NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3329 8.2493 123.5834 51.7176 20.9938 177.6819 2 T 3.8706 7.6392 108.3943 60.4083 70.8105 173.6346 3 L 3.9914 8.7782 125.8424 58.7134 42.4035 181.4633 4 K 4.0891 7.9760 123.5162 59.6534 31.6732 182.7378 5 E 4.2022 8.0674 119.5292 59.3974 29.1619 179.6791 6 V 3.9031 8.0260 120.0520 66.1448 31.5318 178.1861 7 E 4.2523 8.4222 120.9012 62.0117 29.5582 184.4691 8 M 4.2641 7.9978 121.0342 59.6706 31.3459 180.4790 9 R 4.1741 8.4937 118.6783 57.5185 30.0380 177.1799 10 L 4.2253 7.6251 120.9995 57.1741 42.5216 178.7372 11 K 4.2272 7.8191 124.1563 59.4421 31.6856 184.4648 12 S 4.2493 8.2970 115.5513 61.7162 63.1477 176.8748 13 I 3.6976 7.3112 126.8139 63.4889 36.7192 179.4643 14 K 3.9988 7.4749 127.7611 60.6212 31.6660 184.4364 15 N 4.6584 8.2917 120.9067 56.9768 37.2220 179.3105 16 I 3.9290 7.9609 120.8092 64.6041 37.0185 178.0447 17 E 4.0318 8.1866 122.1531 59.5153 29.3708 179.2147 18 K 4.0300 7.8839 124.1642 60.0155 31.7172 182.9295 19 I 4.0276 8.0586 121.8985 63.6858 37.2104 178.7481 20 T 3.8659 7.8897 112.8186 64.7922 68.4951 177.4668 21 K 4.1405 7.8762 126.7393 59.2522 31.5553 183.9043 22 T 4.0663 7.9514 115.3322 67.2802 68.3008 176.1022 23 M 4.0237 8.5840 120.6491 58.7565 30.5131 178.1692 24 K 3.9120 7.8942 118.9699 59.2795 32.4944 178.2358 25 I 4.1268 7.3678 119.4557 61.2345 37.6555 177.9309 26 V 3.5924 8.6698 121.0889 65.5301 31.0620 176.7238 27 A 4.4313 7.6958 118.0118 52.4590 18.9064 178.4777 28 S 4.4379 7.3459 114.2889 60.7104 63.1681 176.3822 29 T 4.0890 7.9482 112.1671 63.8506 69.1154 176.3667 30 R 4.2807 7.7381 121.9573 58.0706 30.2713 177.9387 31 L 4.2783 7.3220 121.3302 58.5018 40.6882 184.1353 32 S 4.6028 7.8185 116.3747 62.0414 63.5125 177.0966 33 K 4.7160 7.5396 120.8468 53.9444 31.7285 178.3358 34 A 4.9651 7.8949 126.0693 53.7107 25.9694 180.0575 35 E 4.2377 8.4787 118.0840 61.5385 29.6129 182.0922 36 K 4.3573 8.0398 122.6058 59.2990 31.6047 182.4013 37 A 4.4769 7.5525 120.2656 55.2788 18.5726 179.8076 38 K 4.2296 8.0035 120.8615 58.8638 32.2643 182.7775 39 I 4.4435 7.4579 118.2258 63.0084 37.3530 177.0793 40 S 4.8281 7.5000 113.0471 57.2271 65.3014 178.8099 41 A 4.6500 8.2067 122.7679 53.8235 21.1808 178.3648 *136 D 4.4944 9.1507 114.2231 53.6714 42.8811 174.8610 137 A 3.8732 8.0346 122.3873 50.8257 21.9210 175.4254 138 P 4.4147 0.0000 0.0000 61.3979 30.2649 175.4205 139 T 4.5500 7.4057 118.4702 61.7313 72.4040 176.4535 *140 F 4.1161 8.5409 126.7979 62.5264 37.8694 178.7054 141 Q 4.2676 8.1266 122.1445 61.0647 27.7706 182.3904 142 E 4.2242 7.5244 119.2520 60.7457 29.8738 180.7785 143 S 4.3946 8.0953 112.8043 61.5866 62.4874 175.5424 144 A 4.0996 8.2552 125.2770 55.7004 18.9893 179.7460 145 L 4.1976 7.3871 117.4126 54.3298 40.1935 180.2641 *213 T 4.3266 7.6810 115.0389 63.4208 70.6958 176.5509 214 L 3.9424 7.8774 124.2432 58.2141 42.0229 178.0077 215 A 4.4769 7.6801 116.6318 52.5179 18.4913 177.3070 216 N 4.7575 7.7331 118.3190 55.6361 41.0020 176.4534 217 Q 4.1759 8.3570 119.2003 58.6277 28.6918 178.4075 218 M 4.0841 7.8364 120.4866 58.0850 32.0929 178.0567 219 L 3.7523 8.0108 120.0781 58.8494 41.9735 179.1296 220 T 4.0081 7.6080 113.5728 66.0302 68.3679 176.7705 221 A 4.0879 7.8493 122.7681 55.1777 18.5736 179.5682 222 M 4.0957 8.9753 118.0828 58.2010 31.8708 178.5989 223 A 4.2209 8.0247 120.4717 54.5674 18.7082 179.6593 224 Q 4.0890 8.0169 117.3312 58.8932 28.7392 178.9575 