NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 85 T 4.2573 8.2745 110.9391 61.0846 70.0750 174.0583 86 R 3.8646 8.6588 124.5840 55.8780 29.9966 172.5014 87 K 4.8353 8.8871 124.3145 52.0523 38.1272 174.3158 88 L 3.6193 8.2565 118.2033 56.4745 41.0132 179.1321 89 C 4.4167 8.9626 122.1907 61.1543 40.0647 175.7245 90 S 4.0245 8.3121 114.1752 59.6050 62.9033 174.0880 91 L 4.2410 8.3785 123.7923 53.8848 41.3276 175.5307 92 D 4.4828 9.2007 129.5811 55.5055 39.8249 173.4091 93 N 4.0615 8.4214 110.0734 53.5050 37.7914 174.4333 94 G 3.6369 8.3418 101.8142 45.3130 0.0000 174.3910 95 D 4.4044 8.0122 115.5644 54.5226 40.5010 173.2463 96 C 4.7301 7.8169 114.5240 56.7498 41.0175 173.7390 97 D 4.4756 8.7512 123.2473 57.0519 41.9870 177.1720 98 Q 4.5079 7.3027 112.9086 55.7220 30.6919 179.4600 99 F 4.6642 7.0195 127.4150 58.5966 40.1943 172.4959 100 C 5.4089 8.5806 121.2247 55.3118 42.1101 172.7350 101 H 5.0483 9.2844 122.3746 54.1179 32.8642 172.6225 102 E 4.8803 8.9295 122.1316 55.3065 29.8951 175.1451 103 E 4.3846 8.8191 127.7482 56.2138 31.3553 177.9513 104 Q 3.4894 8.4480 122.5700 55.8358 27.0792 170.5305 105 N 4.9121 8.4570 107.7222 53.0313 37.6863 173.5745 106 S 4.5812 7.8379 113.9119 56.9434 66.7768 174.1902 107 V 4.2608 8.1693 121.5658 62.4989 32.2408 175.0976 108 V 4.4744 9.2064 127.9099 61.4174 33.8268 173.7298 109 C 5.5066 8.8512 125.0160 56.0618 37.4286 172.6424 110 S 4.6733 8.7024 114.8948 58.0541 66.5554 171.9113 111 C 4.8178 8.5598 115.4134 54.5322 38.8061 174.3677 112 A 4.4327 9.0006 125.0955 51.9875 18.6572 177.5451 113 R 4.0583 8.4777 118.7686 58.1363 30.5929 177.6329 114 G 3.9256 9.5152 110.1886 45.1541 0.0000 171.8258 115 Y 5.2948 7.6140 115.8755 56.0800 41.6315 175.0123 116 T 4.7846 9.2159 111.7841 59.5692 72.4006 172.8294 117 L 4.6085 8.4777 125.1960 54.8623 42.9094 176.5095 118 A 4.3271 8.9220 128.3243 51.5187 19.3980 178.1268 119 D 4.2970 8.7836 118.9136 57.3999 40.9075 177.8511 120 N 4.4573 8.1724 113.8738 52.8775 37.5923 175.6127 121 G 3.9933 8.4175 107.2223 46.2512 0.0000 174.4236 122 K 4.5126 8.8351 118.7144 56.7616 35.9441 176.5282 123 A 5.0370 8.1843 120.3451 51.1205 21.0745 176.8411 124 C 5.3008 9.2548 117.5541 55.2399 41.1041 173.6675 125 I 4.6221 9.0490 125.3131 58.7840 39.0222 173.5561 126 P 4.2062 0.0000 0.0000 62.7311 31.5698 176.3535 127 T 4.2800 8.4183 114.0625 61.8848 69.5917 174.1953 128 G 3.9738 7.2775 110.0273 44.3895 0.0000 170.6864 129 P 4.2134 0.0000 0.0000 62.2872 32.6233 174.8401 130 Y 3.6865 7.2764 113.4019 58.4990 34.8409 169.2070 131 P 4.3914 0.0000 0.0000 62.0191 32.6417 175.8192 132 C 4.3349 8.3413 114.4955 59.8846 29.8389 174.3330 133 G 4.0168 9.0826 109.4435 45.3210 0.0000 173.1434 134 K 4.6441 7.1970 118.7067 54.0712 34.3343 176.3311 135 Q 4.1917 8.5881 122.8640 55.9683 29.3533 176.0722 136 T 4.3092 8.3898 112.0153 61.5254 69.6928 174.5031 137 L 4.5485 8.4744 126.2225 55.6522 43.3135 176.9326 138 E 4.3796 7.9714 119.1508 56.3916 30.4076 180.3916 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 85 T 8.27 4.26 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 1.21 0.00 0.00 86 R 8.66 3.86 0.00 1.94 1.78 0.00 3.21 0.00 0.00 3.25 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.26 0.00 87 K 8.89 4.84 0.00 1.61 1.63 0.00 1.90 0.00 0.00 1.82 0.00 0.00 2.82 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.00 7.81 88 L 8.26 3.62 0.00 2.02 1.20 0.89 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 89 C 8.96 4.42 0.00 3.09 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 90 S 8.31 4.02 0.00 3.94 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 91 L 8.38 4.24 0.00 1.66 1.67 0.92 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 92 D 9.20 4.48 0.00 2.90 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.42 4.06 0.00 2.98 2.79 0.00 0.00 7.65 7.90 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 94 G 8.34 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 0.00 0.00 0.00 95 D 8.01 4.40 0.00 2.83 2.76 0.00 0.00 0.00 0.00 0.00 0.00 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 