NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *151 H 4.6219 8.3033 117.3727 54.5223 29.7474 174.5105 *153 Q 4.3972 9.1549 115.6090 56.5369 30.1548 175.2570 154 K 4.6612 7.3015 116.0758 53.2821 32.7394 172.6165 155 P 4.4963 0.0000 0.0000 62.6163 32.7093 175.9440 156 I 5.1809 8.3691 116.9551 58.8557 41.9652 173.9560 157 V 4.6687 8.8261 121.8389 61.1302 34.6500 174.3459 158 R 4.6237 8.4232 126.8511 55.3670 31.7989 175.5217 159 V 4.7018 8.6712 123.6141 61.1012 34.6380 174.0841 160 F 4.8686 9.1586 127.1379 56.5049 40.4618 175.1028 161 L 5.1930 9.0288 123.1944 51.8494 44.7228 174.5148 162 P 4.2837 0.0000 0.0000 63.7305 32.6895 176.0070 163 N 4.0134 9.2195 116.3857 54.7575 35.5767 174.7976 164 K 3.9384 8.3364 112.7233 57.6526 29.7143 175.7754 165 Q 4.7961 7.5449 118.1991 54.9703 31.3936 174.5047 166 R 4.9785 8.1156 115.0496 56.0362 32.3171 173.8029 167 T 4.6171 8.7112 113.8061 61.0134 71.4989 172.1365 168 V 4.8321 8.2369 124.3892 61.1592 33.9702 174.9956 169 V 4.7370 8.6131 119.8657 58.4937 35.8038 173.2950 170 P 4.6584 0.0000 0.0000 62.8177 31.9477 176.9282 171 A 4.5195 8.3104 126.2783 50.8033 17.0196 176.1844 172 R 4.1975 7.6514 120.5856 54.3494 31.7587 176.6205 173 C 4.1870 7.8839 120.0455 60.7055 28.5443 174.4085 174 G 3.9125 9.1789 111.6308 45.4859 0.0000 173.1960 175 V 4.2698 7.4883 120.7203 60.9224 32.9086 175.6029 176 T 4.6113 8.3011 117.7082 61.5368 70.7518 175.3217 177 V 3.6494 8.3284 121.8926 66.2378 31.5850 178.1828 178 R 4.0453 8.3175 118.3872 60.0340 29.7180 178.2909 179 D 4.4044 8.2230 117.2266 57.4169 40.8646 178.6056 180 S 4.3058 8.3976 115.3519 60.8249 63.1484 175.7091 181 L 4.6108 7.9851 119.2723 54.1065 42.0971 178.0559 182 K 3.7487 7.7578 120.2882 59.7207 32.0967 178.2026 183 K 4.0872 7.9285 115.9867 59.4954 32.2270 178.5843 184 A 4.2741 8.0145 119.0835 54.5762 19.5768 179.0632 185 L 4.2471 7.8566 118.7573 54.6899 38.5473 177.6415 *188 R 4.1448 7.7807 117.4580 54.9539 31.9390 175.8977 189 G 3.9182 8.2157 104.5141 46.6164 0.0000 173.8354 190 L 4.8253 8.0376 118.7669 52.3881 44.4097 176.1251 191 I 4.5991 7.6475 112.4967 58.2168 40.8031 174.5772 192 P 3.2936 0.0000 0.0000 65.5533 31.0320 178.2593 193 E 3.9938 7.7685 115.4708 58.0742 29.6258 176.7894 194 C 4.8472 8.2099 113.8433 57.9639 30.8642 172.9888 195 C 5.5950 8.3750 115.5857 58.5263 32.1883 173.0282 196 A 5.0427 9.5363 122.2929 50.1440 21.8965 175.8208 197 V 4.6461 7.2100 118.4919 60.0261 34.7929 174.1284 198 Y 5.2107 9.1488 119.6212 56.4971 43.0071 174.6188 199 R 5.0033 9.1179 118.6897 54.9873 32.9237 174.6033 200 I 4.6333 8.1027 121.0164 60.8716 39.3415 176.9990 201 Q 3.7401 8.8182 127.3929 56.4734 25.2022 171.2370 *205 K 3.9690 7.7269 115.7853 55.2998 33.5399 178.6427 206 K 4.8454 7.9316 121.0586 54.2192 34.6620 175.6480 207 P 4.7935 0.0000 0.0000 62.6335 32.1226 175.6828 208 I 4.5862 8.0690 115.5023 58.7193 40.8130 175.4824 209 G 3.7377 8.3763 112.0255 45.0278 0.0000 175.0760 210 W 4.1979 8.7049 121.6720 59.3049 29.2936 177.4649 211 D 4.7713 8.0912 115.4993 54.2227 40.9479 176.5553 212 T 3.8398 7.5668 117.2692 63.9888 69.1659 172.7941 213 D 4.8448 8.7788 124.8019 53.7759 41.6603 176.7322 214 I 3.8274 8.8273 128.3184 64.1180 37.4464 177.8266 215 S 4.2125 8.5511 115.1578 60.9574 62.4753 176.3363 216 W 4.3565 7.8572 121.1276 58.4625 28.9329 176.6288 217 L 4.6501 7.8107 117.7273 54.2015 41.7285 176.1433 218 T 4.0720 7.2269 115.7025 65.7381 68.6907 173.8478 219 G 4.0238 9.0132 114.9305 45.2729 0.0000 173.4784 220 E 4.4474 8.2998 119.3362 56.0048 31.7550 175.2964 221 E 5.0777 8.7060 119.7857 54.9445 32.0143 175.6499 222 L 5.2253 8.9469 124.1798 53.5310 45.1985 175.1014 223 H 5.4451 9.6852 117.4348 54.1516 32.8636 172.7031 224 V 4.9906 8.9081 122.3074 61.2451 33.6162 174.5571 225 E 4.9703 9.3000 126.9382 54.3022 33.1980 175.5762 226 V 4.2519 8.4428 122.7484 62.6459 32.3573 175.8717 227 L 4.3317 9.0757 127.9932 54.4370 42.3126 177.0754 228 E 3.9224 8.8574 121.1093 57.1498 29.8448 177.4980 229 N 4.6416 8.4903 121.7741 52.3024 