NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 125 N 4.5919 8.2785 119.1990 53.3254 40.6269 174.8808 126 A 3.6819 8.5007 127.7280 54.3443 18.5614 178.0611 127 L 3.5023 8.0046 118.4421 58.2159 42.4692 177.2734 128 V 3.5596 7.4982 117.8238 66.4494 31.4029 177.8702 129 E 4.1635 8.0653 117.8467 59.2566 29.1403 178.8523 130 D 4.3541 7.9382 117.7878 57.5817 41.3336 178.3845 131 F 4.6688 8.5061 118.6225 60.9004 38.8265 177.5768 132 E 4.3440 8.4783 119.5362 58.5156 29.0127 179.4270 133 R 3.9573 7.9675 117.6390 59.3921 30.2734 178.3078 134 E 4.1824 8.2679 116.9564 59.7071 29.6365 179.1940 135 L 4.3739 7.9764 116.9794 55.2416 41.9209 178.1432 136 G 4.1578 9.8728 106.4214 45.2179 0.0000 172.6429 137 R 4.2912 7.1094 121.7984 55.3225 33.1302 176.6778 *139 L 4.2509 8.4683 115.1497 54.1458 42.5917 176.8350 140 S 4.2783 9.0571 117.3072 57.4436 64.4436 173.4403 141 P 4.0499 0.0000 0.0000 65.6449 30.9555 178.9612 142 F 4.1723 7.5893 116.6201 60.6371 38.7611 177.5580 143 E 2.9552 7.8376 117.5805 58.8954 29.2270 179.1834 144 L 3.8623 7.8872 119.3978 57.6796 41.5492 179.1294 145 E 3.9211 8.1360 119.2587 59.3648 29.5355 178.4507 146 D 4.4388 8.0649 118.1375 57.0493 41.2197 177.7864 147 L 4.3312 8.3855 121.5221 58.3702 42.1048 178.6533 148 Q 4.0156 8.2327 119.3733 59.2459 28.8614 178.6312 149 K 4.4801 7.8768 120.4292 59.3287 31.9932 179.2422 150 T 4.0628 8.1528 116.0210 66.8382 67.9359 176.8082 151 V 3.8057 8.2440 120.1060 66.0811 31.4015 177.8982 152 S 4.3354 8.5575 114.9898 61.0825 63.0437 176.3931 153 D 4.3802 7.9081 120.6212 57.6603 40.7944 178.1771 154 D 4.5258 8.3287 115.9194 54.2059 41.6459 176.2041 155 K 3.9646 7.1797 117.4914 56.5098 29.8934 175.4068 156 T 4.5081 7.5739 113.8048 61.3915 70.5676 175.2112 157 D 4.4434 8.6845 126.0374 53.9388 41.9156 175.3093 158 P 4.5349 0.0000 0.0000 65.8265 31.2919 178.4264 159 D 4.5256 8.8867 118.1875 56.9471 40.6939 178.4017 160 L 4.0186 8.1165 121.3153 57.7524 42.0558 178.9246 161 V 3.5051 7.8681 117.9258 65.9632 31.4428 177.6138 162 R 3.5803 7.9839 118.4514 59.5842 29.9665 178.6731 163 S 4.2474 8.2110 113.4548 61.2536 62.8485 176.2523 164 A 3.8374 8.3160 124.7378 54.7354 17.9990 179.5490 165 L 3.8343 7.9250 117.6919 57.9599 41.6153 179.8518 166 R 3.9642 7.9805 117.9519 59.2823 30.0538 178.5900 167 E 4.0603 8.4103 118.7878 59.3029 29.5100 178.6791 168 A 4.2414 8.1580 120.7316 55.2449 18.3992 179.5398 169 V 3.5642 7.9423 116.6827 66.4199 31.3955 177.6698 170 F 4.2962 8.3868 119.0838 61.5188 39.2126 176.0547 171 N 4.5972 8.1631 112.7166 52.3724 38.7196 175.4553 172 G 3.8656 8.1914 108.6222 46.2587 0.0000 174.6847 173 K 4.3609 8.3479 120.0306 54.5561 33.0845 175.8452 174 T 4.6307 8.2209 113.0214 61.1714 69.5879 175.7109 175 N 4.7842 7.9167 119.9187 52.8541 39.6997 175.2038 176 W 4.1326 8.7930 130.8127 60.7863 30.8556 178.0115 177 N 4.3944 8.3057 116.0911 56.2825 37.9289 176.6519 178 Y 4.0941 7.8901 120.6134 60.5300 39.0407 177.3352 179 I 3.2049 7.3844 120.5015 64.4829 37.0613 178.3953 180 Q 3.5908 7.7712 118.7250 58.5877 28.3841 178.5310 181 A 3.7867 8.0476 122.1816 55.1857 18.3534 179.7278 182 I 2.9425 7.1157 118.0133 64.2167 37.0372 178.6390 183 L 3.7070 7.2016 119.5728 57.6640 41.4120 179.6046 184 R 3.7328 7.9204 118.8397 59.3522 30.0100 178.0268 185 N 4.1973 8.0322 116.9325 56.4395 38.8259 176.8279 186 W 4.4711 7.9733 120.3566 59.7484 29.2024 178.2351 187 R 3.9235 8.2121 118.6850 59.9448 29.2600 177.9388 188 H 4.2393 7.8782 114.3891 59.1756 28.8830 176.8471 189 E 4.3800 8.0733 116.3881 56.2483 29.3710 177.7335 190 G 3.8483 7.7861 107.0517 45.7357 0.0000 173.7811 191 I 4.1710 7.9721 121.6486 60.3549 36.9818 175.7404 192 S 4.7087 9.4108 120.0300 57.7303 64.6211 173.9840 193 T 4.6981 7.4823 110.1011 59.2946 71.8500 174.5815 194 L 3.8231 8.5783 122.3092 58.1123 41.8158 179.1193 195 R 3.9980 