NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 143 N 4.7536 8.2833 118.1256 53.3860 41.0751 176.3713 144 I 3.5614 7.7246 118.7934 64.0610 37.0606 176.6378 145 N 4.3657 8.9375 118.2081 56.1815 38.6981 177.2057 146 K 4.0130 7.8354 119.5153 59.3260 32.2762 179.1897 147 L 3.9657 8.3160 119.7642 57.6844 41.5555 179.5148 148 K 3.9217 8.2005 119.5838 59.3766 31.9976 178.7952 149 S 4.0910 7.9429 113.5917 61.3392 62.2858 176.3294 150 S 4.1077 8.3000 117.1443 61.7286 62.8176 176.4648 151 I 3.6446 7.9124 123.8919 63.5735 36.7461 177.8544 152 E 3.8397 8.2119 120.2552 59.6175 29.4308 179.1885 153 S 4.0245 7.8158 114.7056 61.7831 62.8707 176.7189 154 T 3.8572 8.0263 118.5703 66.9319 68.2608 176.3183 155 N 4.3084 8.5724 118.5266 56.1627 38.4947 177.3348 156 E 3.6130 7.8002 119.7280 59.2419 29.3917 179.0690 157 A 4.1338 7.9158 120.7723 55.3823 18.3824 179.8887 158 V 3.5229 7.7537 116.5946 66.0950 31.6391 178.3917 159 V 3.7502 7.8316 118.0165 66.0615 31.3101 178.2115 160 K 4.1145 8.1314 118.2139 59.2356 31.8034 179.4085 161 L 4.0612 7.9266 119.5691 57.7832 41.4926 179.4810 162 Q 3.9705 8.1967 118.1679 58.8855 28.4926 178.5844 163 E 4.0249 8.1054 119.7383 59.5687 29.3328 179.4737 164 T 3.9238 7.9022 115.7926 66.4127 68.4946 176.7745 165 A 3.9590 8.1827 123.0942 54.8479 18.4557 179.2429 166 E 3.5458 8.0571 117.9273 59.4083 29.7424 179.3609 167 K 4.1273 7.7516 117.9896 59.4817 32.0210 179.6522 168 T 3.8838 7.4989 116.3557 66.4368 68.3063 176.8312 169 V 3.5270 7.5733 120.1435 66.1989 31.4968 177.4406 170 Y 4.4448 7.4499 116.0719 61.3519 37.6802 179.0097 171 V 3.6383 7.9590 118.7854 66.1794 31.4547 178.0185 172 L 4.0489 8.2655 117.6662 58.1938 41.4777 179.4348 173 T 4.0755 8.1136 115.0579 66.2548 68.4557 176.4405 174 A 4.1927 7.9360 121.8995 53.7136 18.8128 177.6173 175 L 4.5927 7.3438 117.6121 54.5675 43.8224 178.1635 *454 V 4.0996 7.9981 120.0260 62.6413 32.8086 177.0407 455 D 4.7980 9.0139 116.0635 53.5278 42.5882 176.0034 456 I 3.6020 7.6055 125.2657 64.5222 37.7858 177.6525 457 S 4.4933 8.1875 115.3594 62.0242 62.7517 176.9099 458 S 4.1468 8.0423 116.8290 61.7665 62.6786 176.7239 459 Q 4.0526 8.5144 120.9719 59.2312 28.4172 179.1094 460 I 3.8398 8.8297 121.5586 63.9921 37.1501 178.4355 461 S 4.1537 8.1367 114.5324 61.2443 62.2260 176.3025 462 S 4.1800 8.2751 118.0366 61.5191 62.4812 176.1850 463 M 3.9842 7.9664 121.5145 58.6264 31.7607 178.2158 464 N 4.2746 7.8558 116.7915 56.8519 39.1353 176.7926 465 Q 3.9724 7.9167 118.7354 59.1251 28.8672 178.8473 466 S 4.1274 8.4731 116.4709 61.7488 62.8398 176.6948 467 L 4.0004 8.3247 123.1748 58.1472 41.7116 178.9659 468 Q 3.9696 8.2694 118.0897 59.0442 28.6865 178.8369 469 Q 3.7955 7.9834 118.8955 58.9118 28.7399 178.5302 470 S 4.2634 8.0945 114.1225 61.6885 62.4783 176.4440 471 K 3.9646 8.3000 120.9935 59.6283 31.8563 179.0508 472 D 4.3200 8.1932 119.2127 57.6133 40.7448 178.4779 473 Y 4.3495 8.4102 117.5378 61.1768 37.8129 178.5495 474 I 3.7923 8.1463 119.6842 63.9693 38.1020 178.0900 475 K 4.0179 8.0380 119.1477 59.4143 31.7688 178.9389 476 E 3.9649 8.3080 119.3314 58.9581 29.4489 178.6950 477 A 3.9911 8.0522 120.8998 55.4307 18.5967 179.6313 478 Q 3.9436 8.4833 116.9631 58.8522 28.4919 178.9883 479 K 3.9018 7.9540 119.7460 59.5508 32.5414 178.4133 480 I 3.8197 7.9542 120.1012 64.6298 37.1457 177.8721 481 L 3.7031 8.2090 121.1114 58.7632 41.5511 178.8112 482 D 4.4959 7.8326 116.6260 56.9610 40.8042 178.1723 483 T 4.1223 8.4216 116.0311 65.1699 68.6055 174.6830 484 V 3.9198 7.4839 125.4140 63.0607 31.5411 175.3583 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 143 N 8.28 4.75 0.00 2.77 2.93 0.00 0.00 7.01 6.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 I 7.72 3.56 1.87 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 1.64 0.84 0.91 0.00 0.00 145 N 8.94 4.37 0.00 2.81 2.87 0.00 0.00 7.16 6.94 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 0.00 146 K 7.84 4.01 0.00 2.00 1.85 0.00 1.84 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.53 7.81 147 L 8.32 3.97 0.00 1.82 1.71 0.92 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 148 K 8.20 3.92 0.00 1.82 1.96 0.00 1.63 0.00 0.00 1.57 0.00 0.00 3.04 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.44 7.81 149 S 7.94 4.09 0.00 4.10 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 0.00 150 S 8.30 4.11 0.00 4.21 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 0.00 151 I 7.91 3.64 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.60 0.89 0.00 0.00 152 E 8.21 3.84 0.00 2.36 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 2.27 2.33 0.00 153 S 7.82 4.02 0.00 4.06 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 0.00 154 T 8.03 3.86 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 155 N 8.57 4.31 0.00 2.76 2.79 0.00 0.00 7.08 7.67 0.00 0.00 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 E 7.80 3.61 0.00 1.20 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 2.12 1.78 0.00 157 A 7.92 4.13 