NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.3046 7.8827 121.4510 61.1705 38.8391 173.7974 17 V 4.3347 8.4519 125.0554 61.7075 33.1866 174.5104 18 G 3.8102 8.5102 113.7761 46.5453 0.0000 173.0966 19 G 4.0856 7.6854 109.3417 43.9243 0.0000 172.0493 20 Y 4.9664 7.7520 116.6592 55.1159 42.2403 174.6601 21 T 4.4150 8.5886 116.5379 63.6261 68.3309 175.9078 22 C 4.3911 8.6544 125.5138 59.1343 36.0048 175.3271 23 G 4.0681 8.6765 106.7655 44.6686 0.0000 172.7693 24 A 4.1981 8.5633 125.6380 53.3733 18.6782 176.5441 25 N 4.2633 8.8335 118.0723 54.3885 36.3714 175.5137 26 T 4.1953 7.5736 108.3511 62.7738 69.8605 175.1773 27 V 4.0454 7.0875 122.5967 60.0540 31.1887 173.6154 28 P 4.5735 0.0000 0.0000 63.5880 32.0368 178.0339 29 Y 4.8424 6.7547 115.8671 56.1863 38.7979 174.7123 30 Q 4.6105 7.3682 123.4372 56.3584 29.3724 175.3734 31 V 4.8543 8.9661 118.5689 59.6645 36.2641 174.1594 32 S 4.8984 8.6007 116.2503 56.5879 65.4606 172.4932 33 L 4.7455 8.3702 126.3435 52.8674 43.8293 174.9066 34 N 5.7634 8.9267 122.2566 50.0521 42.2328 174.9176 *37 S 4.4548 8.4915 119.8726 58.5354 64.2331 174.5262 38 G 4.0696 9.4615 109.0185 46.3797 0.0000 173.0942 39 Y 4.5341 6.8246 115.5742 56.3426 40.0861 172.4789 40 H 4.6597 8.7615 121.1026 55.6487 30.5093 174.7867 41 F 4.8378 7.5169 119.0713 57.0095 39.5910 173.6545 42 C 4.6966 6.6314 116.5697 56.2206 43.1086 172.8464 43 G 4.3036 8.7174 108.4567 45.3215 0.0000 172.0609 44 G 4.3757 7.9350 104.9538 46.4664 0.0000 172.5989 45 S 5.4952 8.7895 115.9329 56.4240 66.4827 173.5993 46 L 4.7095 9.0391 127.1562 54.6374 42.5020 177.0567 47 I 4.5462 8.5363 119.1734 61.0537 38.9302 174.4881 48 N 4.8816 7.6564 117.3674 51.7489 39.7941 175.0602 49 S 4.2972 8.6987 112.1200 60.4051 63.2624 174.7479 50 Q 4.5393 9.1196 121.5177 55.2943 30.7679 174.2825 51 W 5.4485 8.4088 116.5659 55.3615 33.4344 174.3995 52 V 5.1441 8.8961 122.9406 61.0473 34.7179 174.3569 53 V 5.0024 8.8094 125.9210 60.4564 34.2028 174.8038 54 S 4.6824 8.9420 117.2253 57.7070 66.0609 171.9796 55 A 5.0022 8.4864 119.9031 50.5149 20.9418 178.3974 56 A 3.8466 8.1947 123.9950 55.1896 18.5080 179.1379 57 H 4.5571 8.2838 109.1169 57.0981 28.5544 175.2269 58 C 4.7887 7.8300 117.0475 56.9875 40.6536 173.4317 59 Y 4.1617 7.7321 121.6791 57.5951 38.8189 174.9822 60 K 3.7090 6.3224 122.9834 56.5798 34.4164 173.8873 61 S 4.3517 8.2248 114.1020 57.7267 65.2522 173.1754 62 G 3.5689 8.4219 105.8551 46.6781 0.0000 173.5800 63 I 4.6697 7.2820 118.4522 59.2846 40.5277 175.9468 64 Q 4.7921 8.7253 127.0448 54.2198 32.0348 174.0974 65 V 4.3320 8.8715 126.5604 61.6379 33.7556 174.5841 65A R 5.1093 8.7115 126.5828 54.6378 32.5341 174.8441 66 L 4.7246 8.9867 124.6050 52.6322 44.7877 177.2777 *69 G 4.1611 8.2543 106.7874 46.2784 0.0000 172.7728 70 E 4.6335 8.4398 118.7404 55.5202 30.1773 174.5399 71 D 4.8242 8.2040 118.5411 54.7992 45.7474 174.1742 72 N 5.1105 7.9714 120.0743 52.2467 39.2512 175.8657 73 I 3.7506 8.3266 119.7622 62.1942 37.8788 176.2490 74 N 4.7560 8.5724 118.0145 53.0431 39.3176 174.7755 75 V 4.4016 7.3156 117.2879 60.6992 34.2228 174.6770 76 V 4.2544 8.3079 126.1439 62.1379 32.1179 175.2599 77 E 4.5372 9.4600 124.8631 54.7875 31.3563 175.9385 78 G 4.0092 9.0083 106.5900 45.6880 0.0000 174.3533 79 N 4.5859 8.9898 116.2866 52.9363 36.9157 174.5053 80 E 4.5361 7.6777 117.0259 56.3327 30.6731 176.2940 81 Q 4.4427 9.2137 121.3461 54.2172 32.8729 174.0502 82 F 5.5498 8.8727 122.6386 55.9706 41.1554 175.0581 83 I 4.7165 8.6791 124.3637 59.4624 41.0392 175.5461 84 S 4.6576 8.6402 121.5420 58.0892 64.4448 173.1373 85 A 4.4181 8.1666 124.5649 52.2095 18.5001 177.6833 86 S 4.4259 8.9955 118.3552 60.3566 63.2544 174.3925 87 K 4.7911 7.6575 116.6826 55.5273 36.0758 174.7902 88 S 5.2256 8.8028 117.0118 56.9787 66.0341 173.7517 89 I 4.4649 9.2513 125.9636 59.5450 38.6427 175.0053 90 V 4.2414 8.2773 127.1933 62.0371 32.6525 175.3249 91 H 3.8545 8.6369 126.6122 55.8246 30.1329 174.5612 92 P 4.3054 0.0000 0.0000 65.3469 31.3327 177.2366 93 S 4.7038 7.9313 111.8425 58.1718 62.9123 