225 G 3.6249 8.1824 106.8453 47.7576 0.0000 175.2207 226 Y 4.0450 8.3812 122.2991 60.4047 38.7309 178.2293 227 A 4.0274 8.0805 121.6418 54.9159 18.5129 179.4574 228 A 3.9845 7.7184 120.8268 54.6535 18.6067 179.3582 229 E 3.8013 8.5058 118.2099 59.6706 29.3469 179.1698 230 I 3.6259 7.2547 119.6876 64.2140 36.8538 178.5603 231 S 4.1462 7.8304 114.5904 61.1944 63.0590 176.3799 232 A 4.1189 8.2232 124.2560 54.2958 18.1014 179.7089 233 R 3.8410 7.9816 119.8467 60.2883 30.0719 179.3890 234 R 4.2193 7.4834 117.7233 60.1390 29.3699 179.1913 235 N 4.7558 7.5756 113.8379 56.5699 39.4711 176.7468 236 A 4.0004 8.4414 122.5009 55.6467 18.4650 179.6649 237 M 4.0345 8.5719 117.2948 58.2870 31.5309 178.4004 238 D 4.3962 8.0337 117.7893 56.8408 41.5225 177.7106 239 N 4.4665 7.8783 117.0261 55.8597 38.5994 177.2673 240 A 4.0401 8.2063 122.6469 55.0464 18.3709 179.8569 241 S 4.1393 8.1175 115.2873 62.0335 62.6414 177.5394 242 K 4.0166 7.7852 126.1072 59.4883 31.3842 181.9295 243 N 4.5525 8.0842 116.6094 56.4288 38.5401 177.5007 244 A 4.1273 8.3240 122.5088 54.9927 18.3721 179.8331 245 G 3.7630 8.4843 104.6605 47.9475 0.0000 175.7637 246 D 4.4297 7.9058 122.7899 58.1180 40.9039 179.2464 247 M 4.2121 8.1379 120.8219 59.8419 31.3331 180.2003 248 I 3.9009 8.3538 121.5303 64.2340 37.2994 177.8758 249 N 4.3430 8.1148 119.8205 57.4775 38.8912 177.5934 250 R 3.9608 8.2992 122.0770 61.8959 29.5021 180.3245 251 Y 4.2058 8.6706 118.1880 60.6813 37.8127 178.8815 252 S 4.2054 8.5928 116.7484 61.8648 62.9292 176.7959 253 I 3.7758 7.8428 122.3795 64.2855 36.7551 178.3317 254 L 3.9567 7.8866 121.1731 57.9616 41.8082 178.1040 255 Y 4.0307 8.5320 120.0797 60.9869 38.6672 178.1868 256 N 4.3620 8.3129 116.9905 56.4250 38.7075 177.4903 257 R 3.9250 7.7888 119.1320 59.6418 30.0610 179.3013 258 T 3.7465 7.9028 115.2569 66.5201 68.5065 176.3410 259 R 3.6707 8.1548 121.4170 59.7930 29.9915 178.1877 260 Q 3.9588 8.3777 117.4717 59.0908 28.7564 178.9468 261 A 3.9857 8.0200 121.5578 55.0744 18.2826 179.9358 262 V 3.4852 7.9812 116.8955 66.0775 31.6320 178.2279 263 I 3.6665 7.7101 119.4756 64.9351 36.9932 178.5549 264 T 3.8901 7.9175 116.3117 66.6078 68.1445 176.6055 265 N 4.3214 8.3075 118.3729 56.4583 38.3428 177.4810 266 E 3.9491 8.5224 120.1496 58.8041 29.3530 179.2429 267 L 4.0152 7.8759 120.5830 57.8771 42.4573 178.6091 268 V 3.5709 7.8137 118.2518 66.1171 31.3102 177.1880 269 D 4.3007 8.2712 117.6065 57.7728 40.8600 178.5825 270 I 3.7537 7.2292 118.2508 64.4082 36.9328 178.3147 271 I 3.8990 8.2258 121.2219 64.5300 36.6719 178.6469 272 T 4.0825 7.7743 116.0403 66.2858 68.4483 176.5511 273 G 3.8844 7.9365 104.0794 45.3598 0.0000 173.4628 274 A 4.8204 7.4368 123.1383 51.7273 19.4718 177.0196 275 S 4.6007 8.0257 111.1979 59.1382 64.5938 173.8057 276 S 4.3100 8.1146 120.0238 59.5027 62.5388 173.8389 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 1 A 8.25 4.33 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.64 3.87 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 1.26 0.00 0.00 3 L 8.78 3.99 0.00 1.66 1.67 0.79 -0.23 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 4 K 7.98 4.09 0.00 1.80 1.80 0.00 1.84 0.00 0.00 1.82 0.00 0.00 2.88 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.44 1.10 7.81 5 E 8.07 4.20 0.00 2.23 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 0.00 2.35 2.33 0.00 6 V 8.03 3.90 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 