NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 168 K 4.1588 8.3144 120.1371 56.6091 33.3802 175.3820 169 H 4.4731 8.5222 122.4201 54.0665 28.9840 172.6887 170 L 4.1774 8.3467 127.4759 53.7634 42.8703 176.6846 171 D 4.4844 9.0511 124.0150 54.5368 42.0651 177.5479 172 D 4.5784 8.4484 124.8629 57.5175 41.1838 179.2480 173 D 4.7481 8.0829 117.1466 54.8302 39.7635 177.3596 174 E 4.2954 8.9155 119.6209 57.0815 30.1513 175.5567 175 D 4.6731 7.7429 119.3895 53.0707 41.7106 176.4827 176 R 3.0294 8.3411 126.0560 58.4778 30.3844 176.7275 177 K 4.3517 7.4468 117.0590 56.1791 32.3731 176.4429 178 N 4.9505 7.7121 116.4551 51.3269 41.9103 172.3259 179 P 4.3708 0.0000 0.0000 65.0490 31.8155 177.1960 180 A 4.4870 8.6683 122.4328 52.6405 18.1019 176.1072 181 Y 4.4642 7.5758 120.0423 58.9773 39.6531 175.9527 182 I 4.2983 7.0822 126.2229 58.0805 38.7247 172.5960 183 P 4.0309 0.0000 0.0000 63.3162 31.3725 174.8692 184 R 3.8943 8.6770 123.4081 58.2941 32.2833 178.1088 185 K 4.1440 7.7536 121.4237 53.7386 29.5483 177.7795 186 G 3.8822 7.0751 110.9840 44.0912 0.0000 172.3329 187 L 4.0486 8.5746 120.9784 56.9238 41.9518 178.9584 188 F 4.3991 7.8840 113.3452 59.7288 38.0511 176.3318 189 F 4.4931 6.7663 123.7126 58.2272 36.8114 174.8130 190 E 4.2710 7.6374 127.6586 54.8254 28.1876 175.8759 191 H 4.8264 6.9801 115.4493 53.4486 33.1383 173.2316 192 D 4.4846 8.5796 122.5836 53.8752 41.7260 175.4155 193 L 4.7647 8.4640 125.6788 53.3262 44.0303 176.4007 194 R 4.4748 8.8030 121.6259 55.7060 31.4031 176.0985 195 G 4.1533 7.9476 107.4188 43.4736 0.0000 172.9069 196 Q 4.4726 8.4342 123.1982 54.5262 31.2941 175.4257 *215 E 4.1056 8.4965 113.9209 55.7421 31.0429 176.9266 216 G 3.8977 8.8799 113.8969 47.2961 0.0000 175.6564 217 R 4.6856 7.5194 119.6978 56.2758 30.6450 175.3774 218 W 3.5208 8.4962 111.0287 57.5503 26.0571 173.5816 219 E 4.6030 7.8691 118.8223 54.9709 31.7061 176.5675 220 H 4.7031 8.3909 119.6633 55.3231 27.9809 175.5944 221 D 4.5031 7.9226 123.5048 56.6322 40.2119 179.0504 222 K 4.2555 8.0326 115.3635 56.2577 31.8294 176.1276 223 F 4.6618 7.8510 122.9271 56.7847 39.7597 175.1862 224 R 4.2614 7.6778 126.6216 53.9487 32.7738 176.4092 225 E 3.5972 8.2973 122.8856 58.3600 30.0941 177.2826 226 D 4.5030 8.0245 118.3614 57.3096 40.9961 178.8499 227 E 4.6592 7.4263 115.5371 56.0962 29.7458 176.3255 228 Q 4.4318 7.7389 113.3015 56.3330 31.7683 175.5107 229 A 4.4397 7.7275 120.8773 50.2459 19.8382 175.6818 230 P 4.3549 0.0000 0.0000 62.7978 31.9796 177.5812 231 K 3.9371 8.5212 121.9039 54.8406 32.2473 178.4042 232 S 4.3318 8.7871 120.0395 58.2259 64.2251 175.7672 233 R 4.0608 8.8969 131.8940 62.5976 29.0058 178.9973 234 Q 4.2369 8.1686 122.9089 60.7499 28.3839 180.7489 235 E 4.2019 8.3451 122.3800 61.6192 29.2332 181.7469 236 L 4.4173 8.5874 126.2063 60.1877 40.8326 182.0553 237 I 4.2013 8.0388 119.5420 64.0525 35.3494 179.8660 238 A 4.3370 8.2489 120.2878 55.3041 18.4871 178.8468 239 L 4.2460 7.2208 114.0505 55.9809 40.9314 176.3960 240 Y 4.6779 7.4699 116.1959 58.2344 39.9832 176.2683 241 G 4.1058 7.9211 108.8066 42.9395 0.0000 171.1376 242 Y 4.7384 7.4160 121.2613 56.0170 41.0173 175.3595 243 D 4.4681 8.8035 123.0260 54.8636 39.2049 177.0663 244 I 3.2155 7.5334 122.0994 61.8532 35.5991 176.6749 245 R 4.1924 7.2492 115.5659 57.1520 29.7745 177.1507 246 S 4.4373 8.3275 107.9214 58.4913 64.4171 175.4968 247 A 3.6160 8.5824 135.0000 54.0943 15.4825 177.9552 *248 H 4.2309 8.2986 121.7759 55.5028 27.8533 177.0176 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 168 K 8.31 4.16 0.00 1.78 1.83 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.45 7.81 169 H 8.52 4.47 0.00 3.13 3.27 0.00 5.92 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 L 8.35 4.18 0.00 1.67 1.62 0.94 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 171 D 9.05 4.48 0.00 2.77 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 0.00 172 D 8.45 4.58 0.00 2.77 2.69 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 0.00 173 D 8.08 4.75 0.00 2.82 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 0.00 174 E 8.92 4.30 0.00 2.05 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 2.30 2.23 0.00 175 D 7.74 4.67 0.00 2.60 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 R 8.34 3.03 0.00 1.61 1.57 0.00 3.18 0.00 0.00 3.08 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 1.47 0.00 177 K 7.45 4.35 0.00 2.05 1.78 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.45 1.24 7.81 178 N 7.71 4.95 0.00 2.80 2.95 0.00 0.00 7.25 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 0.00 179 P 0.00 4.37 0.00 2.28 2.30 0.00 3.75 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.97 0.00 180 A 8.67 4.49 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.58 4.46 0.00 3.21 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 0.00 182 I 7.08 4.30 1.68 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 