NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 T 4.5457 8.1749 111.0249 61.7268 70.4805 172.1564 5 F 4.6192 9.8045 120.7533 55.4203 43.6065 172.2140 6 T 5.1319 8.7371 115.3353 60.9707 71.1502 172.4334 7 A 4.6765 9.0203 127.5608 50.8478 22.8948 175.5213 8 N 5.2968 7.9159 119.4541 51.7139 40.7274 172.6989 9 F 4.9972 9.2074 121.2428 55.2938 42.5770 174.6011 10 K 4.4489 8.4842 121.2386 54.3946 34.7189 176.1363 11 D 4.3583 8.5430 128.5486 55.3814 39.1683 174.7675 12 T 4.3698 8.0529 115.3368 62.4270 70.1315 174.8648 13 D 4.6298 8.5856 124.8212 54.2255 42.9874 176.9645 14 L 4.0104 8.5718 128.0229 58.2654 42.1336 179.5934 15 K 3.9011 8.0059 117.8028 59.5602 32.0238 179.0287 16 S 4.1194 8.0986 114.7749 61.6959 62.8082 176.2883 17 F 3.8804 8.2035 122.9488 61.3912 38.9716 177.1340 18 I 3.3558 7.9886 119.4470 64.3507 36.9404 178.1766 19 E 3.8390 8.0940 119.2219 59.6716 29.2815 179.4808 20 T 3.8531 7.8580 115.6015 66.8556 68.6335 176.8100 21 V 3.7253 6.7442 121.3547 65.0683 31.2417 178.1037 22 G 3.3874 7.8628 105.4683 47.7407 0.0000 175.3416 23 A 3.9500 7.9143 123.8671 54.8291 18.1940 179.3473 24 N 4.3623 7.9261 113.6284 56.2104 38.7616 176.7473 25 L 4.1460 7.7511 117.0704 53.5803 43.1045 176.0023 26 N 4.1495 7.7697 115.5570 54.5933 36.3035 174.3680 27 K 4.6037 8.1297 115.5873 54.7828 36.1843 177.9679 28 T 4.2712 8.2441 121.2433 63.0792 69.7181 173.7638 29 I 4.9601 8.3060 126.8861 59.6967 39.5568 175.0351 30 I 4.7230 8.5702 125.8597 59.9708 40.7814 174.4916 31 M 4.6405 8.3759 122.4858 53.8112 35.5416 174.8495 32 G 3.3965 8.2911 106.8686 48.8849 0.0000 174.4457 *35 V 3.9960 7.3614 124.0311 61.8410 31.8003 174.7068 36 Q 4.5561 9.3423 124.2357 53.1253 31.5048 174.5031 37 G 4.3867 7.3553 110.7948 44.4758 0.0000 171.0443 38 A 5.1889 7.6965 121.0213 49.8704 21.4744 175.8827 39 V 4.3164 9.0685 122.3251 61.2399 34.4950 174.8161 40 S 5.0853 8.0909 121.5937 57.3315 66.8998 173.1931 41 I 4.5208 8.4810 122.1264 60.1488 42.1861 172.7394 42 R 5.1618 8.6800 128.7991 54.6374 33.1710 174.2301 43 T 4.5726 8.7779 117.7159 61.3211 68.5874 174.5715 44 M 4.4008 8.9627 128.2948 57.4988 32.4934 177.1647 45 T 4.7357 7.7073 106.3150 58.4024 71.9720 171.6001 46 P 4.6790 0.0000 0.0000 63.0947 31.9954 175.4074 47 L 5.1836 9.1074 122.0322 53.1235 45.2265 176.1183 48 N 5.5423 9.1588 120.2420 51.8953 39.5793 175.6835 49 E 3.8079 9.1281 118.3458 59.4222 29.5269 178.2432 50 R 4.0237 8.1292 118.0888 59.8136 30.1186 178.1706 51 Q 4.0618 8.6087 117.5680 59.1443 28.2434 178.3339 52 Y 4.1982 8.5284 120.8151 61.0195 38.8078 177.4372 53 Y 4.3767 8.4047 120.6534 60.9886 38.8387 178.0274 54 Q 3.7654 8.3859 120.4143 58.9687 29.1365 177.7979 55 L 3.9686 8.2257 121.6443 58.1754 42.1151 178.7418 56 F 4.4187 8.3080 120.4513 61.4745 39.4590 177.1429 57 L 3.6431 7.9402 118.6182 57.5607 41.3429 179.3261 58 N 4.2647 8.6197 116.7658 56.3544 38.4320 177.5237 59 L 3.9534 8.0056 120.3963 57.5768 41.5594 179.5289 60 L 3.9585 7.6595 118.8999 57.7540 41.5916 178.9953 61 E 4.0101 8.1606 119.8668 58.7062 29.3066 178.5288 62 A 3.9831 7.7324 119.1790 55.3857 18.5127 178.9491 63 Q 4.2766 7.6134 113.1831 56.4341 29.0581 176.9215 64 G 3.7772 8.0652 108.8426 44.9691 0.0000 172.7509 65 Y 4.8986 8.3420 116.3165 