1.29 0.00 0.00 1.07 0.00 0.00 7 E 8.42 4.25 0.00 2.06 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 2.24 2.19 0.00 8 M 8.00 4.26 0.00 1.97 2.11 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.43 0.00 9 R 8.49 4.17 0.00 1.98 1.96 0.00 3.18 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.58 0.00 10 L 7.63 4.23 0.00 2.05 1.74 0.97 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 11 K 7.82 4.23 0.00 1.83 1.79 0.00 1.87 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.37 1.31 7.81 12 S 8.30 4.25 0.00 3.97 4.18 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 13 I 7.31 3.70 1.65 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.70 0.82 0.00 0.00 14 K 7.47 4.00 0.00 1.84 1.81 0.00 1.81 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.32 7.81 15 N 8.29 4.66 0.00 2.73 2.85 0.00 0.00 7.15 6.71 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 16 I 7.96 3.93 1.93 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 1.38 0.63 0.88 0.00 0.00 17 E 8.19 4.03 0.00 2.20 2.06 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 2.29 2.53 0.00 18 K 7.88 4.03 0.00 1.83 1.77 0.00 1.87 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.37 1.36 7.81 19 I 8.06 4.03 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 1.35 1.35 0.90 0.00 0.00 20 T 7.89 3.87 4.23 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 1.23 0.00 0.00 21 K 7.88 4.14 0.00 1.74 1.85 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.34 7.81 22 T 7.95 4.07 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 1.20 0.00 0.00 23 M 8.58 4.02 0.00 2.15 2.23 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.60 0.00 24 K 7.89 3.91 0.00 1.88 1.88 0.00 1.82 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.47 7.81 25 I 7.37 4.13 1.86 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 1.64 0.91 0.00 0.00 26 V 8.67 3.59 2.28 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 1.00 0.00 0.00 0.93 0.00 0.00 27 A 7.70 4.43 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 28 S 7.35 4.44 0.00 3.91 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 29 T 7.95 4.09 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 30 R 7.74 4.28 0.00 2.15 1.98 0.00 3.06 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 31 L 7.32 4.28 0.00 1.70 1.65 0.92 0.83 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 32 S 7.82 4.60 0.00 4.00 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 33 K 7.54 4.72 0.00 1.88 1.68 0.00 1.85 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.39 1.26 7.81 34 A 7.89 4.97 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 35 E 8.48 4.24 0.00 2.01 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.19 0.00 36 K 8.04 4.36 0.00 1.72 1.84 0.00 1.77 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.37 1.32 7.81 37 A 7.55 4.48 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 38 K 8.00 4.23 0.00 1.87 1.73 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.33 1.09 7.81 39 I 7.46 4.44 1.97 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 1.51 1.24 0.91 0.00 0.00 40 S 7.50 4.83 0.00 3.63 3.67 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 0.00 0.00 0.00 0.00 41 A 8.21 4.65 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *136 D 9.15 4.49 0.00 2.83 3.14 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 0.00 0.00 0.00 137 A 8.03 3.87 1.07 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 