7.9700 115.8282 59.3930 30.1917 178.0827 196 Q 3.8390 7.4432 114.6455 58.4640 28.7248 176.5522 197 V 3.4549 6.9345 118.2378 63.3806 30.3628 175.1817 198 E 5.9800 8.1562 135.0000 57.6105 29.2153 176.6537 199 E 4.1097 7.8549 122.1107 56.5936 29.4571 176.4956 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 125 N 8.28 4.59 0.00 2.71 2.71 0.00 0.00 6.97 7.69 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 0.00 126 A 8.50 3.68 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.00 3.50 0.00 1.51 1.35 0.68 0.26 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 0.00 128 V 7.50 3.56 2.21 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 0.98 0.00 0.00 0.91 0.00 0.00 129 E 8.07 4.16 0.00 2.02 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 2.48 2.45 0.00 130 D 7.94 4.35 0.00 2.91 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.51 4.67 0.00 3.22 3.07 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 0.00 132 E 8.48 4.34 0.00 2.22 2.16 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 2.55 2.49 0.00 133 R 7.97 3.96 0.00 2.07 2.05 0.00 3.21 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.89 0.00 134 E 8.27 4.18 0.00 2.19 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 0.00 2.70 2.71 0.00 135 L 7.98 4.37 0.00 1.73 1.80 1.10 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 136 G 9.87 4.16 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 0.00 137 R 7.11 4.29 0.00 1.99 1.38 0.00 3.06 0.00 0.00 3.40 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.72 0.00 *139 L 8.47 4.25 0.00 1.77 1.56 1.07 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 140 S 9.06 4.28 0.00 3.87 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 0.00 141 P 0.00 4.05 0.00 1.72 1.86 0.00 3.47 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 1.90 2.04 0.00 142 F 7.59 4.17 0.00 3.03 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 0.00 143 E 7.84 2.96 0.00 1.72 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 2.12 0.00 144 L 7.89 3.86 0.00 1.55 1.65 0.85 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 145 E 8.14 3.92 0.00 2.04 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 0.00 2.34 2.39 0.00 146 D 8.06 4.44 0.00 3.04 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 0.00 147 L 8.39 4.33 0.00 2.10 1.98 1.33 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 148 Q 8.23 4.02 0.00 2.24 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.58 0.00 0.00 0.00 0.00 0.00 2.38 2.49 0.00 149 K 7.88 4.48 0.00 2.08 1.91 0.00 1.82 0.00 0.00 1.79 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.63 1.39 7.81 150 T 8.15 4.06 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 1.25 0.00 0.00 151 V 8.24 3.81 2.16 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 1.09 0.00 0.00 1.13 0.00 0.00 152 S 8.56 4.34 0.00 3.88 3.89 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 0.00 153 D 7.91 4.38 0.00 2.86 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 0.00 154 D 8.33 4.53 0.00 2.93 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 K 7.18 3.96 0.00 1.88 1.86 0.00 1.68 0.00 0.00 1.76 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.51 7.81 156 T 7.57 4.51 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 1.27 0.00 0.00 157 D 8.68 4.44 0.00 2.69 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 P 0.00 4.53 0.00 2.31 2.26 0.00 3.71 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.27 0.00 159 D 8.89 4.53 0.00 2.84 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 0.00 160 L 8.12 4.02 0.00 1.77 1.87 0.60 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 161 V 7.87 3.51 2.27 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 0.66 0.00 0.00 1.00 0.00 0.00 162 R 7.98 3.58 0.00 2.16 2.17 0.00 3.23 0.00 0.00 3.49 