C 7.82 4.73 0.00 3.05 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 97 D 8.75 4.48 0.00 2.59 2.57 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 98 Q 7.30 4.51 0.00 1.49 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.81 6.98 0.00 0.00 0.00 0.00 0.00 1.87 1.99 0.00 99 F 7.02 4.66 0.00 2.93 2.68 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 0.00 0.00 0.00 0.00 100 C 8.58 5.41 0.00 3.05 2.93 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 0.00 101 H 9.28 5.05 0.00 3.06 3.13 0.00 5.65 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 E 8.93 4.88 0.00 1.86 1.94 0.00 0.00 0.00 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 2.34 0.00 103 E 8.82 4.38 0.00 2.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.24 0.00 104 Q 8.45 3.49 0.00 2.23 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 7.44 0.00 0.00 0.00 0.00 0.00 2.18 1.93 0.00 105 N 8.46 4.91 0.00 2.68 2.81 0.00 0.00 6.54 7.57 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 0.00 106 S 7.84 4.58 0.00 3.91 3.92 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 0.00 107 V 8.17 4.26 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 0.78 0.00 0.00 0.94 0.00 0.00 108 V 9.21 4.47 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 1.04 0.00 0.00 109 C 8.85 5.51 0.00 3.01 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 0.00 110 S 8.70 4.67 0.00 4.04 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 0.00 111 C 8.56 4.82 0.00 2.82 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 0.00 112 A 9.00 4.43 1.27 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 0.00 0.00 0.00 0.00 0.00 0.00 113 R 8.48 4.06 0.00 2.16 1.96 0.00 3.31 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.21 0.00 114 G 9.52 3.93 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 0.00 115 Y 7.61 5.29 0.00 2.84 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 0.00 116 T 9.22 4.78 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 0.00 117 L 8.48 4.61 0.00 1.68 1.63 1.03 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 118 A 8.92 4.33 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 0.00 119 D 8.78 4.30 0.00 2.68 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 N 8.17 4.46 0.00 2.81 2.93 0.00 0.00 6.03 7.00 0.00 0.00 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 G 8.42 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 0.00 0.00 0.00 122 K 8.84 4.51 0.00 1.64 1.91 0.00 1.65 0.00 0.00 1.64 0.00 0.00 2.87 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.34 1.47 7.81 123 A 8.18 5.04 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 0.00 124 C 9.25 5.30 0.00 2.58 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 I 9.05 4.62 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 1.25 1.21 0.91 0.00 0.00 126 P 0.00 4.21 0.00 1.76 1.62 0.00 3.67 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.14 0.00 127 T 8.42 4.28 4.20 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 0.00 0.00 0.00 1.18 0.00 0.00 128 G 7.28 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 P 0.00 4.21 0.00 1.43 1.78 0.00 3.90 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.92 0.00 130 Y 7.28 3.69 0.00 3.20 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 0.00 131 P 0.00 4.39 0.00 1.79 1.70 0.00 3.58 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.78 0.00 132 C 8.34 4.33 0.00 3.19 3.08 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 0.00 133 G 9.08 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 K 7.20 4.64 0.00 1.61 1.75 0.00 1.78 0.00 0.00 1.77 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.65 1.59 7.81 135 Q 8.59 4.19 0.00 2.06 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.94 0.00 0.00 0.00 0.00 0.00 2.39 2.37 0.00 136 T 8.39 4.31 4.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 137 L 8.47 4.55 0.00 1.63 1.73 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 138 E 7.97 4.38 0.00 1.94 1.64 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 2.13 1.85 0.00