0.00 0.00 138 P 0.00 4.41 0.00 2.03 1.85 0.00 3.26 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.40 0.00 139 T 7.41 4.55 4.19 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 0.00 0.00 0.00 1.13 0.00 0.00 *140 F 8.54 4.12 0.00 2.31 2.33 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 0.00 141 Q 8.13 4.27 0.00 2.05 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.80 6.90 0.00 0.00 0.00 0.00 0.00 2.36 1.99 0.00 142 E 7.52 4.22 0.00 1.96 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 2.26 2.18 0.00 143 S 8.10 4.39 0.00 3.95 4.07 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 0.00 144 A 8.26 4.10 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 0.00 145 L 7.39 4.20 0.00 1.55 1.54 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 *213 T 7.68 4.33 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 1.26 0.00 0.00 214 L 7.88 3.94 0.00 1.75 1.65 0.92 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 215 A 7.68 4.48 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.73 4.76 0.00 2.75 2.76 0.00 0.00 7.14 7.07 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 0.00 217 Q 8.36 4.18 0.00 2.22 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.59 0.00 0.00 0.00 0.00 0.00 2.42 2.54 0.00 218 M 7.84 4.08 0.00 2.01 2.19 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 2.75 2.54 0.00 219 L 8.01 3.75 0.00 1.71 1.87 0.90 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 220 T 7.61 4.01 4.33 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 1.18 0.00 0.00 221 A 7.85 4.09 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.98 4.10 0.00 2.02 2.21 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.58 0.00 223 A 8.02 4.22 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.02 4.09 0.00 2.23 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.78 0.00 0.00 0.00 0.00 0.00 2.46 2.57 0.00 225 G 8.18 3.62 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 0.00 0.00 0.00 226 Y 8.38 4.04 0.00 3.21 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 0.00 227 A 8.08 4.03 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 0.00 228 A 7.72 3.98 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 0.00 229 E 8.51 3.80 0.00 2.02 1.81 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 2.21 2.30 0.00 230 I 7.25 3.63 1.84 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.52 0.83 0.00 0.00 231 S 7.83 4.15 0.00 4.02 4.16 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.22 4.12 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 0.00 233 R 7.98 3.84 0.00 2.01 2.02 0.00 3.06 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 1.60 1.61 0.00 234 R 7.48 4.22 0.00 1.96 1.83 0.00 3.31 0.00 0.00 3.15 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.51 0.00 235 N 7.58 4.76 0.00 3.05 2.93 0.00 0.00 6.93 8.03 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 0.00 236 A 8.44 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 0.00 237 M 8.57 4.03 0.00 2.22 2.20 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 2.60 2.78 0.00 238 D 8.03 4.40 0.00 2.88 2.79 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 0.00 239 N 7.88 4.47 0.00 3.01 2.83 0.00 0.00 6.75 7.86 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 0.00 240 A 8.21 4.04 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 0.00 241 S 8.12 4.14 0.00 4.17 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 