173.3238 94 Y 4.3176 8.0217 123.2425 57.5705 39.0959 174.3130 95 N 4.5715 8.0260 125.1293 51.4543 40.2049 175.1670 96 S 3.9470 7.8826 119.7969 59.3532 63.6694 174.8151 97 N 4.4502 8.5063 119.1274 54.8315 38.8314 176.0140 98 T 4.0584 7.7302 105.7584 60.6750 70.1483 174.7000 99 L 3.8073 7.7610 120.7416 55.6274 39.6985 174.0367 100 N 4.5295 7.6668 117.0215 54.4401 39.7855 174.2226 101 N 5.0295 8.5946 118.3044 53.9354 36.0278 175.7966 102 D 4.7159 7.8130 117.6571 52.9871 39.6266 175.1647 103 I 4.8156 7.1048 120.8562 59.2944 42.5181 173.2070 104 M 5.4150 8.9859 126.2610 54.1474 36.2608 173.3898 105 L 5.3697 9.0468 124.3924 53.1579 45.1906 175.3900 106 I 5.0177 8.7989 122.7097 59.4838 40.7088 174.4822 107 K 3.7373 8.8597 128.3200 54.7222 33.8461 175.4770 108 L 4.5374 7.8220 126.1339 53.4767 42.6114 176.9335 109 K 4.1817 8.8005 123.9392 58.9892 32.5860 177.1984 110 S 4.6425 7.7255 111.2142 55.8218 66.1762 173.2203 111 A 4.4211 8.3343 122.6567 52.0526 18.8737 177.1726 112 A 4.4723 8.6448 122.2817 51.5136 20.1716 177.3045 113 S 4.5683 8.8053 116.2923 57.5031 63.6827 174.6065 114 L 4.7049 8.4623 125.0270 54.1165 43.4380 176.4465 115 N 4.6126 8.4346 117.8245 53.1591 39.8982 174.6403 116 S 4.4194 8.7736 110.5207 60.1399 63.7827 175.1537 117 R 4.2333 8.9683 120.3958 56.7871 30.7133 176.0417 118 V 4.6836 7.8507 117.0776 60.8594 33.7103 173.6333 119 A 5.1225 8.6666 128.0292 50.5794 22.9913 175.2908 120 S 4.8219 8.6693 114.4264 57.7175 64.9795 172.9624 121 I 4.5055 8.0142 120.2315 59.2335 39.9708 175.2196 122 S 4.5368 8.3075 122.5104 57.6456 63.9793 174.0692 123 L 4.3171 8.0925 123.1103 53.5338 42.4095 175.1520 124 P 4.6118 0.0000 0.0000 62.6725 32.6736 176.0597 125 T 4.2562 8.1520 107.4733 61.8871 70.0975 174.1936 *127 S 4.9165 7.5648 115.1663 58.3465 63.9882 173.8027 128 C 4.4753 8.3938 118.1212 56.3758 40.9676 173.0730 129 A 4.5806 7.8995 123.5797 51.0522 20.5786 176.7719 130 S 4.4365 7.9807 114.8692 56.9113 65.0738 173.6437 *132 A 4.3272 8.1362 123.9049 53.2104 19.2785 175.9550 133 G 4.0937 9.0038 108.4177 45.6379 0.0000 174.9297 134 T 3.9369 7.6758 116.4727 63.7968 69.4834 173.4501 135 Q 4.8152 8.5481 126.9476 55.5080 30.3765 175.1526 136 C 5.2491 9.3707 122.4684 55.1744 46.4602 172.2357 137 L 5.1458 8.9778 122.6228 53.5790 43.9323 175.0473 138 I 5.2715 9.1304 127.1631 58.7710 40.1555 174.7929 139 S 5.4508 8.3168 119.0846 55.3295 66.6656 172.9881 140 G 3.8052 7.2373 108.0910 46.0323 0.0000 172.5778 141 W 4.6075 8.4956 117.3423 56.2400 29.5355 176.9407 142 G 4.2142 8.1899 108.7701 43.8371 0.0000 173.5220 143 N 3.8349 8.7149 117.9551 54.5116 38.9066 174.4951 144 T 5.1497 8.1357 112.5806 60.5089 69.6426 174.2193 145 K 4.6445 7.8222 121.3641 54.8012 34.7809 176.1530 146 S 4.3434 8.5824 116.2357 59.5759 63.7489 174.1470 147 S 4.4140 7.7852 116.3034 58.7946 63.1107 172.5654 148 G 3.9347 8.4103 110.9586 44.0377 0.0000 170.8783 149 T 4.4847 8.1984 109.3246 59.7402 70.8179 174.1140 150 S 4.3651 9.1827 121.0885 57.0618 65.3715 171.7604 151 Y 5.0227 8.6022 125.3736 55.7637 39.4751 174.4673 152 P 4.7334 0.0000 0.0000 62.2825 33.2805 175.4302 153 D 4.6613 8.6925 116.8647 55.7351 41.6835 177.2812 154 V 5.7981 7.3836 109.7721 58.4733 34.5534 175.7640 155 L 3.2142 8.6684 124.2805 55.1199 42.9791 175.7395 156 K 4.8993 8.2986 125.1955 54.8302 35.1912 174.5663 157 C 5.2533 8.4705 119.9426 55.1474 42.1233 172.8712 158 L 5.0000 8.4491 122.2653 53.6894 45.7193 174.5063 159 K 5.1632 8.9430 124.7466 54.9235 33.8236 175.5680 160 A 4.9038 9.0255 126.3712 49.4949 23.0753 173.3400 161 P 5.0049 0.0000 0.0000 61.9874 33.8804 175.1390 162 I 4.4502 8.2738 122.4478 61.3621 38.1628 176.0172 163 L 4.8267 8.7364 127.5907 53.2853 43.5996 176.6978 164 S 4.4364 8.3891 114.5888 57.9859 64.0687 175.1276 165 D 4.4462 8.6551 121.3801 57.4547 40.4595 179.1532 166 S 4.1357 8.0485 114.4770 61.6611 63.0270 176.6900 167 S 4.1204 7.9635 118.7918 61.1515 62.5458 175.8298 168 C 4.3224 8.1491 120.9713 59.8486 39.9709 175.9346 169 K 4.0023 8.3845 120.1707 59.4462 31.3655 179.6223 170 S 4.1608 