55.7285 41.9066 174.6336 66 A 4.7623 8.4471 122.8622 50.2445 22.5507 175.3527 67 V 4.6652 8.2051 118.8650 61.3554 33.8458 175.7240 68 V 4.4413 8.8928 127.0252 60.2898 33.6733 172.4581 69 P 4.9316 0.0000 0.0000 63.1405 31.9803 175.4405 70 M 4.8881 9.0170 122.1078 53.6192 36.7943 173.3492 71 E 3.5759 9.1533 118.0780 58.3025 30.8234 177.4903 72 N 4.0791 9.3872 122.9876 54.4050 35.9637 173.2664 73 D 4.3572 7.7151 115.4149 56.2537 39.3990 174.1421 74 V 4.5418 7.3351 117.4500 61.3398 34.1329 174.2964 75 L 5.2089 9.0397 127.2686 52.8530 44.6046 175.0603 76 K 4.7656 8.9115 125.3275 54.7271 33.7683 174.8894 77 V 4.8434 8.4187 127.7002 61.4575 33.1470 176.7749 78 V 4.3479 8.4288 124.2770 62.7767 33.4003 176.3461 *99 A 4.2314 8.4159 125.1297 52.9224 20.1953 179.8719 100 G 3.7831 7.8661 102.7695 47.3534 0.0000 174.5033 101 D 4.6128 7.8282 118.1570 54.7817 41.7504 176.2760 102 E 4.0689 7.6014 121.4804 56.3962 31.0021 175.6766 103 M 4.7316 8.6968 126.6719 55.3760 33.0755 175.6764 104 V 5.0359 9.3741 117.0160 59.7334 36.6836 174.5926 105 T 5.1652 8.6991 116.1774 60.4834 70.8497 172.5940 106 K 4.9371 9.2775 127.9371 55.0108 36.2946 174.5310 107 V 4.6361 8.2892 126.7275 61.2657 33.2355 174.9475 108 V 4.3246 9.0926 128.9617 60.4347 33.1294 173.1666 109 P 4.7227 0.0000 0.0000 62.6079 32.1825 176.1493 110 V 4.5094 8.0785 122.3674 61.4509 33.4040 175.0888 111 R 4.4385 9.4940 127.3190 56.9308 31.4376 176.1375 112 N 5.0163 8.9637 111.7967 52.6198 40.0114 174.1362 113 V 4.4813 7.3039 116.5541 60.8988 34.8616 173.9358 114 S 4.4209 8.5408 120.0027 58.1163 63.2142 175.5399 115 V 3.7970 8.7042 120.9857 64.7203 31.7935 178.7700 116 R 3.8656 7.7565 117.1614 58.5277 29.5766 178.6300 117 E 4.0750 7.8490 117.4917 58.6623 29.7037 178.2653 118 L 4.3420 7.8892 117.2145 55.4236 41.8757 178.5642 119 A 4.4787 7.6534 123.3108 54.1734 18.3227 177.6043 120 P 4.2045 0.0000 0.0000 65.9644 31.6065 178.8601 121 I 3.9001 7.7273 110.8806 63.6712 37.6525 177.9195 122 L 4.1193 8.1063 120.8842 57.4506 41.2579 179.5042 123 R 4.0082 8.3756 118.7579 59.0836 29.7698 178.6329 124 Q 3.9754 7.9137 118.7481 59.3028 28.8542 177.8309 125 M 4.1775 7.8638 118.8279 58.7780 32.3347 178.3619 126 I 3.8297 7.6541 119.4487 64.1032 36.9954 178.0850 127 D 4.4492 7.7827 119.2286 56.6810 40.7259 177.8306 128 S 4.4970 7.6470 112.5865 58.9147 63.3603 174.9350 129 A 4.5123 7.5997 122.3880 51.6009 19.7023 177.9366 130 G 3.7488 8.1228 106.3519 44.4085 0.0000 173.1445 131 S 4.4442 8.2699 113.3675 57.6345 64.3661 174.3678 132 G 3.9688 8.9313 108.6932 44.8534 0.0000 172.9220 133 N 5.2743 7.6320 116.0987 51.4592 41.4336 174.3862 134 V 4.4108 8.6909 121.5885 61.2821 35.4114 173.7863 135 V 4.5484 8.4991 127.4399 61.3045 33.0611 174.2148 136 N 5.1256 8.7592 125.3009 51.6516 41.9270 173.2099 137 Y 4.9640 8.6387 119.1691 56.2616 41.2952 173.8999 138 D 5.1988 8.7089 123.6038 51.8770 43.0819 175.5906 139 P 4.3651 0.0000 0.0000 65.0853 31.4990 177.1398 140 S 4.3965 9.9025 111.8099 58.0511 63.4143 173.2223 141 N 4.3374 8.6203 119.3415 55.4370 37.3165 173.4441 142 V 4.6728 7.6375 107.9907 59.3949 35.9577 175.0965 143 I 4.7396 8.5679 123.9275 59.8634 39.7630 174.2358 144 M 5.0219 8.9041 126.3354 53.7008 34.9119 174.2076 145 L 