NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -2 G 3.8898 8.3501 109.7363 45.3661 0.0000 173.5042 -1 A 3.9433 8.7657 121.5147 55.3202 18.5988 179.0144 0 S 4.5084 8.7373 109.9672 59.5712 63.5074 174.2165 0 D 4.6784 8.7673 114.6672 55.4712 40.8074 175.9165 3 A 4.0027 8.2281 120.8852 55.0542 18.0160 179.7838 4 I 3.6383 7.6370 117.0092 64.4954 37.3699 178.2317 5 K 4.0875 7.9491 117.4463 59.3303 32.0002 178.7977 6 K 4.1395 7.9243 118.1583 59.3205 32.2370 179.4968 7 K 3.9720 7.7433 114.5899 57.1485 32.2561 177.0663 *9 Q 4.0898 7.8660 118.5184 56.0562 30.4975 176.6149 *11 L 4.2702 7.8683 117.8522 54.2587 43.8785 179.1480 12 K 3.9034 8.0298 118.4855 59.5643 32.1996 178.5793 13 L 3.9810 8.3246 119.6359 57.9300 41.5458 179.2643 14 D 4.3422 8.0535 118.1978 57.1872 40.7498 178.4370 15 K 3.8715 8.1953 120.1383 59.8650 32.1920 178.6941 16 E 3.9681 8.3508 118.6552 59.3397 29.3372 179.1514 17 N 4.3318 8.4074 116.5546 56.1479 38.5286 177.3067 18 A 4.0117 8.1122 122.2058 55.1405 18.3883 179.7010 19 L 3.9225 8.1984 117.7208 57.9390 41.7001 179.3853 20 D 4.3325 8.2260 118.8806 57.4160 40.7562 178.8739 21 R 3.8664 8.0930 118.8110 59.3260 29.9945 178.3837 22 A 3.9754 8.1945 120.6414 55.2751 18.4318 179.4685 23 E 3.8780 8.4391 117.4007 59.5443 29.5029 179.4536 24 Q 3.9063 8.2169 119.3592 59.0559 29.1290 178.0337 25 A 3.9957 8.1575 121.8893 55.3087 18.2042 179.4821 26 E 3.9029 8.2880 116.0317 59.3130 29.7594 179.1951 27 A 4.1247 8.0701 120.8179 55.2642 18.4817 179.3861 28 D 4.1117 8.1365 117.4374 57.3136 40.8035 178.9101 29 K 3.8742 8.1169 120.0734 59.6367 32.1188 178.1716 *215 D 4.6694 7.9171 117.5886 54.3758 42.7107 177.4330 216 F 4.2854 8.4691 120.7355 61.7481 39.4483 176.9186 217 Y 4.3524 7.8154 116.3391 60.9083 37.6038 177.9969 218 F 4.2554 8.8539 122.2020 61.3110 39.5523 177.3244 219 G 3.6541 8.6069 105.6231 47.7403 0.0000 175.8061 220 K 3.8886 7.6027 119.4385 59.2793 32.0714 179.4771 221 L 3.8664 7.5679 118.7899 57.6118 41.4521 179.5318 222 R 3.6266 7.6282 118.7380 59.3838 29.9818 178.3546 223 N 4.2704 8.0720 116.1870 56.3960 38.5150 177.4344 224 I 3.6434 8.0544 121.6216 64.2195 37.1123 177.9377 225 E 3.8225 8.6696 120.4380 59.3928 29.3514 178.9254 226 L 3.9876 7.9634 118.8947 57.8183 41.4186 179.6039 227 I 3.6739 7.5852 118.7594 64.6663 37.4776 177.9703 228 C 4.2626 8.2014 117.5578 62.9172 27.4389 176.2740 229 Q 4.0493 8.2399 119.7849 58.8837 28.0615 178.2655 230 E 4.0987 8.2590 119.0860 58.6285 29.6105 177.6943 231 N 4.9166 7.8659 115.7530 53.3203 39.5551 176.5443 232 E 3.9911 7.9340 115.6943 59.0480 29.7926 183.3918 233 G 3.7316 8.2845 109.8601 49.2993 0.0000 175.6502 234 E 4.0613 7.9142 113.7977 56.2575 30.1532 178.1521 235 N 4.1345 7.4530 114.7600 54.8137 36.7763 174.7174 236 D 4.6416 7.5334 117.1861 52.8078 43.4158 174.0308 237 P 4.2209 0.0000 0.0000 65.7332 31.4261 178.9794 238 V 3.5274 7.7545 117.7199 65.9858 31.6642 177.8133 239 L 3.9712 8.0941 118.7444 57.7826 41.3615 179.3041 240 Q 3.9887 8.3257 119.7275 59.2365 29.0668 178.5572 241 R 3.9041 7.8284 118.5921 59.3132 30.0840 179.1775 242 I 3.6440 7.5647 119.3671 64.2334 37.2145 178.5477 243 V 3.2706 8.1336 119.4665 66.1456 31.0953 177.8115 244 D 4.4110 7.9630 117.3596 57.3306 40.7574 178.6356 245 I 3.8267 7.5435 120.1535 64.2776 36.8898 178.2467 246 L 3.8532 7.5065 118.6068 57.5848 41.5005 178.3822 247 Y 4.8596 7.1644 112.3355 56.9041 38.5458 175.9541 248 A 4.2758 7.0245 123.3925 52.2792 19.1832 177.1112 249 T 4.6530 7.9843 113.4937 59.9758 70.5722 173.4793 250 D 4.4947 8.7141 125.5910 54.6096 41.2818 175.7897 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 G 8.35 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 0.00 0.00 0.00 -1 A 8.77 3.94 1.34 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 0.00 0.00 0.00 0 S 8.74 4.51 0.00 3.90 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 D 8.77 4.68 0.00 2.73 2.66 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 0.00 0.00 0.00 0.00 3 A 8.23 4.00 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 4 I 7.64 3.64 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 0.67 0.91 0.00 0.00 5 K 7.95 4.09 0.00 1.87 1.87 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.50 7.81 6 K 7.92 4.14 0.00 1.81 1.97 0.00 1.79 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.42 1.53 7.81 7 K 7.74 3.97 0.00 2.04 1.83 0.00 1.78 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.45 7.81 *9 Q 7.87 4.09 0.00 2.11 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.66 6.49 0.00 0.00 0.00 0.00 0.00 2.32 2.39 0.00 *11 L 7.87 4.27 0.00 1.77 1.74 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 12 K 8.03 3.90 0.00 1.86 1.96 0.00 1.61 0.00 0.00 1.81 0.00 0.00 3.08 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.50 1.59 7.81 13 L 8.32 3.98 0.00 1.68 1.70 0.92 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 14 D 8.05 4.34 0.00 2.87 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 