NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 M 4.0738 8.1585 120.3155 55.3771 32.9763 175.1932 *79 A 4.3416 8.4085 125.5791 51.3532 21.0140 175.3955 80 L 5.1144 7.5790 115.2167 53.5488 44.2896 174.8564 81 Y 4.8611 8.7696 122.2683 56.1683 42.1722 174.4083 82 R 4.8122 8.6647 123.3690 55.1153 31.9308 175.0040 83 V 4.5940 8.9736 127.3019 61.0752 34.1084 174.1073 84 V 4.5677 8.3628 128.5107 61.2334 33.4949 174.2379 85 L 4.9412 8.6724 128.6668 53.8023 42.5353 176.1274 86 L 4.4348 10.0528 123.9359 52.4787 45.4795 175.2269 87 G 4.6271 8.3863 105.7710 43.9971 0.0000 173.0719 88 D 4.7116 8.3947 121.1869 53.3496 41.5425 174.6890 89 P 4.4577 0.0000 0.0000 64.0800 31.7537 177.4493 90 G 4.0351 8.9290 109.6830 45.5880 0.0000 174.7535 91 V 3.7979 7.0798 111.8790 62.1269 32.1024 176.8147 92 G 4.2797 8.4479 109.8365 45.7909 0.0000 176.2195 93 K 3.9452 8.5738 120.5042 59.7135 32.0450 179.1641 94 T 4.0575 7.7790 116.6825 66.1431 68.4647 176.8454 95 S 4.1148 8.0141 116.6751 61.5284 62.9488 176.5219 96 L 4.0517 8.0904 121.4510 57.7830 41.3023 179.4406 97 A 3.7926 7.9423 120.6856 55.1630 18.1933 179.9135 98 S 4.0863 8.1345 113.8885 61.7006 62.6653 176.9309 99 L 4.0319 7.6786 120.6991 57.6038 41.3922 179.0108 100 F 4.0229 7.9893 119.6965 61.0628 39.2898 176.7722 101 A 3.8614 8.0708 119.8721 53.8691 18.2983 178.0572 102 G 4.0380 7.9897 109.0561 46.7125 0.0000 175.0549 *111 Q 4.1759 7.8665 118.2870 54.9738 29.8422 177.9766 112 L 4.9907 8.0389 118.4188 53.3187 45.3396 177.0899 113 G 4.1510 8.0991 116.3541 44.9332 0.0000 175.7923 114 E 4.3263 8.6930 124.2312 54.5110 31.0754 174.4891 115 D 4.3652 8.5760 118.2763 56.4487 41.3201 177.0600 116 V 4.4354 7.7913 122.7128 59.7297 34.8125 171.4027 117 Y 4.7385 8.5629 119.3136 56.1905 40.9573 174.3705 118 E 5.3379 8.8456 124.5853 54.5008 32.7249 174.6134 119 R 4.5508 9.0098 125.4098 55.4740 34.2506 173.4791 120 T 4.9664 8.4110 121.8874 62.3623 69.7419 173.9123 121 L 4.7672 9.2306 127.3308 53.2382 44.6288 175.7240 122 T 4.9450 8.4461 119.7979 62.2859 69.8619 174.5802 123 V 4.3391 8.7710 126.2673 62.5212 34.7668 174.8810 124 D 4.5288 9.8919 126.4092 55.5550 38.3576 174.4868 125 G 3.9495 8.4320 102.5779 45.7954 0.0000 173.0570 126 E 4.7322 8.1135 120.0596 54.2467 33.1287 174.2741 127 D 5.3142 8.7701 125.9097 54.2919 42.4958 176.0307 128 T 4.7507 8.9493 118.1074 62.6912 73.7597 172.7821 129 T 4.9398 8.9156 122.9574 62.4184 70.5768 173.6765 130 L 5.2741 8.9453 126.0105 52.9743 45.0779 175.5568 131 V 4.6481 8.8710 123.8256 61.4285 33.6683 174.4033 132 V 4.6449 9.3361 130.0706 61.4304 33.2325 174.4421 133 V 4.5628 8.8637 128.9836 60.9056 32.8349 175.2790 134 D 5.2531 8.4820 126.3069 53.6440 41.0013 175.5014 135 T 4.7653 7.7639 105.1436 60.8349 70.1729 174.3922 136 W 4.4030 8.4373 134.4706 58.4347 30.9312 174.8068 137 E 4.0450 7.9377 121.1272 56.0403 32.6229 173.6413 *144 S 4.3382 7.6409 110.1137 57.3663 64.3013 174.3717 145 W 4.3958 8.8177 135.0000 60.7863 30.5946 178.1464 146 S 3.9591 8.0871 113.7736 61.3406 62.1777 176.1017 147 Q 4.0098 7.6423 121.7092 58.9027 29.1836 177.1745 148 E 4.2499 8.3913 122.8175 60.5277 29.5997 179.6954 149 S 4.3290 8.7476 118.7292 63.5871 62.1005 178.0553 150 C 4.5672 8.5428 123.2543 62.4618 31.3954 175.3412 151 L 4.4443 7.9993 121.6446 56.8212 40.9216 181.1509 152 Q 4.8502 8.1319 115.5076 57.6245 31.1080 176.7375 153 G 4.2750 8.5175 105.8943 44.6270 0.0000 173.1156 154 G 3.6458 7.9837 107.2279 43.9862 0.0000 174.4828 155 S 4.4158 8.6481 118.8336 60.8591 63.5731 174.5243 156 A 4.7241 7.3787 118.9859 50.5788 22.8311 174.6272 157 Y 4.9444 8.7150 117.1929 56.0952 41.6851 175.0584 158 V 4.5495 8.8463 124.5125 61.3545 33.7323 174.5119 159 I 4.6159 8.5342 130.7343 60.2427 38.2984 175.1477 160 V 4.8356 8.8702 128.6980 61.3805 33.6510 174.2138 161 Y 5.0525 8.7679 124.8250 55.3291 42.3957 173.6326 162 S 5.2112 8.7222 114.4423 56.5865 63.6469 