5.1324 9.3621 126.1264 53.2244 44.9506 175.4050 146 T 4.9096 9.3922 120.4852 60.8718 71.6110 174.3858 147 G 4.1889 8.0127 113.3638 45.4873 0.0000 171.3663 148 R 4.5523 7.7344 118.8941 55.5438 32.0016 177.0721 149 A 4.0259 8.7843 125.6629 55.4726 18.4321 180.4083 150 S 4.0356 8.0299 112.4301 61.7113 62.9980 176.9205 151 V 3.5255 7.7027 121.9775 65.4946 31.3720 177.9546 152 V 3.5932 8.2645 118.2508 65.8502 31.2204 177.6165 153 E 3.9268 8.5222 119.5704 59.3509 29.4130 179.0613 154 R 4.0992 7.9561 117.9759 59.1585 30.0802 179.1083 155 L 4.0266 8.1261 118.9831 57.8453 41.5842 179.4747 156 T 3.8264 8.0266 115.7467 66.6871 68.4514 176.1648 157 E 3.9414 8.2401 120.4008 59.5513 29.5586 179.7676 158 V 3.5351 7.5486 117.5250 66.0621 31.5876 177.7910 159 I 3.7169 7.6090 119.4581 64.8964 37.0556 178.5391 160 Q 4.0000 8.2776 118.4816 58.6824 28.4357 178.9402 161 R 3.8851 7.9775 120.0379 59.3893 30.3017 178.7557 162 V 3.6234 7.9249 118.1452 65.9933 31.3094 177.4987 163 D 4.3584 8.1781 117.1531 57.6235 41.1325 177.4473 164 H 4.3051 8.1541 117.7342 58.8988 30.2446 176.8360 165 A 4.3018 7.9302 122.7154 54.6962 17.9053 178.8937 166 G 4.0715 7.6862 101.5734 45.0835 0.0000 173.4416 167 N 4.9523 7.5305 115.7810 52.5604 39.7332 174.3410 168 R 4.0006 7.9886 116.4321 56.0465 30.1366 176.4724 169 T 4.1707 8.4485 113.7705 61.7882 70.1413 173.4309 170 E 4.8987 8.6622 123.2635 55.0351 32.2527 174.8524 171 E 4.6816 8.6328 121.3332 54.6943 33.5646 173.9804 172 V 4.6723 8.4292 125.9556 61.5435 33.5264 175.0264 173 I 4.5953 8.9357 128.4690 58.8081 39.8661 173.2141 174 P 4.8959 0.0000 0.0000 61.7151 32.6750 175.5952 175 L 4.8277 8.2943 120.7921 53.3971 43.6161 176.6713 176 D 4.4611 9.1526 124.6488 56.8650 41.1291 176.5440 177 N 4.6577 8.1222 112.3590 54.7799 40.3778 175.3507 178 A 4.2428 8.3097 119.8212 51.6279 19.5879 177.2544 179 S 4.5717 8.3111 113.2327 57.4912 64.5666 174.6074 180 A 3.9553 9.0288 131.5610 55.5370 18.2460 180.2559 181 S 4.0766 8.0568 113.0965 61.7334 62.8542 176.5473 182 E 3.8966 8.0605 121.2077 59.4868 29.5003 178.7124 183 I 3.6703 7.6753 119.2821 64.1935 37.1080 178.3831 184 A 3.9436 7.8831 121.1452 55.1114 18.3147 179.5292 185 R 3.7931 8.1116 117.3861 59.6485 29.9250 178.8876 186 V 3.5689 7.7471 116.6923 66.0615 31.9541 177.7258 187 L 4.1423 8.1114 118.8653 57.7364 41.3879 179.0791 188 E 4.0302 8.8623 119.3667 59.0545 29.2751 178.9940 189 S 4.2505 7.9212 114.7194 60.8315 62.9414 175.5215 190 L 4.4742 7.5849 119.1047 54.8395 42.4381 176.7896 191 T 4.4458 7.5932 112.2326 61.8332 67.5636 175.3216 *205 Q 4.1961 8.5748 117.6920 55.5458 30.2599 173.0848 206 I 5.0594 8.9337 124.1743 59.6042 40.3240 175.0669 207 V 4.5775 8.5552 125.7014 61.0123 35.1085 174.2370 208 A 5.1082 8.5038 126.4109 50.6449 21.9337 176.4034 209 D 4.4185 8.6721 118.3173 52.8365 43.0913 175.7443 210 E 3.9820 9.1112 126.7572 59.4695 29.8112 179.9724 211 R 3.7272 7.5099 116.6278 59.1923 30.2481 177.0000 212 T 4.2621 7.9118 105.4209 60.4780 70.1239 173.9175 213 N 4.1033 7.9016 120.5194 55.1630 37.5868 172.1602 214 S 5.2077 8.0248 114.8359 56.8291 68.6817 174.8019 215 V 4.6732 8.5954 120.5893 61.2977 34.8137 174.1373 216 I 4.8470 8.8273 128.5454 59.7816 39.3822 174.6225 217 V 4.6447 8.8188 