NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 133 L 4.2629 8.1693 120.9922 55.5370 42.1351 177.1930 134 S 4.3596 8.5083 115.5834 58.3679 65.7192 172.3777 135 I 3.7501 8.3505 122.1672 64.4907 37.1916 179.3106 136 Y 4.0993 7.9916 120.0613 60.7844 38.7510 177.7622 137 Q 4.1377 8.2555 120.3847 58.5093 28.7642 178.3565 138 D 4.3745 8.2341 119.9691 57.4468 40.8228 178.8357 139 Q 3.8383 7.7207 119.3626 59.1786 28.6028 178.0281 140 E 3.7536 7.8245 119.5620 59.5246 29.4468 179.4576 141 Q 3.9798 8.4234 118.4633 58.7938 28.7510 178.7286 142 R 3.9135 8.0311 119.8769 59.4453 30.1254 178.7711 143 I 3.7114 7.6991 119.5586 64.3904 37.1710 178.3585 144 L 4.0167 8.1597 120.1946 57.6900 41.4101 179.6044 145 K 3.9672 8.5924 120.0226 59.2582 31.9217 178.6126 146 F 3.9513 8.0888 119.9245 61.4911 39.6353 176.9133 147 L 4.2763 8.3081 118.4786 57.8151 41.1398 179.4121 148 E 4.0727 8.1160 118.0379 59.0018 29.4485 178.1478 149 E 4.3082 7.7366 115.9957 56.4343 29.5729 177.9323 150 L 4.0343 7.3350 122.2892 59.6584 42.7410 177.0647 151 G 3.6854 8.1503 103.1115 44.2888 0.0000 170.9563 152 E 3.8475 8.3686 122.0532 57.0935 29.3695 177.9530 153 G 4.0656 8.2413 105.3750 45.0282 0.0000 173.6326 154 K 4.0561 7.9400 119.1548 56.1060 32.5432 175.8964 155 A 5.1007 8.3112 123.5376 50.5872 22.6930 174.2414 156 T 4.8640 8.9168 112.8611 61.1477 71.8515 172.7849 157 T 4.8961 8.4539 114.0770 60.4042 70.9835 175.7977 158 A 3.9542 8.8126 123.7337 55.2886 18.4131 179.4004 159 H 4.0636 8.2674 116.5009 59.4830 29.9053 176.8329 160 D 4.1860 8.2193 119.6619 57.1879 41.1481 177.6829 161 L 3.3004 7.6276 120.8069 58.1823 42.0393 178.8303 162 S 4.2437 7.7551 114.7181 60.7567 62.2736 176.4584 163 G 3.4997 7.7875 108.2133 47.7278 0.0000 175.9784 164 K 4.0630 8.0237 120.2043 58.4377 32.1790 178.5333 165 L 4.4488 7.7239 116.4901 53.4308 42.1009 176.6908 166 G 3.9351 7.5421 106.2517 46.8808 0.0000 173.7269 167 T 4.5898 7.5119 115.2863 59.9783 71.6212 172.3142 168 P 4.3165 0.0000 0.0000 62.8451 33.0461 177.3921 169 K 3.8137 8.8133 122.3949 59.6323 31.9772 178.8146 170 K 3.9014 8.0044 119.2666 59.5524 32.1635 178.4800 171 E 3.9665 8.0727 118.2339 59.3634 29.4867 179.0314 172 I 3.5544 7.5697 119.6418 64.6916 37.1477 178.2048 173 N 4.2959 8.6439 117.3506 56.2843 38.1913 177.4096 174 R 3.8919 7.9620 120.1677 59.4350 30.0626 178.8312 175 V 3.6614 7.7360 118.0174 65.7058 31.6651 177.9653 176 L 3.4988 8.1247 118.9984 57.9132 41.2853 179.1557 177 Y 4.0732 8.0965 116.7627 61.0682 37.8218 178.5280 178 S 4.1785 7.9795 114.0909 61.6373 62.4096 176.3653 179 L 4.1040 8.3152 121.2680 57.3562 41.3806 179.2072 180 A 4.6428 7.8552 122.0953 54.2189 18.1779 179.7862 181 K 4.0917 7.9233 116.6641 59.2835 32.2431 178.8956 182 K 4.2960 7.7336 115.8169 56.5979 32.3215 178.1147 183 G 4.0451 7.8860 107.6106 45.2376 0.0000 174.9122 184 K 4.2574 7.9019 119.2162 58.4223 33.1712 176.9342 185 L 5.4187 8.0035 118.2505 52.7740 45.8395 175.1672 186 Q 4.7541 9.0658 122.3964 54.2209 31.7476 174.0298 187 K 3.5707 8.3945 127.5797 54.9246 33.6949 175.3140 188 E 4.3939 8.3761 127.5289 54.2385 30.8364 175.3671 189 A 4.1659 8.6032 126.8535 51.6991 19.2034 177.3754 190 G 3.7584 7.4295 106.5501 46.3141 0.0000 172.3037 191 T 4.4034 7.9005 115.6061 61.0855 69.8213 172.1349 192 P 4.6666 0.0000 0.0000 60.8424 32.8747 174.4020 193 P 4.5554 0.0000 0.0000 62.5717 32.1800 175.9503 194 L 5.0309 8.2397 121.1200 52.8872 44.8505 