175.1096 163 I 3.9762 8.7918 120.7701 63.2522 37.4212 176.9880 164 A 4.7312 8.0911 122.3937 51.4853 19.1502 176.9493 165 D 4.7149 8.2129 116.4962 51.2105 42.4209 175.3429 166 R 4.0469 10.6400 127.2369 59.4576 30.0108 177.8110 167 G 3.8235 8.3829 104.8756 48.1442 0.0000 175.5399 168 S 4.4341 8.2826 116.4576 61.0406 63.0206 176.3944 169 F 3.8509 8.1823 123.8670 61.0129 39.2760 176.7363 170 E 3.7015 8.2817 118.5255 59.3412 29.2599 179.4800 171 S 4.1553 7.9722 113.6182 60.8222 63.2441 176.1924 172 A 3.8812 7.9613 124.4432 55.1197 17.7551 179.0972 173 S 3.7361 7.5405 111.4450 61.8361 62.1768 176.3818 174 E 3.8525 7.8351 120.6476 58.7636 29.1881 178.7313 175 L 3.8882 7.7250 119.7258 57.4204 41.7286 179.2121 176 R 3.6948 7.9542 116.2447 59.3314 28.7432 179.0804 177 I 2.8673 7.0568 120.1208 63.8619 36.8377 178.3938 178 Q 3.9179 7.3995 117.4682 58.8584 28.8318 178.1341 179 L 3.9309 7.8275 121.0617 57.7699 41.5305 179.6930 180 R 4.7867 7.7172 119.3958 58.5505 30.0492 179.2817 181 R 4.1762 7.4738 119.0817 60.1093 29.4564 182.3988 182 T 4.4872 8.0938 112.7274 65.1244 70.7635 174.0471 183 H 4.8864 7.7811 119.0148 53.7570 30.3633 174.0401 184 Q 4.3181 8.5160 123.5051 55.3596 29.5146 177.2922 185 A 3.9792 8.8744 126.2333 56.1834 18.6781 180.4335 186 D 4.4923 8.3840 115.5550 56.7588 40.0550 179.4884 *187 H 4.6491 7.7457 113.6490 55.5450 29.1325 178.5184 188 V 4.4226 7.8479 121.1417 60.0414 33.3924 173.7773 189 P 4.5389 0.0000 0.0000 62.5527 32.8923 175.5457 190 I 5.1103 8.3679 123.5453 59.6363 40.8379 174.1184 191 I 4.8516 8.7751 128.3507 59.4507 39.8016 174.3612 192 L 4.9378 9.2111 130.2640 53.9751 43.6365 175.1375 193 V 4.4564 9.1102 127.3141 61.0242 34.2546 174.5719 194 G 3.2520 8.2194 116.1569 44.5645 0.0000 172.5708 195 N 5.0019 8.8741 126.5578 51.5908 41.3997 174.5167 196 K 4.1073 8.5758 117.0761 57.3080 29.0633 178.4483 197 A 4.0194 8.0329 124.1677 54.9898 18.4196 179.8071 198 D 4.4313 8.0118 114.2218 55.8366 40.4950 176.9012 199 L 4.3396 7.8583 122.9421 53.8396 40.3861 177.7641 200 A 4.0492 7.7528 124.6821 55.3319 19.1761 180.6111 201 R 3.9694 8.0037 113.5829 58.9006 29.9795 177.1893 202 C 4.5369 7.8973 113.4871 58.9850 28.4821 173.2864 203 R 4.2847 7.4286 120.5354 57.1786 29.9370 175.7072 204 E 4.4328 9.4773 124.8863 56.9191 31.3794 176.5685 205 V 4.1140 7.5211 117.7062 61.1831 33.0259 175.8964 206 S 4.5699 9.0053 122.6396 57.3497 65.6062 175.5063 207 V 3.7730 8.2663 122.1631 66.3065 31.2528 178.0960 208 E 3.9217 8.0964 117.1382 59.1458 29.6949 178.7277 209 E 4.1432 8.0408 118.5493 58.8209 29.6113 179.5033 210 G 3.4277 7.6392 106.3585 47.5942 0.0000 175.6568 211 R 3.1801 7.1814 120.9960 58.6838 30.1868 178.9686 212 A 3.9404 8.3450 120.4848 55.3393 18.1492 179.1280 213 C 4.0754 7.9909 115.8377 62.5409 31.7830 175.4556 214 A 4.2011 7.8555 122.3600 55.0899 17.9611 179.7622 215 V 3.4924 7.7641 116.7573 66.2644 31.4275 178.1120 216 V 3.4823 7.3092 116.4878 65.4471 31.2961 176.4747 217 F 4.6793 7.9874 115.9469 57.0552 39.9455 174.7554 218 D 4.3666 8.1046 117.8663 55.5419 38.7140 173.4441 219 C 4.7351 8.1648 115.1932 59.0413 30.3339 175.2689 220 K 4.6172 8.5870 120.2429 55.6732 34.0371 175.6500 221 F 5.4983 8.4738 122.8743 56.9194 42.5494 173.3927 222 I 4.1561 7.6971 123.7719 59.5332 41.8948 172.8156 223 E 5.0058 8.2205 126.0930 54.7006 31.1523 175.2299 224 T 4.7531 8.4897 113.0853 59.9246 73.2672 172.7594 225 S 4.8507 8.7741 115.5355 56.7905 65.2306 174.6534 226 A 4.0285 8.6426 131.3212 55.0199 18.4964 179.3134 227 T 4.1661 7.8139 105.0726 63.8528 69.3746 175.6391 228 L 4.1913 7.8132 119.8713 54.4405 42.5374 176.1656 229 Q 3.3836 7.1949 116.0333 57.3968 26.7832 173.4046 230 H 4.7552 8.3663 117.1677 55.4783 32.0630 174.0412 231 N 4.3718 8.7092 121.3318 54.0164 36.6300 176.2652 232 V 3.4825 7.6394 118.8237 65.9532 31.6873 177.5260 233 A 4.1633 8.0873 120.0381 55.6229 17.6716 179.3672 234 E 