8.1842 114.8183 61.1495 62.7728 176.1801 171 A 3.9975 7.8056 123.1177 53.8123 19.7714 177.4642 172 Y 4.8393 7.8062 114.0625 55.1973 38.0682 173.3515 173 P 4.6598 0.0000 0.0000 63.5828 32.0396 177.7326 174 G 3.9549 9.0242 109.1907 46.1892 0.0000 173.6254 175 Q 4.5675 8.3070 116.3368 55.3380 29.7759 175.1627 176 I 4.4885 7.8483 119.9177 59.8353 38.2921 175.4732 177 T 4.5377 8.2387 115.9307 60.0083 70.9742 174.9473 178 S 4.5937 8.5458 113.8638 59.2930 63.1437 173.8493 179 N 5.1639 8.1483 117.9494 53.5409 39.6577 173.8424 180 M 5.9376 8.2506 116.5803 52.7162 36.2946 174.5938 181 F 5.0985 8.2156 114.4537 55.8534 42.0382 173.6318 182 C 5.7475 9.2457 116.0662 54.9037 41.5249 172.7129 183 A 5.0399 8.7688 121.8239 51.1416 22.5134 177.0257 184 G 3.8478 6.7572 106.7730 44.5779 0.0000 171.6853 184A Y 4.6383 8.2699 118.1430 55.9901 40.5924 176.6415 185 L 4.0893 8.6288 125.5422 57.2181 42.0129 178.6862 186 E 4.0476 8.2205 115.0154 56.9112 30.0420 177.1875 187 G 3.8217 7.7984 107.0342 45.2400 0.0000 171.9830 188 G 4.1635 9.2689 105.5117 44.5727 0.0000 173.6939 188A K 5.4708 7.1617 116.7356 53.4500 35.4950 175.3324 189 D 4.5816 8.2849 122.5033 54.2685 44.7238 174.7536 190 S 5.0501 8.7458 116.3404 57.8172 65.5634 172.9721 191 C 4.7854 9.1835 118.6936 55.4621 45.0941 172.5412 192 Q 4.4384 8.5569 117.6352 57.8198 28.4986 176.6490 193 G 4.2468 9.2028 108.0088 45.9292 0.0000 174.2891 194 D 4.6532 8.2157 118.4405 55.4974 41.6999 176.6416 195 S 4.3912 8.0824 114.9998 60.3628 63.4687 175.1877 196 G 4.2177 8.8857 112.6771 46.5028 0.0000 173.8230 197 G 4.4773 7.7795 107.2266 44.9041 0.0000 171.1898 198 P 5.0884 0.0000 0.0000 62.1972 33.7753 175.8175 199 V 4.5975 8.2489 119.8181 61.4480 34.1573 173.4626 200 V 4.8450 8.6595 128.2520 61.1864 33.8813 173.7137 201 C 5.1453 8.7455 124.2645 55.8303 44.0834 174.5233 202 S 3.5574 9.7978 119.0000 59.7282 60.1577 173.2341 203 G 3.9180 8.3634 104.1595 45.6782 0.0000 173.7349 204 K 4.6936 7.7662 118.1420 53.0681 35.2011 175.5372 *209 L 4.3158 8.2222 122.4020 55.4536 42.0753 175.7352 210 Q 4.4564 8.7271 126.0529 56.7718 30.7209 175.7588 211 G 5.4439 8.0501 103.6487 45.6981 0.0000 171.8594 212 I 5.0588 8.2288 118.9282 58.9394 41.4142 175.3808 213 V 3.8131 8.8527 127.0353 63.9764 31.8040 174.1948 214 S 4.7990 8.5050 120.6005 58.7517 64.3855 174.1880 215 W 4.9510 7.1311 114.2842 56.7297 31.5954 172.3645 216 G 3.9387 8.3975 106.7644 47.0052 0.0000 173.1227 217 S 4.6892 8.3064 116.2283 56.8881 62.9879 173.9317 *219 G 4.1722 7.9786 115.2361 45.4995 0.0000 170.7323 220 C 4.9714 8.0750 114.7985 56.3504 45.1153 173.9327 221 A 4.3921 9.0924 125.2124 53.1526 16.6157 177.1229 221A Q 4.5351 7.3800 116.9305 56.3349 29.6301 175.9585 222 K 4.1674 8.4328 121.7595 57.9604 32.7198 176.1814 223 N 4.2358 9.2929 121.1922 53.9676 36.9468 175.2704 224 K 4.2657 7.4832 118.1761 53.4492 32.1034 173.8770 225 P 4.6129 0.0000 0.0000 62.1134 32.9741 176.7982 226 G 3.6991 8.4019 106.0792 45.8843 0.0000 172.8019 227 V 4.3332 7.5509 121.0670 60.6957 34.3342 174.1164 228 Y 4.9341 7.8945 123.4696 56.0449 42.2558 174.9319 229 T 4.3799 8.5299 119.2421 63.5789 70.0749 174.5600 230 K 5.1556 9.1118 127.8248 55.1284 30.8806 177.1079 231 V 3.9368 8.7301 125.0217 65.8906 31.4057 174.7196 232 C 4.3027 8.3615 112.4594 58.1074 41.4492 174.6923 233 N 4.2973 8.0141 117.0708 54.1820 38.6740 175.4953 234 Y 4.7491 7.9196 117.6503 57.4198 38.8265 177.3170 235 V 3.6804 7.8636 121.1233 66.2545 31.6540 177.9625 236 S 4.1111 8.0852 114.2917 61.2613 62.7918 176.2205 237 W 4.1594 8.3000 130.4878 60.5665 30.4393 177.6929 238 I 3.1149 8.4182 119.9658 64.3010 36.6061 178.4278 239 K 3.7296 8.1040 119.1931 59.5936 31.8765 179.5160 240 Q 3.8555 8.4140 118.3533 59.2505 28.4577 178.8450 241 T 3.5417 7.4463 115.6012 66.4651 68.6096 176.5386 242 I 2.7905 7.3234 121.6335 63.9896 36.8080 178.2688 243 A 4.0038 7.6121 120.4828 54.5428 18.1567 178.7780 244 S 4.6172 7.5876 109.8789 58.3180 63.5287 174.1378 245 N 4.6811 8.0707 125.6171 53.8644 39.2216 174.0355 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 