127.4876 61.3308 33.9561 174.5029 218 S 4.5228 8.4907 125.0041 57.5475 62.7949 173.8142 219 G 4.0917 8.1026 114.8900 45.8571 0.0000 169.9688 220 D 5.1978 8.6007 120.6522 50.0879 42.5629 174.8970 221 P 4.2947 0.0000 0.0000 66.4113 30.7188 178.3474 222 A 4.0136 7.9219 119.5016 55.3749 18.4797 179.6545 223 T 3.9410 7.7709 113.5950 66.9072 68.6914 177.2469 224 R 3.9462 8.5038 120.3823 59.1711 29.7984 178.5689 225 D 4.3283 7.8576 117.8960 57.4377 40.9508 178.6038 226 K 4.0099 7.7291 117.5712 59.5508 32.0207 179.0797 227 M 4.0651 8.2160 118.6051 58.1137 32.1042 178.3426 228 R 3.8110 8.1134 119.1545 59.5203 30.3300 178.5075 229 R 3.9321 7.6354 117.6554 59.3572 29.8657 178.7246 230 L 3.9840 7.4196 118.5555 58.1617 42.4082 178.9944 231 I 3.8388 7.7014 119.6111 64.4334 37.0989 178.2092 232 R 3.9271 8.3402 119.2867 59.8279 29.7808 179.2625 233 R 3.9325 8.1561 116.2462 59.2041 30.1336 178.7213 234 L 4.1654 7.6898 116.8032 56.2643 41.7432 176.5756 235 D 4.4845 7.9419 123.4024 54.1692 41.1763 175.6320 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 4 T 8.17 4.55 4.30 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 1.19 0.00 0.00 5 F 9.80 4.62 0.00 2.89 2.24 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 6 T 8.74 5.13 4.25 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 1.20 0.00 0.00 7 A 9.02 4.68 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 0.00 0.00 0.00 0.00 0.00 8 N 7.92 5.30 0.00 2.36 2.60 0.00 0.00 6.91 7.45 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 9 F 9.21 5.00 0.00 3.00 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 10 K 8.48 4.45 0.00 1.61 1.74 0.00 1.90 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.35 1.45 7.81 11 D 8.54 4.36 0.00 2.80 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 12 T 8.05 4.37 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 1.31 0.00 0.00 13 D 8.59 4.63 0.00 2.80 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.57 4.01 0.00 1.85 1.61 1.01 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 15 K 8.01 3.90 0.00 1.83 1.83 0.00 1.73 0.00 0.00 1.80 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.49 1.50 7.81 16 S 8.10 4.12 0.00 4.00 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 17 F 8.20 3.88 0.00 2.77 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 18 I 7.99 3.36 1.98 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 1.74 0.72 0.89 0.00 0.00 19 E 8.09 3.84 0.00 2.08 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 2.45 2.48 0.00 20 T 7.86 3.85 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 1.50 0.00 0.00 21 V 6.74 3.73 1.03 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 0.15 0.00 0.00 0.24 0.00 0.00 22 G 7.86 3.39 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 0.00 23 A 7.91 3.95 1.35 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 24 N 7.93 4.36 0.00 2.99 2.89 0.00 0.00 7.08 8.02 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 25 L 7.75 4.15 0.00 1.39 1.44 0.55 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 26 N 7.77 4.15 0.00 2.85 2.82 0.00 0.00 6.71 7.55 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 27 K 8.13 4.60 0.00 1.38 1.54 0.00 1.57 0.00 0.00 1.58 0.00 0.00 2.75 