1.17 0.70 0.85 0.00 0.00 183 P 0.00 4.03 0.00 2.05 2.23 0.00 3.54 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.43 0.00 184 R 8.68 3.89 0.00 1.38 1.09 0.00 2.91 0.00 0.00 2.51 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 1.40 0.00 185 K 7.75 4.14 0.00 1.77 1.65 0.00 1.84 0.00 0.00 1.71 0.00 0.00 2.87 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.36 1.02 7.81 186 G 7.08 3.88 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 0.00 0.00 0.00 187 L 8.57 4.05 0.00 1.68 1.77 0.94 0.84 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 0.00 188 F 7.88 4.40 0.00 3.16 3.23 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 0.00 0.00 0.00 0.00 189 F 6.77 4.49 0.00 2.68 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 0.00 190 E 7.64 4.27 0.00 1.84 1.79 0.00 0.00 0.00 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 2.47 0.00 191 H 6.98 4.83 0.00 1.92 2.80 0.00 5.70 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 D 8.58 4.48 0.00 2.62 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.46 4.76 0.00 1.65 1.60 1.05 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 194 R 8.80 4.47 0.00 1.78 1.95 0.00 3.17 0.00 0.00 3.23 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 195 G 7.95 4.15 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 Q 8.43 4.47 0.00 2.14 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 6.47 0.00 0.00 0.00 0.00 0.00 2.22 2.26 0.00 *215 E 8.50 4.11 0.00 2.04 1.84 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 2.13 1.89 0.00 216 G 8.88 3.90 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 0.00 0.00 0.00 217 R 7.52 4.69 0.00 1.68 1.89 0.00 3.40 0.00 0.00 3.25 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.65 0.00 218 W 8.50 3.52 0.00 3.28 3.18 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 0.00 219 E 7.87 4.60 0.00 1.97 1.89 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 2.28 2.35 0.00 220 H 8.39 4.70 0.00 3.18 3.26 0.00 5.70 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 0.00 221 D 7.92 4.50 0.00 2.88 2.94 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 0.00 222 K 8.03 4.26 0.00 1.80 1.90 0.00 1.73 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.42 7.81 223 F 7.85 4.66 0.00 2.95 3.15 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 0.00 0.00 0.00 0.00 224 R 7.68 4.26 0.00 1.89 1.57 0.00 3.30 0.00 0.00 3.21 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.49 0.00 225 E 8.30 3.60 0.00 1.82 1.89 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 2.30 2.38 0.00 226 D 8.02 4.50 0.00 2.60 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 0.00 227 E 7.43 4.66 0.00 1.96 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 2.23 2.33 0.00 228 Q 7.74 4.43 0.00 1.96 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.03 0.00 0.00 0.00 0.00 0.00 2.19 2.02 0.00 229 A 7.73 4.44 1.23 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 0.00 0.00 0.00 0.00 0.00 0.00 230 P 0.00 4.35 0.00 2.05 2.01 0.00 3.71 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 231 K 8.52 3.94 0.00 1.77 1.63 0.00 1.82 0.00 0.00 1.63 0.00 0.00 2.88 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.36 1.01 7.81 232 S 8.79 4.33 0.00 3.88 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 233 R 8.90 4.06 0.00 1.85 1.95 0.00 3.31 0.00 0.00 3.37 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.29 0.00 234 Q 8.17 4.24 0.00 2.05 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.82 6.82 0.00 0.00 0.00 0.00 0.00 2.36 2.00 0.00 235 E 8.35 4.20 0.00 1.96 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 2.32 1.96 0.00 236 L 8.59 4.42 0.00 1.59 1.71 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 237 I 8.04 4.20 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 1.45 1.10 0.91 0.00 0.00 238 A 8.25 4.34 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 0.00 239 L 7.22 4.25 0.00 1.41 1.53 0.47 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 240 Y 7.47 4.68 0.00 2.81 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 241 G 7.92 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 0.00 0.00 0.00 242 Y 7.42 4.74 0.00 3.09 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 0.00 243 D 8.80 4.47 0.00 2.75 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 0.00 244 I 7.53 3.22 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 1.41 0.80 0.91 0.00 0.00 245 R 7.25 4.19 0.00 2.04 1.97 0.00 3.15 0.00 0.00 3.26 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.50 0.00 246 S 8.33 4.44 0.00 3.96 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 0.00 247 A 8.58 3.62 1.51 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 0.00 0.00 *248 H 8.30 4.23 0.00 2.94 2.90 0.00 7.24 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 * Residues marked with a * may have inaccurate shift predictions.