175.7522 195 W 5.3952 9.2289 121.8870 55.2012 33.1646 174.4690 196 K 4.8760 8.3379 119.2609 56.0037 36.0349 174.4503 197 I 4.2984 8.3879 121.5189 61.0975 37.5113 176.3467 198 A 4.1075 8.6681 129.1517 52.2783 19.4631 178.0546 199 V 3.6193 8.2339 110.9012 62.2150 31.7779 173.0978 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 133 L 8.17 4.26 0.00 1.75 1.84 0.93 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 134 S 8.51 4.36 0.00 4.12 4.14 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 0.00 0.00 0.00 0.00 135 I 8.35 3.75 1.91 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 1.54 0.92 0.94 0.00 0.00 136 Y 7.99 4.10 0.00 3.04 2.99 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 0.00 137 Q 8.26 4.14 0.00 2.38 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.54 0.00 0.00 0.00 0.00 0.00 2.41 2.35 0.00 138 D 8.23 4.37 0.00 2.86 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 0.00 139 Q 7.72 3.84 0.00 2.05 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.19 2.30 0.00 140 E 7.82 3.75 0.00 2.03 1.83 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 1.93 1.62 0.00 141 Q 8.42 3.98 0.00 2.21 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.80 0.00 0.00 0.00 0.00 0.00 2.48 2.49 0.00 142 R 8.03 3.91 0.00 2.09 1.93 0.00 3.07 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 143 I 7.70 3.71 1.91 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.63 0.81 0.00 0.00 144 L 8.16 4.02 0.00 1.80 1.72 0.95 0.77 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 0.00 145 K 8.59 3.97 0.00 1.87 2.04 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.44 7.81 146 F 8.09 3.95 0.00 3.22 3.20 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 0.00 147 L 8.31 4.28 0.00 1.95 1.79 0.98 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 148 E 8.12 4.07 0.00 2.08 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.64 0.00 149 E 7.74 4.31 0.00 1.75 1.86 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 2.27 2.55 0.00 150 L 7.34 4.03 0.00 1.61 1.71 0.86 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 151 G 8.15 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 0.00 0.00 0.00 152 E 8.37 3.85 0.00 1.91 1.78 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 2.29 2.37 0.00 153 G 8.24 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 K 7.94 4.06 0.00 1.74 1.77 0.00 1.58 0.00 0.00 1.70 0.00 0.00 3.12 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.50 7.81 155 A 8.31 5.10 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 0.00 156 T 8.92 4.86 4.43 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 1.39 0.00 0.00 157 T 8.45 4.90 4.36 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 158 A 8.81 3.95 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 H 8.27 4.06 0.00 3.28 3.36 0.00 5.87 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 D 8.22 4.19 0.00 2.88 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 0.00 161 L 7.63 3.30 0.00 1.84 1.54 0.03 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 162 S 7.76 4.24 0.00 3.81 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 0.00 163 G 7.79 3.50 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 0.00 0.00 0.00 164 K 8.02 4.06 0.00 1.42 1.94 0.00 1.85 0.00 0.00 1.75 0.00 0.00 3.10 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.72 1.84 7.81 165 L 7.72 4.45 0.00 1.50 1.61 0.76 0.68 