37.7111 173.3421 230 V 4.4631 7.6938 121.8927 59.5215 34.7970 173.5603 231 P 4.3366 0.0000 0.0000 62.8318 31.7549 176.2524 232 L 4.3900 8.1358 121.5204 54.0606 42.7668 177.2448 233 T 4.0596 8.2840 115.5737 64.1386 68.3468 174.6909 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 *151 H 8.30 4.62 0.00 2.85 2.22 0.00 7.18 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *153 Q 9.15 4.40 0.00 2.03 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 7.17 0.00 0.00 0.00 0.00 0.00 2.25 2.44 0.00 154 K 7.30 4.66 0.00 1.70 1.68 0.00 1.69 0.00 0.00 1.75 0.00 0.00 2.92 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.34 1.34 7.81 155 P 0.00 4.50 0.00 2.07 2.16 0.00 3.61 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.93 0.00 156 I 8.37 5.18 1.85 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 1.22 0.62 0.90 0.00 0.00 157 V 8.83 4.67 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 1.14 0.00 0.00 1.00 0.00 0.00 158 R 8.42 4.62 0.00 1.74 1.60 0.00 3.12 0.00 0.00 3.09 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.54 0.00 159 V 8.67 4.70 2.12 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 1.10 0.00 0.00 0.93 0.00 0.00 160 F 9.16 4.87 0.00 2.90 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 0.00 161 L 9.03 5.19 0.00 1.50 1.61 0.93 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 162 P 0.00 4.28 0.00 2.12 2.05 0.00 3.79 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.23 0.00 163 N 9.22 4.01 0.00 2.91 2.96 0.00 0.00 7.00 7.61 0.00 0.00 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 8.34 3.94 0.00 1.95 1.96 0.00 1.78 0.00 0.00 1.74 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.37 1.41 7.81 165 Q 7.54 4.80 0.00 2.16 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.61 0.00 0.00 0.00 0.00 0.00 2.32 2.48 0.00 166 R 8.12 4.98 0.00 1.41 1.60 0.00 2.99 0.00 0.00 3.00 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.53 0.00 167 T 8.71 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 V 8.24 4.83 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 0.88 0.00 0.00 0.86 0.00 0.00 169 V 8.61 4.74 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 0.72 0.00 0.00 1.00 0.00 0.00 170 P 0.00 4.66 0.00 2.06 2.04 0.00 3.75 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 1.98 1.97 0.00 171 A 8.31 4.52 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 0.00 172 R 7.65 4.20 0.00 1.88 1.84 0.00 3.13 0.00 0.00 3.33 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.63 0.00 173 C 7.88 4.19 0.00 2.90 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 0.00 174 G 9.18 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 175 V 7.49 4.27 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 1.11 0.00 0.00 0.94 0.00 0.00 176 T 8.30 4.61 4.55 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 1.34 0.00 0.00 177 V 8.33 3.65 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.99 0.00 0.00 178 R 8.32 4.05 0.00 2.28 2.00 0.00 3.11 0.00 0.00 3.03 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.34 0.00 179 D 8.22 4.40 0.00 2.72 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 0.00 180 S 8.40 4.31 0.00 4.07 3.98 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 0.00 0.00 0.00 181 L 7.99 4.61 0.00 2.02 1.82 1.11 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 182 K 7.76 3.75 0.00 1.93 1.86 0.00 1.77 0.00 0.00 1.66 0.00 0.00 3.05 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.45 7.81 183 K 7.93 4.09 0.00 1.77 1.85 0.00 1.82 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.50 7.81 184 A 8.01 4.27 1.36 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 0.00 0.00 0.00 185 L 7.86 4.25 0.00 2.01 1.81 1.02 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 *188 R 7.78 4.14 0.00 1.96 2.02 0.00 3.52 0.00 0.00 3.26 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.65 0.00 189 G 8.22 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 0.00 0.00 0.00 190 L 8.04 4.83 0.00 1.71 1.59 0.97 