0.00 242 K 7.79 4.02 0.00 1.83 1.86 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.37 1.35 7.81 243 N 8.08 4.55 0.00 3.03 2.89 0.00 0.00 6.84 7.16 0.00 0.00 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 A 8.32 4.13 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 0.00 245 G 8.48 3.76 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 0.00 0.00 0.00 246 D 7.91 4.43 0.00 3.04 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 0.00 247 M 8.14 4.21 0.00 2.03 2.07 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.46 0.00 248 I 8.35 3.90 2.01 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 1.35 0.52 0.90 0.00 0.00 249 N 8.11 4.34 0.00 3.04 2.92 0.00 0.00 7.38 8.99 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 0.00 250 R 8.30 3.96 0.00 1.84 1.93 0.00 3.33 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 1.57 1.55 0.00 251 Y 8.67 4.21 0.00 3.20 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 0.00 252 S 8.59 4.21 0.00 4.13 3.95 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 0.00 253 I 7.84 3.78 2.01 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 1.43 1.61 0.92 0.00 0.00 254 L 7.89 3.96 0.00 1.83 1.79 0.74 0.74 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 0.00 255 Y 8.53 4.03 0.00 3.25 3.21 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 0.00 256 N 8.31 4.36 0.00 2.88 2.90 0.00 0.00 7.09 7.65 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 0.00 257 R 7.79 3.92 0.00 1.96 1.97 0.00 3.11 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 1.65 1.94 0.00 258 T 7.90 3.75 4.19 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 0.00 0.00 0.00 1.16 0.00 0.00 259 R 8.15 3.67 0.00 1.48 2.03 0.00 3.15 0.00 0.00 3.29 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.65 0.00 260 Q 8.38 3.96 0.00 2.31 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.37 2.49 0.00 261 A 8.02 3.99 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 0.00 262 V 7.98 3.49 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 1.08 0.00 0.00 0.94 0.00 0.00 263 I 7.71 3.67 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 1.51 0.47 0.90 0.00 0.00 264 T 7.92 3.89 4.23 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 1.20 0.00 0.00 265 N 8.31 4.32 0.00 2.76 2.84 0.00 0.00 7.00 7.28 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 0.00 266 E 8.52 3.95 0.00 2.18 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 2.45 0.00 267 L 7.88 4.02 0.00 1.87 1.82 0.92 0.88 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 0.00 268 V 7.81 3.57 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 0.93 0.00 0.00 0.93 0.00 0.00 269 D 8.27 4.30 0.00 2.99 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 0.00 270 I 7.23 3.75 1.98 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 1.52 0.70 0.91 0.00 0.00 271 I 8.23 3.90 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 1.69 1.20 0.91 0.00 0.00 272 T 7.77 4.08 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 0.00 273 G 7.94 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 0.00 274 A 7.44 4.82 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 0.00 275 S 8.03 4.60 0.00 4.06 3.79 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 0.00 276 S 8.11 4.31 0.00 3.90 3.76 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 * Residues marked with a * may have inaccurate shift predictions.