3.8882 8.1405 116.2782 59.1090 29.4779 179.1720 235 L 3.7344 7.8567 120.6871 58.3206 42.3124 179.2038 236 F 4.2086 7.9100 117.3141 60.4129 38.8307 177.7276 237 E 4.2017 8.7991 118.9878 59.1585 29.1389 179.5576 238 G 3.5397 8.0980 106.0030 47.6527 0.0000 175.8324 239 V 3.4855 7.8263 120.8459 65.6455 31.5051 178.0431 240 V 3.4982 7.6180 117.4718 66.2511 31.3519 178.1381 241 R 3.9060 7.9126 117.4828 59.5008 29.7957 179.1453 242 Q 3.9837 8.2529 117.8886 58.9308 28.4388 178.8671 243 L 3.8203 7.7023 119.2361 57.6652 41.5627 179.4706 244 R 4.0999 7.7121 117.4275 59.0074 30.0730 178.6663 245 L 4.2289 7.8656 120.2815 57.5396 41.7214 178.4390 246 R 4.2537 7.5228 124.7022 58.8281 29.4848 180.8288 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 0 M 8.16 4.07 0.00 1.43 1.90 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.47 0.00 *79 A 8.41 4.34 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 80 L 7.58 5.11 0.00 1.55 1.43 1.04 0.79 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 81 Y 8.77 4.86 0.00 2.97 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 82 R 8.66 4.81 0.00 1.91 1.77 0.00 3.03 0.00 0.00 3.29 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.54 0.00 83 V 8.97 4.59 1.99 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 0.84 0.00 0.00 0.89 0.00 0.00 84 V 8.36 4.57 1.99 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 1.19 0.00 0.00 0.85 0.00 0.00 85 L 8.67 4.94 0.00 1.75 1.62 0.93 0.81 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 86 L 10.05 4.43 0.00 1.21 0.75 0.45 -0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 87 G 8.39 4.63 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 0.00 0.00 0.00 88 D 8.39 4.71 0.00 2.90 2.69 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 89 P 0.00 4.46 0.00 2.07 2.02 0.00 3.74 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.10 0.00 90 G 8.93 4.04 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 0.00 0.00 0.00 91 V 7.08 3.80 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 0.83 0.00 0.00 1.09 0.00 0.00 92 G 8.45 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 0.00 0.00 0.00 0.00 93 K 8.57 3.95 0.00 1.87 2.05 0.00 1.77 0.00 0.00 2.10 0.00 0.00 3.22 0.00 0.00 3.37 0.00 0.00 0.00 0.00 1.56 1.59 7.81 94 T 7.78 4.06 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 95 S 8.01 4.11 0.00 3.99 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 96 L 8.09 4.05 0.00 1.89 1.84 0.88 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 97 A 7.94 3.79 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 S 8.13 4.09 0.00 4.06 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 99 L 7.68 4.03 0.00 1.89 1.79 1.00 0.84 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 0.00 100 F 7.99 4.02 0.00 1.83 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 0.00 101 A 8.07 3.86 1.51 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 0.00 0.00 102 G 7.99 4.04 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 0.00 0.00 0.00 *111 Q 7.87 4.18 0.00 2.11 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.98 6.64 0.00 0.00 0.00 0.00 0.00 2.18 1.93 0.00 112 L 8.04 4.99 0.00 1.60 1.41 0.92 0.74 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 0.00 113 G 8.10 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 0.00 0.00 0.00 0.00 114 E 8.69 4.33 0.00 2.00 1.80 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 2.23 1.90 0.00 115 D 8.58 4.37 0.00 2.56 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 0.00 0.00 0.00 116 V 7.79 4.44 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 0.76 0.00 0.00 0.93 0.00 0.00 117 Y 8.56 4.74 0.00 3.20 3.07 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 0.00 118 E 8.85 5.34 0.00 1.96 1.78 0.00 0.00 0.00 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 2.31 0.00 119 R 9.01 4.55 0.00 1.34 0.84 0.00 2.73 0.00 0.00 2.52 