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 0.00 166 G 7.54 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 167 T 7.51 4.59 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 168 P 0.00 4.32 0.00 2.14 1.98 0.00 3.73 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.14 0.00 169 K 8.81 3.81 0.00 1.83 1.84 0.00 1.80 0.00 0.00 1.82 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.55 1.54 7.81 170 K 8.00 3.90 0.00 1.86 1.78 0.00 1.77 0.00 0.00 1.81 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.50 1.53 7.81 171 E 8.07 3.97 0.00 2.21 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 2.41 2.40 0.00 172 I 7.57 3.55 1.96 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.79 0.72 0.00 0.00 173 N 8.64 4.30 0.00 2.85 2.98 0.00 0.00 6.75 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 R 7.96 3.89 0.00 2.10 2.10 0.00 3.12 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 1.66 1.64 0.00 175 V 7.74 3.66 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 0.90 0.00 0.00 1.03 0.00 0.00 176 L 8.12 3.50 0.00 0.81 0.13 -0.13 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 177 Y 8.10 4.07 0.00 3.17 3.14 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 0.00 0.00 0.00 0.00 178 S 7.98 4.18 0.00 3.99 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 L 8.32 4.10 0.00 1.82 1.70 0.84 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 180 A 7.86 4.64 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 K 7.92 4.09 0.00 2.07 1.94 0.00 1.78 0.00 0.00 1.79 0.00 0.00 3.14 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.76 1.71 7.81 182 K 7.73 4.30 0.00 1.91 1.88 0.00 1.77 0.00 0.00 1.75 0.00 0.00 3.08 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.51 1.66 7.81 183 G 7.89 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 0.00 0.00 0.00 184 K 7.90 4.26 0.00 1.71 1.89 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.47 1.44 7.81 185 L 8.00 5.42 0.00 1.71 1.82 0.89 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 186 Q 9.07 4.75 0.00 2.12 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.87 0.00 0.00 0.00 0.00 0.00 2.19 2.20 0.00 187 K 8.39 3.57 0.00 0.79 1.15 0.00 1.17 0.00 0.00 1.41 0.00 0.00 2.77 0.00 0.00 2.74 0.00 0.00 0.00 0.00 0.76 0.21 7.81 188 E 8.38 4.39 0.00 1.73 1.74 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 2.11 2.20 0.00 189 A 8.60 4.17 1.16 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 0.00 0.00 190 G 7.43 3.76 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 0.00 0.00 0.00 191 T 7.90 4.40 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 1.22 0.00 0.00 192 P 0.00 4.67 0.00 2.26 2.11 0.00 3.78 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 193 P 0.00 4.56 0.00 1.80 1.76 0.00 3.77 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.28 0.00 194 L 8.24 5.03 0.00 1.44 1.49 1.01 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 195 W 9.23 5.40 0.00 3.18 3.06 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 0.00 0.00 0.00 0.00 196 K 8.34 4.88 0.00 1.86 1.92 0.00 1.32 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.31 1.41 7.81 197 I 8.39 4.30 1.89 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 1.31 0.83 0.99 0.00 0.00 198 A 8.67 4.11 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 0.00 199 V 8.23 3.62 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 0.66 0.00 0.00 0.94 0.00 0.00