15 K 8.20 3.87 0.00 1.81 2.00 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.49 7.81 16 E 8.35 3.97 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 2.50 2.49 0.00 17 N 8.41 4.33 0.00 2.74 2.86 0.00 0.00 6.84 6.86 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 18 A 8.11 4.01 1.38 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 0.00 0.00 19 L 8.20 3.92 0.00 1.83 1.72 0.92 1.33 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 20 D 8.23 4.33 0.00 2.86 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 21 R 8.09 3.87 0.00 1.96 2.08 0.00 3.10 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 22 A 8.19 3.98 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 23 E 8.44 3.88 0.00 2.13 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 0.00 2.32 2.47 0.00 24 Q 8.22 3.91 0.00 2.25 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.33 2.39 0.00 25 A 8.16 4.00 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 26 E 8.29 3.90 0.00 2.00 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 2.33 2.39 0.00 27 A 8.07 4.12 1.34 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 0.00 0.00 0.00 28 D 8.14 4.11 0.00 2.81 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 K 8.12 3.87 0.00 1.91 2.06 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.83 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.56 7.81 *215 D 7.92 4.67 0.00 3.00 2.82 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 0.00 216 F 8.47 4.29 0.00 2.98 2.96 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 0.00 0.00 0.00 217 Y 7.82 4.35 0.00 3.16 2.89 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 0.00 218 F 8.85 4.26 0.00 3.25 3.28 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 0.00 219 G 8.61 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.60 3.89 0.00 1.90 1.74 0.00 1.49 0.00 0.00 1.47 0.00 0.00 2.13 0.00 0.00 2.46 0.00 0.00 0.00 0.00 1.25 1.35 7.81 221 L 7.57 3.87 0.00 1.61 1.54 0.91 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 222 R 7.63 3.63 0.00 1.20 1.74 0.00 3.20 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 1.56 1.63 0.00 223 N 8.07 4.27 0.00 3.02 2.79 0.00 0.00 7.07 6.93 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 0.00 224 I 8.05 3.64 1.87 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 1.34 0.61 0.82 0.00 0.00 225 E 8.67 3.82 0.00 1.97 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 0.00 2.35 2.40 0.00 226 L 7.96 3.99 0.00 1.87 1.69 0.91 0.65 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 0.00 227 I 7.59 3.67 1.96 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 1.50 0.60 0.88 0.00 0.00 228 C 8.20 4.26 0.00 3.05 2.93 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 0.00 229 Q 8.24 4.05 0.00 2.25 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.74 0.00 0.00 0.00 0.00 0.00 2.43 2.54 0.00 230 E 8.26 4.10 0.00 2.16 2.03 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 2.35 2.52 0.00 231 N 7.87 4.92 0.00 2.82 2.76 0.00 0.00 7.01 7.18 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 0.00 232 E 7.93 3.99 0.00 2.03 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 2.27 2.15 0.00 233 G 8.28 3.73 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 0.00 0.00 0.00 234 E 7.91 4.06 0.00 1.95 1.87 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 2.26 2.15 0.00 235 N 7.45 4.13 0.00 2.79 2.84 0.00 0.00 6.85 7.72 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 0.00 236 D 7.53 4.64 0.00 2.77 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 237 P 0.00 4.22 0.00 2.29 2.29 0.00 3.74 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.01 0.00 238 V 7.75 3.53 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 1.04 0.00 0.00 0.92 0.00 0.00 239 L 8.09 3.97 0.00 1.88 1.68 0.90 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 240 Q 8.33 3.99 0.00 2.24 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.44 0.00 241 R 7.83 3.90 0.00 2.06 1.93 0.00 3.16 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.91 0.00 242 I 7.56 3.64 1.93 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.81 0.81 0.00 0.00 243 V 8.13 3.27 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 1.01 0.00 0.00 0.87 0.00 0.00 244 D 7.96 4.41 0.00 2.82 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 0.00 245 I 7.54 3.83 1.94 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.38 0.85 0.00 0.00 246 L 7.51 3.85 0.00 0.93 1.27 0.63 0.57 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 0.00 247 Y 7.16 4.86 0.00 3.00 2.87 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 0.00 248 A 7.02 4.28 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 0.00 249 T 7.98 4.65 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 1.23 0.00 0.00 250 D 8.71 4.49 0.00 2.69 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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.