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.38 0.00 120 T 8.41 4.97 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 1.22 0.00 0.00 121 L 9.23 4.77 0.00 1.62 1.61 1.15 0.77 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 0.00 122 T 8.45 4.94 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 1.24 0.00 0.00 123 V 8.77 4.34 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 1.02 0.00 0.00 0.98 0.00 0.00 124 D 9.89 4.53 0.00 2.81 2.69 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 0.00 125 G 8.43 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 0.00 0.00 0.00 126 E 8.11 4.73 0.00 2.03 1.90 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 2.22 2.28 0.00 127 D 8.77 5.31 0.00 2.62 2.59 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 0.00 128 T 8.95 4.75 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 1.45 0.00 0.00 129 T 8.92 4.94 4.35 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 1.25 0.00 0.00 130 L 8.95 5.27 0.00 1.79 1.50 0.99 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 131 V 8.87 4.65 2.11 0.00 0.00 0.00 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 0.96 0.00 0.00 132 V 9.34 4.64 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 0.77 0.00 0.00 -0.23 0.00 0.00 133 V 8.86 4.56 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 1.01 0.00 0.00 0.95 0.00 0.00 134 D 8.48 5.25 0.00 2.82 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 0.00 135 T 7.76 4.77 4.29 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 1.26 0.00 0.00 136 W 8.44 4.40 0.00 3.42 3.08 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 0.00 137 E 7.94 4.04 0.00 1.91 1.68 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 2.15 2.09 0.00 *144 S 7.64 4.34 0.00 3.93 3.82 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 0.00 145 W 8.82 4.40 0.00 3.40 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 0.00 146 S 8.09 3.96 0.00 4.01 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 0.00 147 Q 7.64 4.01 0.00 2.06 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.92 0.00 0.00 0.00 0.00 0.00 2.17 2.50 0.00 148 E 8.39 4.25 0.00 2.21 2.38 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 2.47 2.45 0.00 149 S 8.75 4.33 0.00 3.74 3.87 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 0.00 150 C 8.54 4.57 0.00 3.07 3.52 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 0.00 151 L 8.00 4.44 0.00 1.79 1.54 0.92 0.68 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 0.00 152 Q 8.13 4.85 0.00 2.39 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.47 0.00 0.00 0.00 0.00 0.00 2.25 1.88 0.00 153 G 8.52 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 0.00 0.00 0.00 0.00 154 G 7.98 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 0.00 155 S 8.65 4.42 0.00 3.86 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 0.00 156 A 7.38 4.72 1.04 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 0.00 0.00 157 Y 8.72 4.94 0.00 2.90 2.70 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 0.00 158 V 8.85 4.55 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 0.86 0.00 0.00 0.79 0.00 0.00 159 I 8.53 4.62 1.88 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 0.96 0.34 0.87 0.00 0.00 160 V 8.87 4.84 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 0.90 0.00 0.00 0.87 0.00 0.00 161 Y 8.77 5.05 0.00 3.07 3.19 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 0.00 162 S 8.72 5.21 0.00 4.02 3.87 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 0.00 163 I 8.79 3.98 1.94 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 1.37 0.69 1.03 0.00 0.00 164 A 8.09 4.73 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 0.00 165 D 8.21 4.71 0.00 2.78 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 R 10.64 4.05 0.00 2.14 1.98 0.00 3.22 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.80 