NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.2547 8.3344 116.7546 57.9723 65.0909 173.9169 3 N 4.5603 6.9519 119.1228 50.8729 40.5119 173.3630 4 A 3.7744 8.5485 130.2737 55.1834 19.1733 178.1000 5 E 3.7756 8.1721 117.0745 59.5682 29.5593 178.6103 6 A 3.7676 7.8370 119.8997 55.2166 18.3652 179.3662 7 S 3.7764 7.6172 113.4128 61.7362 62.8594 176.9086 8 R 3.8702 8.2082 121.4492 59.5829 29.8517 178.6131 9 V 3.6496 8.2877 118.2416 66.2812 31.4836 177.6195 10 Y 4.3032 8.5104 116.7251 61.3059 37.9059 178.3671 11 E 4.2920 8.5626 119.5508 59.5486 29.4969 179.5153 12 I 3.7960 8.1502 120.1081 64.2302 37.1355 178.5758 13 I 3.7043 7.8629 120.6978 64.5363 37.0019 178.9431 14 V 2.6130 7.3377 113.1549 64.0680 31.0230 178.5933 15 E 3.9409 7.9518 118.0050 59.4039 29.2625 179.6198 16 S 4.1528 8.3262 115.5357 61.4310 62.8929 176.8684 17 V 3.6637 8.3947 121.4764 66.0303 31.0316 178.1960 18 V 3.5838 7.8701 117.9841 66.1484 31.0521 177.8012 19 N 4.3698 7.7452 115.6025 56.2126 38.5015 177.0683 20 E 4.1417 8.1523 119.2064 58.5951 29.8767 178.7094 21 V 4.3874 7.7309 110.7544 61.5664 32.2977 177.7177 22 R 3.7394 7.5989 119.3646 59.5778 29.7673 177.8641 23 E 4.0231 8.1825 118.4209 59.1589 29.4583 178.1936 24 D 4.5173 8.1213 118.2952 56.6776 41.2368 178.5495 25 F 4.1104 8.4159 118.1132 60.6511 38.9629 177.2247 26 E 4.0141 8.2825 118.1719 59.5683 29.0748 178.9117 27 N 4.4093 7.9887 114.8249 55.3705 39.1320 175.6551 28 A 4.5189 8.0246 120.1301 51.6536 19.8578 177.5368 29 G 3.8884 7.7570 106.0611 44.9340 0.0000 173.7368 30 I 4.0977 7.2641 120.8385 60.2810 38.2944 175.5756 31 D 4.7327 8.4789 124.4521 52.2884 40.7876 176.5827 32 E 3.8718 8.9159 120.2402 59.8740 29.2448 178.8766 33 Q 3.9470 7.7726 119.0007 59.5295 29.1057 178.4710 34 T 4.1402 8.1751 116.6314 66.3849 68.4460 176.4298 35 L 3.5515 7.8235 121.8635 58.1200 42.0264 178.8641 36 Q 3.9392 8.2078 118.0869 59.0518 28.5730 178.4367 37 D 4.3697 8.4330 120.3008 57.3191 40.7909 178.6521 38 L 3.9458 8.0396 120.6275 58.0859 42.0477 178.8773 39 K 3.9948 7.9541 119.4626 59.5986 32.0084 178.4090 40 N 4.2916 8.4188 116.9122 56.5568 38.4751 177.5344 41 I 3.6662 8.1170 121.5337 63.9042 37.1353 178.2943 42 W 4.1798 8.4474 129.6247 60.6005 30.5412 178.0427 43 Q 2.9613 7.9836 118.2515 58.3068 27.8957 178.6491 44 K 2.6388 7.5209 120.6523 59.0338 31.9578 178.6949 45 K 4.0048 7.7101 117.2709 59.6454 32.1811 178.7818 46 L 4.2305 7.8158 118.9173 58.3617 41.4163 179.8384 47 T 4.2581 8.0560 115.4852 66.8248 68.1609 176.5950 48 E 4.0581 8.1892 120.0014 59.4554 29.4825 179.1454 49 T 4.0790 7.6970 109.2818 62.1864 69.3730 174.6667 50 K 3.8957 7.8409 119.5093 57.5003 30.2747 176.5577 51 V 4.4056 7.6778 110.9692 62.2462 32.3412 175.9326 52 T 4.0858 6.9501 111.9084 61.6073 69.6309 171.6172 53 T 4.1817 7.7223 114.4808 60.0405 70.5388 174.1262 54 F 4.5803 9.1149 122.8567 55.1881 41.6930 176.6362 55 S 4.2522 8.9074 117.8346 59.6510 63.0152 174.8341 56 W 4.8315 7.1880 117.5344 56.4400 29.2538 177.2317 57 D 4.7570 8.1096 120.7951 58.1364 40.0105 178.3144 58 N 4.7961 8.2634 115.1056 56.1905 38.5843 176.7108 59 Q 4.0580 8.1385 118.3244 56.8484 30.0232 176.0965 60 F 5.0345 8.1788 118.1570 56.4884 39.1339 177.9981 61 N 4.5430 7.7343 118.2965 53.5671 36.1934 174.2651 *228 D 4.2753 7.7375 120.7944 54.3479 42.4769 174.2761 229 Y 4.5162 8.5812 115.4402 57.8639 38.4815 175.7069 230 L 4.8596 7.5969 120.3133 52.2770 44.5000 176.5024 231 I 3.8904 8.3871 123.3928 62.0010 38.3434 176.3015 232 S 4.7563 8.1478 117.4787 57.8183 