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.22 1.21 7.81 28 T 8.24 4.27 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 29 I 8.31 4.96 1.82 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.70 0.91 0.00 0.00 30 I 8.57 4.72 1.88 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 1.22 0.70 0.91 0.00 0.00 31 M 8.38 4.64 0.00 1.77 1.86 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.49 0.00 32 G 8.29 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.36 4.00 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 0.63 0.00 0.00 0.72 0.00 0.00 36 Q 9.34 4.56 0.00 2.06 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 7.01 0.00 0.00 0.00 0.00 0.00 2.29 2.42 0.00 37 G 7.36 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 0.00 0.00 0.00 0.00 38 A 7.70 5.19 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 39 V 9.07 4.32 1.69 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 0.20 0.00 0.00 0.63 0.00 0.00 40 S 8.09 5.09 0.00 3.71 3.70 0.00 0.00 0.00 0.00 0.00 0.00 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 8.48 4.52 1.85 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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2.66 0.00 0.00 6.36 7.01 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 0.00 137 Y 8.64 4.96 0.00 2.82 2.85 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 0.00 0.00 0.00 138 D 8.71 5.20 0.00 2.78 2.67 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 0.00 139 P 0.00 4.37 0.00 2.11 2.14 0.00 3.77 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.12 0.00 140 S 9.90 4.40 0.00 4.01 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 0.00 141 N 8.62 4.34 0.00 3.01 3.00 0.00 0.00 6.93 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 0.00 142 V 7.64 4.67 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 0.73 0.00 0.00 0.96 0.00 0.00 143 I 8.57 4.74 1.80 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 1.03 1.01 0.69 0.00 0.00 144 M 8.90 5.02 0.00 2.00 1.88 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.47 0.00 145 L 9.36 5.13 0.00 1.54 1.49 0.89 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 146 T 9.39 4.91 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 1.20 0.00 0.00 147 G 8.01 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 0.00 0.00 0.00 0.00 148 R 7.73 4.55 0.00 1.90 2.07 0.00 3.32 0.00 0.00 3.16 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.63 0.00 149 A 8.78 4.03 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 0.00 150 S 8.03 4.04 0.00 4.08 4.14 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 0.00 151 V 7.70 3.53 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 1.01 0.00 0.00 0.97 0.00 0.00 152 V 8.26 3.59 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 0.93 0.00 0.00 0.95 0.00 0.00 153 E 8.52 3.93 0.00 2.10 2.17 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 2.30 2.39 0.00 154 R 7.96 4.10 0.00 2.07 1.96 0.00 3.17 0.00 0.00 3.31 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 155 L 8.13 4.03 0.00 1.82 1.69 0.90 0.57 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 0.00 156 T 8.03 3.83 4.38 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 1.21 0.00 0.00 