0.00 167 G 8.38 3.82 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 0.00 0.00 0.00 168 S 8.28 4.43 0.00 4.25 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 0.00 169 F 8.18 3.85 0.00 2.63 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 E 8.28 3.70 0.00 2.33 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 2.33 2.19 0.00 171 S 7.97 4.16 0.00 4.07 4.13 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.96 3.88 1.43 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 0.00 0.00 173 S 7.54 3.74 0.00 3.30 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 0.00 174 E 7.84 3.85 0.00 2.27 1.86 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 2.30 2.22 0.00 175 L 7.72 3.89 0.00 1.87 1.45 0.63 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 176 R 7.95 3.69 0.00 1.84 2.08 0.00 2.68 0.00 0.00 3.27 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.52 0.00 177 I 7.06 2.87 1.79 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 0.87 0.66 0.74 0.00 0.00 178 Q 7.40 3.92 0.00 2.07 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.95 0.00 0.00 0.00 0.00 0.00 2.33 2.25 0.00 179 L 7.83 3.93 0.00 1.59 1.50 0.47 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 180 R 7.72 4.79 0.00 1.64 2.08 0.00 3.45 0.00 0.00 3.40 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 181 R 7.47 4.18 0.00 1.92 1.84 0.00 3.21 0.00 0.00 3.22 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.54 0.00 182 T 8.09 4.49 3.85 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 1.12 0.00 0.00 183 H 7.78 4.89 0.00 3.26 3.28 0.00 5.81 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 Q 8.52 4.32 0.00 2.15 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.91 0.00 0.00 0.00 0.00 0.00 2.48 2.38 0.00 185 A 8.87 3.98 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 0.00 186 D 8.38 4.49 0.00 2.71 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 *187 H 7.75 4.65 0.00 2.91 2.98 0.00 7.11 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 V 7.85 4.42 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 1.07 0.00 0.00 1.02 0.00 0.00 189 P 0.00 4.54 0.00 2.06 1.91 0.00 3.72 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.04 0.00 190 I 8.37 5.11 1.90 0.00 0.00 0.84 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 0.92 0.95 0.00 0.00 191 I 8.78 4.85 1.78 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 1.02 0.91 0.81 0.00 0.00 192 L 9.21 4.94 0.00 1.87 1.96 1.15 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 193 V 9.11 4.46 1.92 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 0.64 0.00 0.00 0.73 0.00 0.00 194 G 8.22 3.25 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 0.00 195 N 8.87 5.00 0.00 2.69 2.81 0.00 0.00 7.10 7.09 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 0.00 196 K 8.58 4.11 0.00 2.04 1.92 0.00 1.75 0.00 0.00 1.84 0.00 0.00 2.90 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.41 1.42 7.81 197 A 8.03 4.02 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 0.00 198 D 8.01 4.43 0.00 2.77 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 0.00 199 L 7.86 4.34 0.00 1.87 1.68 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 200 A 7.75 4.05 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 0.00 201 R 8.00 3.97 0.00 1.82 2.01 0.00 3.19 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 202 C 7.90 4.54 0.00 3.01 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 0.00 203 R 7.43 4.28 0.00 1.79 1.87 0.00 3.22 0.00 0.00 3.29 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 204 E 9.48 4.43 0.00 1.94 1.95 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 2.25 2.40 0.00 205 V 7.52 4.11 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 -0.22 0.00 0.00 0.67 0.00 0.00 206 S 9.01 4.57 0.00 4.00 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 0.00 207 V 8.27 3.77 