63.0924 173.2979 *236 E 4.1827 8.1334 113.7064 55.6132 31.5868 175.2673 237 D 5.2334 7.2822 123.3520 51.2122 40.4411 175.8534 238 G 4.0812 8.0109 112.6051 44.3405 0.0000 171.0095 239 P 4.3810 0.0000 0.0000 65.0153 31.1636 176.6073 240 D 4.6775 7.9193 116.9758 54.1937 41.7550 175.7143 241 E 4.2353 8.1030 122.1095 55.3603 30.3916 174.6267 242 N 5.5186 8.5981 123.6156 51.7909 39.5452 174.2151 243 L 4.8472 8.5455 125.5658 53.2767 45.8931 174.3870 244 M 5.3276 8.8564 125.1618 53.7982 34.5599 174.4005 245 L 4.9540 8.5151 126.1835 53.4769 44.9340 176.0240 246 C 5.1164 8.1540 116.3608 58.2521 32.6137 172.4723 247 L 4.9657 7.9308 118.9603 53.6810 44.5758 175.1959 248 Y 5.2451 7.8851 117.8057 55.9770 40.0615 175.0080 249 D 4.7532 9.6998 124.8844 56.4315 41.6386 176.8814 250 K 4.7305 8.4371 116.1679 55.7693 36.2714 174.1673 251 V 5.0557 8.4620 122.9553 61.4166 33.8913 174.5956 252 T 4.7879 8.6328 116.4107 60.2048 72.4367 172.8418 253 R 4.7643 7.9551 118.6391 54.7615 32.7642 174.4622 254 T 4.3957 8.2128 117.6325 62.5274 72.3759 174.9475 255 K 3.7542 8.5325 127.4854 57.9085 30.8624 176.2715 256 A 4.9279 8.9135 131.1014 52.6731 20.7275 175.8901 257 R 4.7656 8.3811 117.5454 55.3397 31.1747 175.7197 258 W 5.1961 9.3503 124.9375 55.2076 32.0802 175.9695 259 K 4.9770 9.3567 122.1380 55.1044 35.7102 174.9721 260 C 5.3624 9.2734 123.8138 57.8799 31.3067 173.2177 261 S 5.1278 8.8985 119.7640 57.1869 64.3753 173.5429 262 L 5.4610 8.8666 125.1643 53.0898 45.3875 175.2284 263 K 5.4836 9.1494 117.5196 57.1943 36.2327 175.2513 264 D 4.5635 8.5030 116.1341 55.2610 37.7490 172.6492 265 G 3.8134 7.2641 110.1425 43.8720 0.0000 169.8018 266 V 5.1921 8.5310 118.5401 59.8459 35.0683 175.0860 267 V 5.1309 9.4137 121.7781 60.7013 35.6447 173.8325 268 T 5.2554 8.8115 119.6525 61.3976 70.4050 173.5290 269 I 4.4784 9.2993 128.4624 59.3209 39.9036 175.3253 270 N 4.1699 10.1472 127.8587 54.6743 36.0083 175.2773 271 R 3.9479 7.8899 112.9342 56.6710 28.8315 175.9297 272 N 5.2939 7.8163 114.7476 51.4370 41.2044 172.9998 273 D 5.5288 8.2646 121.8371 53.1486 43.6830 175.1399 274 Y 4.8746 9.2341 118.7419 56.5896 42.7680 174.2780 275 T 5.2637 8.6617 110.7959 60.1099 72.1927 172.8323 276 F 5.0413 8.7944 117.3474 55.8425 41.7021 174.9796 277 Q 4.2251 9.0764 120.7904 58.2236 30.1669 175.4803 278 K 5.5190 8.1806 114.9083 54.7241 36.4560 175.6989 279 A 4.4785 8.7402 123.4927 50.1909 22.7910 174.9569 280 Q 4.9460 8.5615 119.4143 54.0691 31.5954 175.0715 281 V 4.3509 8.9641 124.5224 61.3111 34.4119 174.5411 282 E 5.2090 9.0433 125.3928 53.3942 31.1578 173.5314 283 A 4.8303 8.4562 124.8356 49.7099 22.6984 174.1653 284 E 4.9409 8.6891 122.3239 54.1432 31.0301 176.8994 285 W 4.5798 9.6312 135.0000 56.8033 28.2683 176.2082 286 V 3.7280 7.2782 122.7963 62.5451 31.2670 174.5659 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 S 8.33 4.25 0.00 3.64 3.86 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 3 N 6.95 4.56 0.00 2.45 2.36 0.00 0.00 7.18 7.51 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 4 A 8.55 3.77 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 5 E 8.17 3.78 0.00 2.04 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 2.38 2.40 0.00 6 A 7.84 3.77 0.94 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 0.00 0.00 7 S 7.62 3.78 0.00 3.92 3.69 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 8 R 8.21 3.87 0.00 1.89 2.08 0.00 3.08 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 9 V 8.29 3.65 2.29 