NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 78 S 4.3906 8.2929 115.2896 57.8922 63.1083 174.7916 79 Q 3.8602 8.6826 131.1161 59.8395 27.9531 171.4369 80 E 4.2117 8.5635 121.5569 60.2901 29.9368 179.3213 81 E 4.0142 8.0608 117.2844 61.6655 29.6765 181.1955 82 I 3.9350 7.9990 121.0036 64.3144 37.2371 178.6284 83 I 3.7837 8.2818 114.0202 63.7148 37.4522 177.8744 84 H 4.0629 8.7548 121.0417 59.5506 29.9162 177.0582 85 N 4.5136 8.4400 118.1533 55.9487 38.2060 177.7210 86 I 3.6889 8.0552 121.4681 64.2195 37.3491 177.7500 87 A 4.0472 7.8470 123.7004 56.2753 18.0565 180.6524 88 R 3.8787 8.0170 118.6702 61.7514 29.5254 180.2295 89 H 4.2904 8.1093 118.7880 59.0805 29.8468 177.4242 90 L 3.9906 8.4419 120.9696 57.6848 41.3899 179.2783 91 A 3.9767 8.0976 120.7307 55.1344 18.2893 179.4034 92 Q 3.8467 8.2874 118.2947 59.4819 29.0833 178.4860 93 I 3.7624 8.3010 120.1103 63.7408 37.9706 178.0558 94 G 3.5923 8.5600 107.1428 48.0206 0.0000 175.4792 95 D 4.4354 8.1990 120.7738 56.8183 41.1877 178.4483 96 E 4.1090 8.3507 119.1828 59.7408 29.5130 179.0062 97 M 4.0131 8.2076 118.8730 58.8306 31.8893 178.5265 98 D 4.4014 8.1709 116.1869 56.6601 41.4317 176.8502 99 H 4.7166 7.6087 113.4475 54.3251 29.7557 174.3636 100 N 4.4697 7.1835 119.5665 53.8914 39.4867 174.4265 101 I 4.1732 7.9430 121.5913 61.2960 38.3936 174.7730 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 78 S 8.29 4.39 0.00 3.87 3.84 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 79 Q 8.68 3.86 0.00 2.18 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.71 0.00 0.00 0.00 0.00 0.00 2.36 2.08 0.00 80 E 8.56 4.21 0.00 2.00 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 0.00 2.41 2.40 0.00 81 E 8.06 4.01 0.00 1.99 1.98 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 2.25 2.24 0.00 82 I 8.00 3.93 2.03 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 1.83 0.66 0.91 0.00 0.00 83 I 8.28 3.78 1.88 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 1.42 0.73 0.93 0.00 0.00 84 H 8.75 4.06 0.00 3.29 3.54 0.00 5.78 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 N 8.44 4.51 0.00 2.98 2.88 0.00 0.00 7.14 6.49 0.00 0.00 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 8.06 3.69 1.88 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 1.44 0.85 0.92 0.00 0.00 87 A 7.85 4.05 1.39 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 0.00 0.00 88 R 8.02 3.88 0.00 1.85 1.95 0.00 3.28 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.50 0.00 89 H 8.11 4.29 0.00 3.34 3.54 0.00 5.75 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 L 8.44 3.99 0.00 1.88 1.71 0.93 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 91 A 8.10 3.98 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 Q 8.29 3.85 0.00 2.32 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.76 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 93 I 8.30 3.76 1.81 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 1.44 1.30 0.98 0.00 0.00 94 G 8.56 3.59 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 95 D 8.20 4.44 0.00 2.81 2.74 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 96 E 8.35 4.11 0.00 2.22 1.99 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 2.31 2.45 0.00 97 M 8.21 4.01 0.00 2.04 2.38 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 2.73 2.57 0.00 98 D 8.17 4.40 0.00 2.79 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 99 H 7.61 4.72 0.00 3.13 3.32 0.00 5.92 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.18 4.47 0.00 2.80 2.81 0.00 0.00 6.78 8.92 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 0.00 101 I 7.94 4.17 1.88 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 1.28 1.06 0.92 0.00 0.00