2.13 0.00 0.00 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 1.07 0.00 0.00 208 E 8.10 3.92 0.00 2.15 2.16 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 2.32 2.28 0.00 209 E 8.04 4.14 0.00 2.00 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 0.00 2.17 2.30 0.00 210 G 7.64 3.43 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 0.00 0.00 0.00 211 R 7.18 3.18 0.00 1.84 1.87 0.00 3.13 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 1.71 1.65 0.00 212 A 8.35 3.94 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 0.00 213 C 7.99 4.08 0.00 3.32 3.27 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.86 4.20 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.76 3.49 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 1.03 0.00 0.00 0.95 0.00 0.00 216 V 7.31 3.48 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 0.41 0.00 0.00 0.97 0.00 0.00 217 F 7.99 4.68 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 0.00 218 D 8.10 4.37 0.00 2.76 2.70 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 0.00 219 C 8.16 4.74 0.00 2.93 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 0.00 220 K 8.59 4.62 0.00 1.70 1.73 0.00 1.64 0.00 0.00 1.61 0.00 0.00 2.76 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.52 7.81 221 F 8.47 5.50 0.00 2.94 2.90 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 0.00 222 I 7.70 4.16 1.65 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.92 0.64 0.00 0.00 223 E 8.22 5.01 0.00 1.72 1.72 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 2.05 2.02 0.00 224 T 8.49 4.75 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 1.03 0.00 0.00 225 S 8.77 4.85 0.00 3.88 3.72 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 0.00 226 A 8.64 4.03 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 0.00 227 T 7.81 4.17 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 1.22 0.00 0.00 228 L 7.81 4.19 0.00 1.97 1.77 0.92 0.89 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 0.00 229 Q 7.19 3.38 0.00 2.27 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.60 0.00 0.00 0.00 0.00 0.00 2.32 2.28 0.00 230 H 8.37 4.76 0.00 3.08 3.12 0.00 5.70 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 231 N 8.71 4.37 0.00 2.64 2.70 0.00 0.00 7.27 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 0.00 232 V 7.64 3.48 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 1.27 0.00 0.00 0.99 0.00 0.00 233 A 8.09 4.16 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 0.00 234 E 8.14 3.89 0.00 2.13 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 2.37 2.41 0.00 235 L 7.86 3.73 0.00 1.54 1.56 0.58 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 236 F 7.91 4.21 0.00 3.30 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 0.00 237 E 8.80 4.20 0.00 2.09 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 2.40 2.55 0.00 238 G 8.10 3.54 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 0.00 0.00 0.00 239 V 7.83 3.49 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 0.90 0.00 0.00 0.80 0.00 0.00 240 V 7.62 3.50 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 1.01 0.00 0.00 1.01 0.00 0.00 241 R 7.91 3.91 0.00 2.05 1.95 0.00 3.17 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.88 0.00 242 Q 8.25 3.98 0.00 2.10 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.80 0.00 0.00 0.00 0.00 0.00 2.55 2.51 0.00 243 L 7.70 3.82 0.00 1.28 0.77 0.39 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 244 R 7.71 4.10 0.00 1.95 2.00 0.00 3.17 0.00 0.00 3.25 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.78 0.00 245 L 7.87 4.23 0.00 1.79 1.72 0.91 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 246 R 7.52 4.25 0.00 1.86 1.72 0.00 3.30 0.00 0.00 3.26 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.53 0.00 * Residues marked with a * may have inaccurate shift predictions.