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 191 I 7.65 4.60 1.94 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.78 0.85 0.00 0.00 192 P 0.00 3.29 0.00 1.24 0.49 0.00 3.32 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.57 0.00 193 E 7.77 3.99 0.00 1.83 1.93 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 2.22 2.21 0.00 194 C 8.21 4.85 0.00 2.96 3.09 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 0.00 0.00 0.00 195 C 8.38 5.59 0.00 3.17 3.24 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 0.00 196 A 9.54 5.04 1.06 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 0.00 197 V 7.21 4.65 1.06 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 -0.64 0.00 0.00 0.68 0.00 0.00 198 Y 9.15 5.21 0.00 2.80 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 0.00 199 R 9.12 5.00 0.00 1.87 2.08 0.00 2.72 0.00 0.00 3.18 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.61 0.00 200 I 8.10 4.63 1.91 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.48 0.92 0.00 0.00 201 Q 8.82 3.74 0.00 2.20 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.85 7.31 0.00 0.00 0.00 0.00 0.00 2.13 1.89 0.00 *205 K 7.73 3.97 0.00 1.79 1.74 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.73 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.26 1.04 7.81 206 K 7.93 4.85 0.00 1.72 1.76 0.00 1.66 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.35 1.50 7.81 207 P 0.00 4.79 0.00 1.95 2.02 0.00 3.77 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.02 0.00 208 I 8.07 4.59 1.76 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.40 0.91 0.00 0.00 209 G 8.38 3.74 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 0.00 0.00 0.00 210 W 8.70 4.20 0.00 3.43 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 0.00 211 D 8.09 4.77 0.00 2.72 2.75 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 0.00 0.00 0.00 0.00 212 T 7.57 3.84 4.26 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 1.26 0.00 0.00 213 D 8.78 4.84 0.00 2.89 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 0.00 214 I 8.83 3.83 1.93 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.22 1.02 0.00 0.00 215 S 8.55 4.21 0.00 3.83 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 0.00 216 W 7.86 4.36 0.00 3.42 3.36 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 0.00 217 L 7.81 4.65 0.00 1.86 1.70 0.95 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 218 T 7.23 4.07 4.22 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 1.19 0.00 0.00 219 G 9.01 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 0.00 0.00 0.00 220 E 8.30 4.45 0.00 2.07 1.94 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 2.36 2.52 0.00 221 E 8.71 5.08 0.00 2.06 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 2.49 2.43 0.00 222 L 8.95 5.23 0.00 1.60 1.56 0.92 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 223 H 9.69 5.45 0.00 3.09 3.25 0.00 5.56 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 V 8.91 4.99 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 1.03 0.00 0.00 1.08 0.00 0.00 225 E 9.30 4.97 0.00 2.20 1.93 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 2.30 2.38 0.00 226 V 8.44 4.25 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 0.86 0.00 0.00 0.99 0.00 0.00 227 L 9.08 4.33 0.00 1.63 1.64 0.98 1.01 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 0.00 228 E 8.86 3.92 0.00 1.98 1.93 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 2.36 2.29 0.00 229 N 8.49 4.64 0.00 2.70 2.77 0.00 0.00 6.75 7.71 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 0.00 230 V 7.69 4.46 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 0.91 0.00 0.00 0.95 0.00 0.00 231 P 0.00 4.34 0.00 2.08 1.98 0.00 3.73 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.12 0.00 232 L 8.14 4.39 0.00 1.64 1.60 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 233 T 8.28 4.06 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 * Residues marked with a * may have inaccurate shift predictions.