7.63 3.30 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 1.08 0.00 0.00 58 F 7.96 3.95 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 59 D 8.20 4.36 0.00 2.77 2.64 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 60 A 7.80 4.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 W 7.76 4.97 0.00 3.47 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 62 Y 8.28 4.37 0.00 2.92 3.23 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 0.00 63 C 8.15 4.63 0.00 3.05 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 64 L 8.38 4.58 0.00 1.59 1.40 0.78 0.78 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 65 N 9.04 3.74 0.00 2.07 1.42 0.00 0.00 6.98 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 66 D 8.24 4.38 0.00 2.75 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 67 A 7.51 4.38 1.28 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 0.00 0.00 0.00 68 H 8.86 5.00 0.00 3.19 3.27 0.00 5.61 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 C 9.01 5.28 0.00 3.14 3.24 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 0.00 70 F 9.20 5.48 0.00 3.17 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 71 A 9.43 5.27 1.53 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 0.00 0.00 72 V 8.51 4.97 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 0.91 0.00 0.00 0.72 0.00 0.00 73 K 8.82 4.92 0.00 1.69 1.73 0.00 1.68 0.00 0.00 1.68 0.00 0.00 2.78 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.31 1.44 7.81 74 I 8.72 4.37 1.75 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 0.59 0.88 0.00 0.00 75 A 9.77 3.98 1.31 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 76 D 8.22 4.57 0.00 2.85 2.84 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 0.00 0.00 0.00 77 L 7.55 4.67 0.00 1.70 1.55 0.86 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 78 P 0.00 4.64 0.00 1.51 1.73 0.00 3.53 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.99 0.00 79 V 8.42 3.85 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 0.80 0.00 0.00 0.72 0.00 0.00 80 Y 7.76 5.04 0.00 2.29 2.35 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 0.00 0.00 0.00 0.00 81 S 8.60 4.78 0.00 2.72 3.39 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 0.00 82 C 8.65 5.44 0.00 2.83 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 83 E 9.64 4.61 0.00 2.26 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 2.33 2.34 0.00 84 C 8.87 4.99 0.00 3.02 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 85 A 8.63 4.34 1.38 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 0.00 0.00 0.00 86 I 8.21 3.75 1.92 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.63 0.92 0.00 0.00 87 G 9.39 3.77 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 0.00 0.00 0.00 0.00 0.00 0.00 88 F 7.57 5.41 0.00 2.97 3.11 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 89 M 9.65 4.83 0.00 2.06 1.90 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.55 0.00 90 G 9.23 4.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.86 3.91 0.00 2.07 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 7.23 0.00 0.00 0.00 0.00 0.00 2.27 2.49 0.00 92 R 8.61 4.15 0.00 1.76 1.70 0.00 3.18 0.00 0.00 3.00 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 1.22 0.00 93 C 7.99 4.54 0.00 3.16 3.18 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 0.00 0.00 0.00 0.00 94 E 8.13 3.92 0.00 1.66 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 1.47 1.55 0.00 95 Y 8.13 4.61 0.00 3.14 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 96 K 8.93 4.31 0.00 1.92 1.79 0.00 1.75 0.00 0.00 1.53 0.00 0.00 3.02 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.11 0.80 7.81 97 E 8.60 4.19 0.00 2.04 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 2.27 2.24 0.00