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.75 0.00 163 S 8.21 4.25 0.00 4.13 4.10 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 0.00 164 A 8.32 3.84 1.07 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 0.00 165 L 7.93 3.83 0.00 1.76 1.68 0.25 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 166 R 7.98 3.96 0.00 2.04 2.00 0.00 3.16 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.77 0.00 167 E 8.41 4.06 0.00 2.24 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 0.00 2.21 2.38 0.00 168 A 8.16 4.24 1.49 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 0.00 0.00 0.00 0.00 0.00 0.00 169 V 7.94 3.56 2.32 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 1.15 0.00 0.00 1.10 0.00 0.00 170 F 8.39 4.30 0.00 3.10 3.38 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 0.00 171 N 8.16 4.60 0.00 3.04 2.77 0.00 0.00 7.05 7.68 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 0.00 172 G 8.19 3.87 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 0.00 0.00 0.00 173 K 8.35 4.36 0.00 1.23 1.38 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.67 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.05 1.21 7.81 174 T 8.22 4.63 4.32 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 0.00 0.00 0.00 1.27 0.00 0.00 175 N 7.92 4.78 0.00 3.04 3.04 0.00 0.00 5.78 8.88 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 0.00 176 W 8.79 4.13 0.00 3.74 3.17 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 0.00 177 N 8.31 4.39 0.00 2.83 2.88 0.00 0.00 6.79 7.48 0.00 0.00 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 Y 7.89 4.09 0.00 2.95 3.03 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 0.00 0.00 0.00 179 I 7.38 3.20 1.26 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.69 0.11 0.00 0.00 180 Q 7.77 3.59 0.00 1.77 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 1.48 2.33 0.00 181 A 8.05 3.79 1.19 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 0.00 0.00 182 I 7.12 2.94 1.26 0.00 0.00 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 -0.28 -0.72 0.00 0.00 183 L 7.20 3.71 0.00 1.58 1.59 0.69 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 184 R 7.92 3.73 0.00 1.89 1.87 0.00 3.05 0.00 0.00 3.02 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.52 0.00 185 N 8.03 4.20 0.00 2.64 2.69 0.00 0.00 7.26 8.07 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 0.00 186 W 7.97 4.47 0.00 3.51 3.22 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 0.00 187 R 8.21 3.92 0.00 1.94 2.11 0.00 3.19 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.75 0.00 188 H 7.88 4.24 0.00 3.44 3.34 0.00 5.70 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 E 8.07 4.38 0.00 2.19 2.04 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 2.41 2.63 0.00 190 G 7.79 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 I 7.97 4.17 1.96 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.56 0.34 0.00 0.00 192 S 9.41 4.71 0.00 3.88 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 0.00 193 T 7.48 4.70 4.18 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 1.17 0.00 0.00 194 L 8.58 3.82 0.00 1.59 1.70 0.91 0.90 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 0.00 195 R 7.97 4.00 0.00 1.71 1.94 0.00 3.21 0.00 0.00 3.19 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.67 0.00 196 Q 7.44 3.84 0.00 2.09 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.06 0.00 0.00 0.00 0.00 0.00 2.31 2.20 0.00 197 V 6.93 3.45 1.75 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 0.30 0.00 0.00 -0.45 0.00 0.00 198 E 8.16 5.98 0.00 1.94 1.91 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 1.98 1.97 0.00 199 E 7.85 4.11 0.00 1.95 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 2.26 2.37 0.00 * Residues marked with a * may have inaccurate shift predictions.