NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *-2 H 4.6900 8.3027 117.3723 54.3704 30.6918 174.5035 -1 M 3.7088 8.0594 117.6832 59.2962 32.3157 175.0494 *140 E 4.2768 8.3653 114.2147 56.7087 33.0399 179.8185 141 Q 4.2858 7.8265 124.2096 60.8362 28.1800 181.6209 142 R 4.2178 8.1171 124.2325 62.2596 29.4122 181.5146 143 I 3.9079 7.7185 122.3465 65.8751 35.4053 180.0269 144 L 4.3729 7.6232 125.2596 59.8309 40.9272 181.8918 145 K 4.2546 8.1966 126.4475 60.9332 32.0466 182.2754 *146 F 4.7031 7.9954 124.3316 57.7668 39.1698 178.6301 *156 T 4.3857 7.8680 111.8503 63.8709 68.2769 172.6445 157 T 5.2132 7.9849 121.4204 61.1013 73.2564 175.2752 158 A 3.8503 8.6001 125.0243 55.7150 18.3070 179.4832 159 H 4.0531 8.3600 114.9935 59.7454 28.5594 176.3356 160 D 4.3427 7.9912 118.4096 56.3951 41.0798 177.4817 161 L 4.1985 7.8984 118.9806 56.9157 41.7188 179.0225 162 S 4.8806 7.4073 116.5126 60.2913 62.1273 176.5992 163 G 3.5822 7.8190 108.0570 47.1475 0.0000 175.8079 164 K 3.9410 7.1874 118.6013 58.4507 32.1450 177.8474 165 L 4.4924 7.5269 115.3674 53.5523 42.9426 176.5285 166 G 4.0640 7.6281 105.4393 46.8125 0.0000 173.6166 167 T 4.6151 7.5419 114.8521 60.1823 71.3377 172.3859 168 P 4.4754 0.0000 0.0000 62.7676 32.3276 177.0643 169 K 3.8071 9.0022 123.2951 59.7082 32.1176 178.5436 170 K 3.8054 8.1056 119.1477 60.0143 31.8788 177.6002 171 E 3.9303 8.0258 119.0157 59.3222 29.3981 179.1170 172 I 3.6499 7.4713 119.2493 64.4434 37.4616 177.9559 173 N 4.2320 8.5567 117.3120 55.7016 38.2124 177.5804 174 R 3.8539 7.7185 120.4881 59.5449 30.3598 178.6576 175 V 3.7126 7.5147 117.5526 65.8023 31.3570 177.1670 176 L 3.8011 8.0242 119.9823 57.1521 41.3941 178.3373 177 Y 4.1437 8.2135 115.9784 61.4906 37.8475 179.1575 178 S 4.1190 7.9611 112.9391 61.5189 62.9903 175.7275 179 L 4.0787 7.9012 122.6961 58.1456 41.8590 178.7876 180 A 4.2775 8.4352 120.8002 54.6650 18.0878 179.3411 181 K 4.1203 7.8316 117.1041 58.7661 32.6733 178.1077 182 K 4.3947 7.8720 117.6395 55.9372 31.8720 178.5883 183 G 4.1143 7.8001 107.1947 45.7574 0.0000 175.1486 184 K 4.1930 7.6808 118.2207 58.1676 33.4540 176.7540 185 L 4.8980 7.6607 120.3986 53.8509 45.1507 175.5273 186 Q 4.4491 8.3137 119.8939 54.9320 32.7071 172.8987 187 K 3.5814 8.4983 128.9335 55.6578 33.0085 175.6425 188 E 4.1564 8.4215 128.8487 55.3174 31.3214 175.4522 189 A 4.3121 8.3304 128.3520 50.5541 17.0770 176.3263 190 G 4.0060 7.7088 110.3151 43.3513 0.0000 170.8687 191 T 4.3899 7.9541 112.6528 59.1904 67.8877 171.6727 192 P 4.5742 0.0000 0.0000 61.0292 32.4308 174.5694 193 P 4.4078 0.0000 0.0000 63.5743 31.8169 175.8356 194 L 4.9927 8.0635 121.9413 53.2591 44.7667 175.3001 195 W 5.6559 8.4786 119.2623 55.6090 33.3343 174.8512 196 K 4.4278 8.3625 116.8735 55.8731 35.7342 174.4502 197 I 4.0284 8.7027 124.0624 61.6869 37.6365 175.5153 198 A 4.1156 8.4965 130.5384 51.5430 18.7727 177.5658 199 V 3.7209 8.3516 121.6101 63.3490 31.6878 175.6757 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 *-2 H 8.30 4.69 0.00 2.85 3.14 0.00 7.18 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 -1 M 8.06 3.71 0.00 2.13 2.07 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.70 0.00 *140 E 8.37 4.28 0.00 2.05 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 2.13 1.88 0.00 141 Q 7.83 4.29 0.00 2.01 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 6.78 0.00 0.00 0.00 0.00 0.00 2.30 2.26 0.00 142 R 8.12 4.22 0.00 1.81 1.97 0.00 3.26 0.00 0.00 3.37 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.27 0.00 143 I 7.72 3.91 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 1.38 1.09 0.91 0.00 0.00 144 L 7.62 4.37 0.00 1.72 1.58 0.92 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 145 K 8.20 4.25 0.00 1.84 1.79 0.00 1.78 0.00 0.00 1.74 0.00 0.00 2.99 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.10 7.81 *146 F 8.00 4.70 0.00 2.41 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 0.00 0.00 0.00 *156 T 7.87 4.39 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 157 T 7.98 5.21 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 1.44 0.00 0.00 158 A 8.60 3.85 1.26 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 0.00 0.00 0.00 