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 1.13 0.00 0.00 0.99 0.00 0.00 10 Y 8.51 4.30 0.00 3.48 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 11 E 8.56 4.29 0.00 2.12 2.18 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 2.36 2.62 0.00 12 I 8.15 3.80 2.05 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.83 0.93 0.00 0.00 13 I 7.86 3.70 1.98 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.74 1.00 0.00 0.00 14 V 7.34 2.61 0.67 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 0.52 0.00 0.00 15 E 7.95 3.94 0.00 2.00 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 2.53 2.51 0.00 16 S 8.33 4.15 0.00 4.08 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 17 V 8.39 3.66 2.57 0.00 0.00 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 1.22 0.00 0.00 18 V 7.87 3.58 2.20 0.00 0.00 0.00 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 1.00 0.00 0.00 19 N 7.75 4.37 0.00 2.84 2.85 0.00 0.00 7.08 7.52 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 20 E 8.15 4.14 0.00 2.10 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 0.00 2.67 2.47 0.00 21 V 7.73 4.39 2.31 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 0.91 0.00 0.00 0.92 0.00 0.00 22 R 7.60 3.74 0.00 1.92 1.91 0.00 3.07 0.00 0.00 3.07 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.60 0.00 23 E 8.18 4.02 0.00 2.09 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 2.40 2.42 0.00 24 D 8.12 4.52 0.00 2.97 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 25 F 8.42 4.11 0.00 3.21 3.31 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 26 E 8.28 4.01 0.00 2.23 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 0.00 2.38 2.58 0.00 27 N 7.99 4.41 0.00 2.87 3.01 0.00 0.00 7.11 9.01 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 28 A 8.02 4.52 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 29 G 7.76 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 30 I 7.26 4.10 1.80 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.48 0.95 0.00 0.00 31 D 8.48 4.73 0.00 2.93 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 32 E 8.92 3.87 0.00 2.09 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 2.37 2.42 0.00 33 Q 7.77 3.95 0.00 2.03 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.58 0.00 0.00 0.00 0.00 0.00 2.37 2.46 0.00 34 T 8.18 4.14 4.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 35 L 7.82 3.55 0.00 1.07 1.61 -0.02 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 36 Q 8.21 3.94 0.00 2.27 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.54 0.00 0.00 0.00 0.00 0.00 2.56 2.52 0.00 37 D 8.43 4.37 0.00 2.94 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 38 L 8.04 3.95 0.00 1.86 1.95 0.81 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 39 K 7.95 3.99 0.00 1.84 1.89 0.00 1.58 0.00 0.00 1.73 0.00 0.00 2.86 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.18 1.32 7.81 40 N 8.42 4.29 0.00 2.98 2.93 0.00 0.00 7.07 7.25 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 41 I 8.12 3.67 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 1.42 0.81 0.89 0.00 0.00 42 W 8.45 4.18 0.00 3.36 3.03 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 0.00 0.00 0.00 43 Q 7.98 2.96 0.00 1.70 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.57 0.00 0.00 0.00 0.00 0.00 1.16 1.48 0.00 44 K 7.52 2.64 0.00 1.34 1.70 0.00 1.70 0.00 0.00 1.72 0.00 0.00 2.90 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.39 1.27 7.81 45 K 7.71 4.00 0.00 1.95 1.89 0.00 1.77 