16 I 7.88 4.30 1.79 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 1.41 0.48 0.87 0.00 0.00 17 V 8.45 4.33 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 1.04 0.00 0.00 0.95 0.00 0.00 18 G 8.51 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 19 G 7.69 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 20 Y 7.75 4.97 0.00 2.90 2.98 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 21 T 8.59 4.42 4.32 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 1.26 0.00 0.00 22 C 8.65 4.39 0.00 2.77 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 23 G 8.68 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 24 A 8.56 4.20 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 25 N 8.83 4.26 0.00 2.83 2.89 0.00 0.00 7.23 7.56 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 26 T 7.57 4.20 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 1.34 0.00 0.00 27 V 7.09 4.05 1.76 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 0.34 0.00 0.00 0.78 0.00 0.00 28 P 0.00 4.57 0.00 2.39 2.43 0.00 3.80 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 1.96 0.00 29 Y 6.75 4.84 0.00 3.15 3.37 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 30 Q 7.37 4.61 0.00 1.81 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.50 0.00 0.00 0.00 0.00 0.00 1.91 2.51 0.00 31 V 8.97 4.85 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 0.83 0.00 0.00 1.00 0.00 0.00 32 S 8.60 4.90 0.00 3.10 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 33 L 8.37 4.75 0.00 0.57 0.85 0.79 0.24 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 34 N 8.93 5.76 0.00 2.41 2.32 0.00 0.00 6.53 8.11 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 *37 S 8.49 4.45 0.00 3.81 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 38 G 9.46 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 39 Y 6.82 4.53 0.00 3.05 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 40 H 8.76 4.66 0.00 2.88 3.17 0.00 5.86 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.52 4.84 0.00 3.09 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 42 C 6.63 4.70 0.00 2.35 2.91 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 43 G 8.72 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 0.00 0.00 0.00 0.00 44 G 7.93 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 0.00 0.00 0.00 0.00 45 S 8.79 5.50 0.00 3.81 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 0.00 46 L 9.04 4.71 0.00 1.88 1.67 1.08 0.74 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 47 I 8.54 4.55 1.90 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 1.56 0.93 1.00 0.00 0.00 48 N 7.66 4.88 0.00 3.02 3.01 0.00 0.00 6.22 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 49 S 8.70 4.30 0.00 4.05 4.20 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 0.00 0.00 0.00 0.00 50 Q 9.12 4.54 0.00 2.06 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.85 0.00 0.00 0.00 0.00 0.00 2.11 2.19 0.00 51 W 8.41 5.45 0.00 3.38 2.98 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 52 V 8.90 5.14 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 1.06 0.00 0.00 0.98 0.00 0.00 53 V 8.81 5.00 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 0.87 0.00 0.00 1.02 0.00 0.00 54 S 8.94 4.68 0.00 3.88 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 55 A 8.49 5.00 1.13 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 0.00 0.00 56 A 8.19 3.85 0.26 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 57 H 8.28 4.56 0.00 3.35 3.53 0.00 5.55 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.83 4.79 0.00 3.19 3.32 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 59 Y 7.73 4.16 0.00 3.00 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 60 K 6.32 3.71 0.00 1.50 1.37 0.00 0.61 0.00 0.00 1.24 0.00 0.00 2.49 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.66 0.89 7.81 61 S 8.22 4.35 0.00 3.93 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 G 8.42 3.57 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 