157 E 8.24 3.94 0.00 2.16 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 2.42 0.00 158 V 7.55 3.54 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 1.05 0.00 0.00 0.96 0.00 0.00 159 I 7.61 3.72 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 1.54 0.55 0.92 0.00 0.00 160 Q 8.28 4.00 0.00 2.16 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.82 0.00 0.00 0.00 0.00 0.00 2.39 2.48 0.00 161 R 7.98 3.89 0.00 2.05 2.09 0.00 3.10 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 1.64 1.64 0.00 162 V 7.92 3.62 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 0.96 0.00 0.00 0.95 0.00 0.00 163 D 8.18 4.36 0.00 2.82 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 0.00 164 H 8.15 4.31 0.00 3.28 3.36 0.00 6.00 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 A 7.93 4.30 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 0.00 166 G 7.69 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 0.00 0.00 0.00 167 N 7.53 4.95 0.00 2.62 2.78 0.00 0.00 7.08 7.03 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 0.00 168 R 7.99 4.00 0.00 1.83 2.00 0.00 3.26 0.00 0.00 3.27 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.73 0.00 169 T 8.45 4.17 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 1.20 0.00 0.00 170 E 8.66 4.90 0.00 1.86 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 2.22 2.27 0.00 171 E 8.63 4.68 0.00 2.00 1.71 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 2.19 2.24 0.00 172 V 8.43 4.67 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 0.86 0.00 0.00 0.93 0.00 0.00 173 I 8.94 4.60 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 1.35 0.63 0.91 0.00 0.00 174 P 0.00 4.90 0.00 2.07 2.04 0.00 3.31 0.00 0.00 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.83 0.00 175 L 8.29 4.83 0.00 1.52 1.77 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 176 D 9.15 4.46 0.00 2.70 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 0.00 177 N 8.12 4.66 0.00 2.68 2.83 0.00 0.00 6.86 7.35 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 0.00 178 A 8.31 4.24 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 0.00 179 S 8.31 4.57 0.00 3.90 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 0.00 180 A 9.03 3.96 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 0.00 181 S 8.06 4.08 0.00 3.87 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 0.00 182 E 8.06 3.90 0.00 2.03 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 2.38 2.40 0.00 183 I 7.68 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 1.45 0.52 0.91 0.00 0.00 184 A 7.88 3.94 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 0.00 185 R 8.11 3.79 0.00 2.08 1.94 0.00 3.10 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 1.63 1.64 0.00 186 V 7.75 3.57 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 0.89 0.00 0.00 1.01 0.00 0.00 187 L 8.11 4.14 0.00 1.78 1.69 0.92 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 188 E 8.86 4.03 0.00 2.14 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 2.30 2.39 0.00 189 S 7.92 4.25 0.00 4.09 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 0.00 190 L 7.58 4.47 0.00 1.65 1.71 0.92 0.70 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 