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.76 1.62 7.81 46 L 7.82 4.23 0.00 1.74 1.35 0.53 0.84 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 47 T 8.06 4.26 4.39 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 1.45 0.00 0.00 48 E 8.19 4.06 0.00 2.16 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.54 0.00 49 T 7.70 4.08 4.34 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 1.37 0.00 0.00 50 K 7.84 3.90 0.00 1.91 1.94 0.00 1.71 0.00 0.00 1.74 0.00 0.00 3.15 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.41 1.65 7.81 51 V 7.68 4.41 2.30 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 1.32 0.00 0.00 1.19 0.00 0.00 52 T 6.95 4.09 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.00 0.00 53 T 7.72 4.18 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 54 F 9.11 4.58 0.00 1.85 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 S 8.91 4.25 0.00 3.92 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 56 W 7.19 4.83 0.00 3.68 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 57 D 8.11 4.76 0.00 2.89 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 58 N 8.26 4.80 0.00 2.72 2.91 0.00 0.00 6.94 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 59 Q 8.14 4.06 0.00 1.65 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 7.33 0.00 0.00 0.00 0.00 0.00 2.34 2.55 0.00 60 F 8.18 5.03 0.00 3.11 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 61 N 7.73 4.54 0.00 2.72 2.83 0.00 0.00 7.12 8.06 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 *228 D 7.74 4.28 0.00 2.65 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 0.00 229 Y 8.58 4.52 0.00 2.99 3.04 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 0.00 0.00 0.00 0.00 230 L 7.60 4.86 0.00 1.60 1.58 0.96 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 231 I 8.39 3.89 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 1.49 0.75 0.92 0.00 0.00 232 S 8.15 4.76 0.00 3.94 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 *236 E 8.13 4.18 0.00 2.13 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 2.18 2.32 0.00 237 D 7.28 5.23 0.00 2.82 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 G 8.01 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 239 P 0.00 4.38 0.00 2.22 2.24 0.00 3.78 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 2.01 2.02 0.00 240 D 7.92 4.68 0.00 2.70 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 0.00 241 E 8.10 4.24 0.00 2.26 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 2.29 0.00 242 N 8.60 5.52 0.00 2.67 2.80 0.00 0.00 6.97 7.85 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 0.00 243 L 8.55 4.85 0.00 1.76 1.51 0.96 0.82 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 0.00 244 M 8.86 5.33 0.00 2.13 2.02 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 2.85 2.78 0.00 245 L 8.52 4.95 0.00 1.65 1.56 0.97 0.53 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 0.00 246 C 8.15 5.12 0.00 3.32 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 0.00 247 L 7.93 4.97 0.00 1.89 1.58 0.90 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 248 Y 7.89 5.25 0.00 2.89 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 0.00 249 D 9.70 4.75 0.00 2.78 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 0.00 250 K 8.44 4.73 0.00 1.85 1.93 0.00 1.28 0.00 0.00 1.60 0.00 0.00 2.77 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.39 1.42 7.81 251 V 8.46 5.06 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 