0.00 63 I 7.28 4.67 1.85 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 1.37 1.18 0.92 0.00 0.00 64 Q 8.73 4.79 0.00 1.99 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.87 0.00 0.00 0.00 0.00 0.00 2.08 2.20 0.00 65 V 8.87 4.33 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 0.85 0.00 0.00 0.89 0.00 0.00 65A R 8.71 5.11 0.00 1.55 1.73 0.00 2.67 0.00 0.00 2.42 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 1.15 0.00 66 L 8.99 4.72 0.00 1.63 1.61 0.95 1.00 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 *69 G 8.25 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 0.00 0.00 0.00 70 E 8.44 4.63 0.00 2.03 1.76 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 2.35 2.07 0.00 71 D 8.20 4.82 0.00 2.72 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 72 N 7.97 5.11 0.00 2.82 2.82 0.00 0.00 6.76 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 73 I 8.33 3.75 1.47 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.56 -0.54 0.00 0.00 74 N 8.57 4.76 0.00 2.81 2.88 0.00 0.00 6.65 8.08 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 75 V 7.32 4.40 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 0.73 0.00 0.00 0.99 0.00 0.00 76 V 8.31 4.25 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 0.76 0.00 0.00 0.95 0.00 0.00 77 E 9.46 4.54 0.00 1.96 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 0.00 2.23 2.22 0.00 78 G 9.01 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 79 N 8.99 4.59 0.00 2.95 3.07 0.00 0.00 6.92 7.67 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 80 E 7.68 4.54 0.00 1.54 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 0.00 2.57 2.59 0.00 81 Q 9.21 4.44 0.00 1.96 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.76 0.00 0.00 0.00 0.00 0.00 2.23 2.29 0.00 82 F 8.87 5.55 0.00 2.78 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 83 I 8.68 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 1.25 0.71 0.94 0.00 0.00 84 S 8.64 4.66 0.00 3.75 3.74 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 85 A 8.17 4.42 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 86 S 9.00 4.43 0.00 3.73 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 87 K 7.66 4.79 0.00 1.87 1.84 0.00 1.63 0.00 0.00 1.94 0.00 0.00 2.86 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.32 1.42 7.81 88 S 8.80 5.23 0.00 4.10 4.05 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 0.00 0.00 0.00 89 I 9.25 4.46 2.06 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.29 1.09 0.00 0.00 90 V 8.28 4.24 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 0.61 0.00 0.00 0.76 0.00 0.00 91 H 8.64 3.85 0.00 2.84 2.98 0.00 5.65 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.31 0.00 2.04 2.12 0.00 3.03 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.20 0.00 93 S 7.93 4.70 0.00 3.91 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 94 Y 8.02 4.32 0.00 2.98 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 95 N 8.03 4.57 0.00 2.60 2.44 0.00 0.00 6.60 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 96 S 7.88 3.95 0.00 3.95 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 0.00 97 N 8.51 4.45 0.00 2.69 2.79 0.00 0.00 6.77 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 98 T 7.73 4.06 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 1.15 0.00 0.00 99 L 7.76 3.81 0.00 1.62 1.96 0.79 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.67 4.53 0.00 2.76 2.65 0.00 0.00 7.26 6.59 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 0.00 101 N 8.59 5.03 0.00 3.04 2.58 0.00 0.00 7.21 8.29 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 0.00 102 D 7.81 4.72 0.00 3.07 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 0.00 103 I 7.10 4.82 1.46 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 1.36 1.26 0.23 0.00 0.00 104 M 8.99 5.41 0.00 2.25 1.82 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.64 0.00 105 L 9.05 5.37 0.00 1.80 1.84 0.23 0.49 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 0.00 106 I 8.80 