159 H 8.36 4.05 0.00 3.16 3.43 0.00 5.93 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 D 7.99 4.34 0.00 2.87 2.86 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 0.00 0.00 0.00 161 L 7.90 4.20 0.00 1.77 1.62 0.88 0.85 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 0.00 162 S 7.41 4.88 0.00 3.96 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 0.00 163 G 7.82 3.58 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 0.00 0.00 0.00 164 K 7.19 3.94 0.00 1.73 1.89 0.00 1.67 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.68 1.56 7.81 165 L 7.53 4.49 0.00 1.67 1.65 0.89 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 166 G 7.63 4.06 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 0.00 0.00 0.00 167 T 7.54 4.62 4.21 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 1.19 0.00 0.00 168 P 0.00 4.48 0.00 2.16 1.98 0.00 3.60 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.08 0.00 169 K 9.00 3.81 0.00 1.84 1.83 0.00 1.84 0.00 0.00 1.82 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.55 1.54 7.81 170 K 8.11 3.81 0.00 1.85 1.82 0.00 1.78 0.00 0.00 1.74 0.00 0.00 2.90 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.51 1.53 7.81 171 E 8.03 3.93 0.00 2.05 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 2.29 2.49 0.00 172 I 7.47 3.65 1.92 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.64 0.73 0.00 0.00 173 N 8.56 4.23 0.00 2.93 2.98 0.00 0.00 6.73 7.66 0.00 0.00 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 7.72 3.85 0.00 2.06 2.10 0.00 3.08 0.00 0.00 3.08 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.62 0.00 175 V 7.51 3.71 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 0.93 0.00 0.00 0.97 0.00 0.00 176 L 8.02 3.80 0.00 1.00 0.13 -0.86 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 177 Y 8.21 4.14 0.00 3.18 3.12 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 0.00 0.00 0.00 178 S 7.96 4.12 0.00 3.91 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 0.00 179 L 7.90 4.08 0.00 2.04 1.76 0.92 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 180 A 8.44 4.28 1.43 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 0.00 0.00 0.00 181 K 7.83 4.12 0.00 2.06 2.08 0.00 1.84 0.00 0.00 1.77 0.00 0.00 3.06 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.49 1.52 7.81 182 K 7.87 4.39 0.00 2.09 1.81 0.00 1.80 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.67 7.81 183 G 7.80 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 0.00 184 K 7.68 4.19 0.00 1.81 1.87 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.82 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.58 7.81 185 L 7.66 4.90 0.00 1.69 1.69 0.97 0.83 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 0.00 186 Q 8.31 4.45 0.00 2.15 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.76 0.00 0.00 0.00 0.00 0.00 2.20 2.25 0.00 187 K 8.50 3.58 0.00 1.12 1.24 0.00 1.15 0.00 0.00 0.90 0.00 0.00 2.45 0.00 0.00 2.53 0.00 0.00 0.00 0.00 0.44 0.21 7.81 188 E 8.42 4.16 0.00 1.96 1.59 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 2.19 2.21 0.00 189 A 8.33 4.31 1.17 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 0.00 0.00 190 G 7.71 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 191 T 7.95 4.39 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 0.00 192 P 0.00 4.57 0.00 2.33 2.10 0.00 3.87 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 2.06 2.03 0.00 193 P 0.00 4.41 0.00 2.00 1.74 0.00 3.77 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.14 0.00 194 L 8.06 4.99 0.00 1.51 1.55 0.89 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 195 W 8.48 5.66 0.00 3.10 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 0.00 196 K 8.36 4.43 0.00 1.93 1.88 0.00 1.32 0.00 0.00 1.64 0.00 0.00 2.90 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.25 1.35 7.81 197 I 8.70 4.03 1.89 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 1.30 0.82 0.92 0.00 0.00 198 A 8.50 4.12 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 0.00 199 V 8.35 3.72 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 0.79 0.00 0.00 0.94 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.