1.07 0.00 0.00 0.76 0.00 0.00 252 T 8.63 4.79 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 1.18 0.00 0.00 253 R 7.96 4.76 0.00 0.67 0.66 0.00 2.21 0.00 0.00 2.57 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.01 0.00 254 T 8.21 4.40 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 1.17 0.00 0.00 255 K 8.53 3.75 0.00 1.88 1.03 0.00 1.58 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.35 1.50 7.81 256 A 8.91 4.93 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.38 4.77 0.00 1.90 1.94 0.00 3.14 0.00 0.00 3.19 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.65 0.00 258 W 9.35 5.20 0.00 3.41 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 0.00 259 K 9.36 4.98 0.00 1.64 1.69 0.00 1.60 0.00 0.00 1.66 0.00 0.00 2.83 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.38 1.43 7.81 260 C 9.27 5.36 0.00 2.85 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 0.00 261 S 8.90 5.13 0.00 3.97 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 0.00 262 L 8.87 5.46 0.00 1.83 1.92 1.06 0.27 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 0.00 263 K 9.15 5.48 0.00 2.02 1.96 0.00 1.68 0.00 0.00 1.76 0.00 0.00 2.89 0.00 0.00 3.36 0.00 0.00 0.00 0.00 1.39 1.29 7.81 264 D 8.50 4.56 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 0.00 265 G 7.26 3.81 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 0.00 0.00 0.00 266 V 8.53 5.19 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 0.81 0.00 0.00 1.20 0.00 0.00 267 V 9.41 5.13 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 1.23 0.00 0.00 1.07 0.00 0.00 268 T 8.81 5.26 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 1.31 0.00 0.00 269 I 9.30 4.48 2.08 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.33 0.94 0.00 0.00 270 N 10.15 4.17 0.00 2.90 2.90 0.00 0.00 7.04 7.68 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 0.00 271 R 7.89 3.95 0.00 2.02 2.03 0.00 3.26 0.00 0.00 3.54 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 272 N 7.82 5.29 0.00 2.99 2.41 0.00 0.00 6.90 7.96 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 0.00 273 D 8.26 5.53 0.00 2.50 2.43 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 0.00 274 Y 9.23 4.87 0.00 2.97 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 0.00 275 T 8.66 5.26 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 1.23 0.00 0.00 276 F 8.79 5.04 0.00 3.14 3.16 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 0.00 277 Q 9.08 4.23 0.00 2.27 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.88 0.00 0.00 0.00 0.00 0.00 2.43 2.51 0.00 278 K 8.18 5.52 0.00 1.67 1.68 0.00 1.78 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.50 7.81 279 A 8.74 4.48 0.35 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 0.00 0.00 0.00 0.00 0.00 0.00 280 Q 8.56 4.95 0.00 1.86 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.65 0.00 0.00 0.00 0.00 0.00 2.22 2.24 0.00 281 V 8.96 4.35 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.90 0.00 0.00 282 E 9.04 5.21 0.00 1.84 1.85 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 2.23 2.15 0.00 283 A 8.46 4.83 1.22 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 0.00 0.00 284 E 8.69 4.94 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 2.30 2.49 0.00 285 W 9.63 4.58 0.00 3.40 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 286 V 7.28 3.73 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 0.77 0.00 0.00 0.98 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.