5.02 1.92 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.78 0.89 0.00 0.00 107 K 8.86 3.74 0.00 0.79 1.13 0.00 1.33 0.00 0.00 1.34 0.00 0.00 2.61 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.63 0.21 7.81 108 L 7.82 4.54 0.00 1.55 1.49 0.97 0.71 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 0.00 109 K 8.80 4.18 0.00 1.76 1.80 0.00 1.72 0.00 0.00 1.73 0.00 0.00 2.96 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.35 7.81 110 S 7.73 4.64 0.00 3.93 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 0.00 111 A 8.33 4.42 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 0.00 112 A 8.64 4.47 1.27 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 0.00 0.00 113 S 8.81 4.57 0.00 3.77 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 0.00 114 L 8.46 4.70 0.00 1.65 1.62 0.96 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.43 4.61 0.00 2.75 2.73 0.00 0.00 6.94 8.32 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 0.00 116 S 8.77 4.42 0.00 4.01 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 0.00 117 R 8.97 4.23 0.00 2.07 2.02 0.00 3.12 0.00 0.00 3.10 7.38 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.56 4.92 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 0.00 128 C 8.39 4.48 0.00 2.94 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 A 7.90 4.58 1.08 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 0.00 130 S 7.98 4.44 0.00 3.83 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 *132 A 8.14 4.33 1.28 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 0.00 133 G 9.00 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 0.00 134 T 7.68 3.94 4.17 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 1.14 0.00 0.00 135 Q 8.55 4.82 0.00 2.03 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.89 0.00 0.00 0.00 0.00 0.00 2.32 2.47 0.00 136 C 9.37 5.25 0.00 2.75 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 0.00 137 L 8.98 5.15 0.00 1.76 1.57 1.04 1.19 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 0.00 138 I 9.13 5.27 1.88 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 1.43 1.02 0.00 0.00 139 S 8.32 5.45 0.00 3.50 3.59 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 0.00 140 G 7.24 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 0.00 141 W 8.50 4.61 0.00 3.13 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 0.00 142 G 8.19 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 0.00 0.00 0.00 0.00 143 N 8.71 3.83 0.00 2.38 2.69 0.00 0.00 7.01 7.43 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 0.00 144 T 8.14 5.15 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 1.27 0.00 0.00 145 K 7.82 4.64 0.00 1.84 1.69 0.00 1.70 0.00 0.00 1.69 0.00 0.00 3.04 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.29 1.31 7.81 146 S 8.58 4.34 0.00 3.98 4.05 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 0.00 0.00 0.00 147 S 7.79 4.41 0.00 3.83 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 0.00 148 G 8.41 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 0.00 0.00 0.00 149 T 8.20 4.48 4.37 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 1.32 0.00 0.00 150 S 9.18 4.37 0.00 3.74 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 0.00 151 Y 8.60 5.02 0.00 3.00 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 0.00 152 P 0.00 4.73 0.00 2.43 2.12 0.00 4.18 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.04 0.00 153 D 8.69 4.66 0.00 2.80 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 0.00 154 V 7.38 5.80 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 0.84 0.00 0.00 0.98 0.00 0.00 155 L 8.67 3.21 0.00 1.35 1.31 -0.81 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.30 4.90 0.00 1.55 1.50 0.00 1.62 0.00 0.00 1.57 0.00 0.00 2.83 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.47 7.81 157 C 8.47 5.25 0.00 1.47 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 0.00 0.00 0.00 158 L 8.45 5.00 0.00 1.71 1.44 1.01 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 159 