0.00 191 T 7.59 4.45 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 1.29 0.00 0.00 *205 Q 8.57 4.20 0.00 2.04 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.63 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00 206 I 8.93 5.06 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 1.11 0.60 0.91 0.00 0.00 207 V 8.56 4.58 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 0.97 0.00 0.00 0.93 0.00 0.00 208 A 8.50 5.11 1.24 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 0.00 0.00 209 D 8.67 4.42 0.00 2.78 2.51 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 0.00 0.00 0.00 0.00 210 E 9.11 3.98 0.00 2.04 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 2.40 2.28 0.00 211 R 7.51 3.73 0.00 2.13 1.98 0.00 3.34 0.00 0.00 3.28 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.62 0.00 212 T 7.91 4.26 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 1.25 0.00 0.00 213 N 7.90 4.10 0.00 2.95 2.79 0.00 0.00 6.92 7.70 0.00 0.00 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 S 8.02 5.21 0.00 3.70 3.68 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 0.00 0.00 0.00 0.00 215 V 8.60 4.67 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 0.95 0.00 0.00 0.93 0.00 0.00 216 I 8.83 4.85 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 1.11 0.71 0.91 0.00 0.00 217 V 8.82 4.64 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 0.98 0.00 0.00 0.93 0.00 0.00 218 S 8.49 4.52 0.00 3.80 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 0.00 219 G 8.10 4.09 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 0.00 0.00 0.00 220 D 8.60 5.20 0.00 2.80 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 0.00 221 P 0.00 4.29 0.00 2.28 2.39 0.00 3.71 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.08 0.00 222 A 7.92 4.01 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 0.00 223 T 7.77 3.94 4.31 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 1.21 0.00 0.00 224 R 8.50 3.95 0.00 1.80 1.98 0.00 3.13 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 225 D 7.86 4.33 0.00 2.91 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 0.00 226 K 7.73 4.01 0.00 2.05 1.84 0.00 1.72 0.00 0.00 1.57 0.00 0.00 3.07 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.56 7.81 227 M 8.22 4.07 0.00 2.14 2.16 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.58 0.00 228 R 8.11 3.81 0.00 2.15 1.90 0.00 3.16 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 229 R 7.64 3.93 0.00 1.88 1.98 0.00 3.19 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.79 0.00 230 L 7.42 3.98 0.00 1.74 1.86 0.92 1.03 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 0.00 231 I 7.70 3.84 2.03 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 1.04 0.91 0.00 0.00 232 R 8.34 3.93 0.00 1.91 2.01 0.00 3.29 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 1.87 1.85 0.00 233 R 8.16 3.93 0.00 1.95 2.00 0.00 3.16 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.86 0.00 234 L 7.69 4.17 0.00 1.81 1.72 0.98 0.91 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 0.00 235 D 7.94 4.48 0.00 2.79 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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.