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 0.00 158 V 7.75 3.52 2.20 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 0.97 0.00 0.00 0.98 0.00 0.00 159 V 7.83 3.75 2.19 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 0.99 0.00 0.00 0.90 0.00 0.00 160 K 8.13 4.11 0.00 2.08 2.11 0.00 1.82 0.00 0.00 1.83 0.00 0.00 3.11 0.00 0.00 3.38 0.00 0.00 0.00 0.00 1.79 1.87 7.81 161 L 7.93 4.06 0.00 1.89 1.71 0.93 1.10 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 0.00 162 Q 8.20 3.97 0.00 2.26 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.70 0.00 163 E 8.11 4.02 0.00 2.23 2.01 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 2.34 2.48 0.00 164 T 7.90 3.92 4.41 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 1.21 0.00 0.00 165 A 8.18 3.96 1.32 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 0.00 0.00 0.00 166 E 8.06 3.55 0.00 2.10 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 2.04 0.00 167 K 7.75 4.13 0.00 1.92 1.90 0.00 1.89 0.00 0.00 1.86 0.00 0.00 3.03 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.75 1.67 7.81 168 T 7.50 3.88 4.34 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 1.20 0.00 0.00 169 V 7.57 3.53 1.95 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 1.09 0.00 0.00 0.89 0.00 0.00 170 Y 7.45 4.44 0.00 3.29 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 0.00 171 V 7.96 3.64 2.23 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 1.06 0.00 0.00 1.02 0.00 0.00 172 L 8.27 4.05 0.00 1.76 1.73 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 173 T 8.11 4.08 4.51 0.00 0.00 0.00 0.00 0.00 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 0.00 174 A 7.94 4.19 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 0.00 175 L 7.34 4.59 0.00 1.62 1.69 0.93 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 *454 V 8.00 4.10 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 0.74 0.00 0.00 0.89 0.00 0.00 455 D 9.01 4.80 0.00 2.69 2.53 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 0.00 456 I 7.61 3.60 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 1.65 0.84 0.93 0.00 0.00 457 S 8.19 4.49 0.00 3.86 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 0.00 458 S 8.04 4.15 0.00 3.97 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 0.00 459 Q 8.51 4.05 0.00 2.25 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.80 0.00 0.00 0.00 0.00 0.00 2.50 2.61 0.00 460 I 8.83 3.84 2.00 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 0.92 0.92 0.00 0.00 461 S 8.14 4.15 0.00 3.97 4.03 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 0.00 462 S 8.28 4.18 0.00 3.96 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 0.00 463 M 7.97 3.98 0.00 2.09 2.35 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 2.81 2.74 0.00 464 N 7.86 4.27 0.00 2.95 2.89 0.00 0.00 7.32 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 465 Q 7.92 3.97 0.00 2.26 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.54 0.00 0.00 0.00 0.00 0.00 2.38 2.71 0.00 466 S 8.47 4.13 0.00 4.09 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 0.00 467 L 8.32 4.00 0.00 1.85 1.83 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 468 Q 8.27 3.97 0.00 2.30 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.58 0.00 0.00 0.00 0.00 0.00 2.37 2.64 0.00 469 Q 7.98 3.80 0.00 2.31 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.73 0.00 0.00 0.00 0.00 0.00 2.27 2.47 0.00 470 S 8.09 4.26 0.00 4.06 4.11 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 0.00 471 K 8.30 3.96 0.00 2.06 1.84 0.00 1.72 0.00 0.00 1.65 0.00 0.00 3.08 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.69 7.81 472 D 8.19 4.32 0.00 2.60 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 473 Y 8.41 4.35 0.00 3.17 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 0.00 474 I 8.15 3.79 1.92 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 1.54 1.40 0.97 0.00 0.00 475 K 8.04 4.02 0.00 2.03 1.85 0.00 1.71 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.70 7.81 476 E 8.31 3.96 0.00 2.15 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 0.00 2.39 2.42 0.00 477 A 8.05 3.99 1.47 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 0.00 478 Q 8.48 3.94 0.00 2.21 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.76 0.00 0.00 0.00 0.00 0.00 2.39 2.63 0.00 479 K 7.95 3.90 0.00 1.82 2.10 0.00 1.83 0.00 0.00 1.94 0.00 0.00 3.03 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.49 7.81 480 I 7.95 3.82 2.00 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 1.60 1.03 0.96 0.00 0.00 481 L 8.21 3.70 0.00 1.86 1.85 0.92 1.34 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 0.00 482 D 7.83 4.50 0.00 2.91 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 483 T 8.42 4.12 4.38 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 1.21 0.00 0.00 484 V 7.48 3.92 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.97 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.