K 8.94 5.16 0.00 1.82 1.82 0.00 1.86 0.00 0.00 1.78 0.00 0.00 2.78 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.64 7.81 160 A 9.03 4.90 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 0.00 161 P 0.00 5.00 0.00 2.02 2.27 0.00 3.09 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.75 0.00 162 I 8.27 4.45 1.88 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.53 0.78 0.00 0.00 163 L 8.74 4.83 0.00 1.55 1.61 0.93 0.87 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 0.00 164 S 8.39 4.44 0.00 4.01 3.99 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 0.00 165 D 8.66 4.45 0.00 2.76 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 0.00 166 S 8.05 4.14 0.00 4.05 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 0.00 167 S 7.96 4.12 0.00 3.85 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 0.00 168 C 8.15 4.32 0.00 3.23 3.33 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 0.00 169 K 8.38 4.00 0.00 1.96 1.89 0.00 1.76 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.64 7.81 170 S 8.18 4.16 0.00 3.91 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 0.00 171 A 7.81 4.00 1.14 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 0.00 0.00 172 Y 7.81 4.84 0.00 3.14 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 0.00 173 P 0.00 4.66 0.00 2.21 2.11 0.00 3.62 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.96 0.00 174 G 9.02 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 0.00 175 Q 8.31 4.57 0.00 2.35 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.95 7.00 0.00 0.00 0.00 0.00 0.00 2.29 2.56 0.00 176 I 7.85 4.49 1.98 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.99 0.99 0.00 0.00 177 T 8.24 4.54 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 178 S 8.55 4.59 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 0.00 179 N 8.15 5.16 0.00 2.86 3.10 0.00 0.00 6.75 8.83 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 0.00 180 M 8.25 5.94 0.00 1.84 1.98 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.42 0.00 181 F 8.22 5.10 0.00 2.96 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 0.00 182 C 9.25 5.75 0.00 2.97 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 0.00 183 A 8.77 5.04 1.21 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 0.00 0.00 184 G 6.76 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 0.00 0.00 0.00 0.00 184A Y 8.27 4.64 0.00 2.96 3.01 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 0.00 0.00 0.00 185 L 8.63 4.09 0.00 1.73 1.73 0.92 0.87 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 0.00 186 E 8.22 4.05 0.00 2.10 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 0.00 2.32 2.27 0.00 187 G 7.80 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 0.00 188 G 9.27 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 0.00 0.00 0.00 188A K 7.16 5.47 0.00 1.39 1.61 0.00 0.91 0.00 0.00 2.02 0.00 0.00 2.43 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.19 0.98 7.81 189 D 8.28 4.58 0.00 2.79 2.55 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 0.00 0.00 0.00 0.00 190 S 8.75 5.05 0.00 3.99 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 0.00 191 C 9.18 4.79 0.00 2.94 3.12 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 0.00 0.00 0.00 0.00 192 Q 8.56 4.44 0.00 2.43 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.16 5.21 0.00 0.00 0.00 0.00 0.00 2.54 2.70 0.00 193 G 9.20 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 0.00 0.00 0.00 0.00 194 D 8.22 4.65 0.00 3.00 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 0.00 195 S 8.08 4.39 0.00 3.99 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 0.00 196 G 8.89 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 0.00 0.00 0.00 197 G 7.78 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 5.09 0.00 2.29 2.34 0.00 3.69 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.22 0.00 199 V 8.25 4.60 2.27 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 0.85 0.00 0.00 0.61 0.00 0.00 200 V 8.66 4.85 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 0.79 0.00 0.00 0.62 0.00 0.00 201 C 8.75 5.15 0.00 2.80 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 S 9.80 3.56 0.00 3.91 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 0.00 203 G 8.36 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 0.00 0.00 0.00 204 K 7.77 4.69 0.00 1.69 1.64 0.00 1.87 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.40 7.81 *209 L 8.22 4.32 0.00 1.52 1.65 0.90 0.75 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 0.00 210 Q 8.73 4.46 0.00 1.98 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.31 0.00 0.00 0.00 0.00 0.00 2.39 2.33 0.00 211 G 8.05 5.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 I 8.23 5.06 1.92 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 1.29 1.12 1.03 0.00 0.00 213 V 8.85 3.81 2.34 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 0.95 0.00 0.00 1.19 0.00 0.00 214 S 8.51 4.80 0.00 3.89 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 0.00 215 W 7.13 4.95 0.00 3.32 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 0.00 216 G 8.40 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 0.00 0.00 0.00 217 S 8.31 4.69 0.00 4.12 3.99 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 *219 G 7.98 4.17 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 0.00 0.00 0.00 220 C 8.08 4.97 0.00 2.95 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 0.00 221 A 9.09 4.39 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 221A Q 7.38 4.54 0.00 1.97 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.17 6.94 0.00 0.00 0.00 0.00 0.00 2.41 2.47 0.00 222 K 8.43 4.17 0.00 1.72 1.72 0.00 1.94 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.48 7.81 223 N 9.29 4.24 0.00 2.81 2.81 0.00 0.00 6.77 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 0.00 224 K 7.48 4.27 0.00 1.69 1.82 0.00 1.69 0.00 0.00 1.40 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.50 7.81 225 P 0.00 4.61 0.00 2.13 2.10 0.00 3.58 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.00 0.00 226 G 8.40 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 0.00 0.00 0.00 227 V 7.55 4.33 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 0.25 0.00 0.00 -0.86 0.00 0.00 228 Y 7.89 4.93 0.00 1.43 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 0.00 0.00 0.00 0.00 229 T 8.53 4.38 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 230 K 9.11 5.16 0.00 2.12 1.91 0.00 1.80 0.00 0.00 1.76 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.52 1.63 7.81 231 V 8.73 3.94 2.36 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 1.17 0.00 0.00 1.11 0.00 0.00 232 C 8.36 4.30 0.00 3.16 3.23 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 0.00 233 N 8.01 4.30 0.00 2.25 2.40 0.00 0.00 6.94 7.67 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 0.00 234 Y 7.92 4.75 0.00 3.11 3.22 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 0.00 235 V 7.86 3.68 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 1.12 0.00 0.00 1.11 0.00 0.00 236 S 8.09 4.11 0.00 3.97 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 0.00 237 W 8.30 4.16 0.00 3.49 3.63 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 0.00 238 I 8.42 3.11 2.04 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.10 0.76 0.00 0.00 239 K 8.10 3.73 0.00 1.85 1.79 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.57 7.81 240 Q 8.41 3.86 0.00 1.93 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.53 0.00 241 T 7.45 3.54 3.44 0.00 0.00 0.00 0.00 0.00 0.00 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 0.00 242 I 7.32 2.79 1.37 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.13 0.43 0.00 0.00 243 A 7.61 4.00 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 0.00 244 S 7.59 4.62 0.00 4.03 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 0.00 245 N 8.07 4.68 0.00 3.05 3.02 0.00 0.00 6.75 7.75 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 * Residues marked with a * may have inaccurate shift predictions.