NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.9165 8.3549 109.7340 45.5319 0.0000 173.2003 3 R 4.0295 8.3750 118.4252 55.1747 31.2543 174.0880 4 K 4.9647 8.2937 119.0456 54.9270 36.6502 174.6888 5 I 5.0977 8.6874 121.7169 59.4904 42.2186 173.8394 6 V 4.9174 8.8622 128.0207 61.1814 34.4323 174.0189 7 F 5.3554 9.1704 126.7553 55.9741 41.4238 174.8367 8 F 5.3897 9.2615 120.9248 55.8650 42.5475 174.2136 9 D 5.0700 8.6472 122.3182 52.9904 42.9349 176.8390 10 I 3.7696 8.3152 122.0725 63.8127 37.8427 175.6098 11 D 4.6869 7.7528 119.8557 55.1909 41.3871 177.0825 12 G 4.0807 9.2036 113.3348 45.5979 0.0000 173.4781 13 T 4.5340 7.6524 112.5434 65.1536 70.6969 175.4203 14 L 4.1616 7.5336 119.7218 56.0694 42.4383 177.4517 15 L 4.9185 7.9108 118.3365 52.6627 43.9042 176.6486 16 D 4.9942 8.5443 122.2701 52.3163 41.3061 176.2732 17 E 3.8740 8.7791 118.6508 59.5005 29.5155 177.7937 18 Q 4.3593 8.6053 116.0110 55.2245 28.7282 175.6385 19 K 3.9248 8.1601 116.3663 57.5639 30.0566 175.4679 20 Q 4.4879 8.1299 116.9010 54.1308 30.4695 174.7080 21 L 4.7077 8.2105 123.8486 52.9055 42.6437 174.5734 22 P 4.3679 0.0000 0.0000 62.2883 32.3294 177.2823 23 L 3.9428 8.8037 123.2867 58.2438 41.5354 180.1106 24 S 3.9500 7.9171 113.1432 61.4698 62.8884 176.4881 25 T 4.0614 7.8950 119.6486 66.3424 68.1946 176.8794 26 I 3.6823 7.5848 121.5501 64.1367 37.1013 177.9001 27 E 3.8986 8.0483 119.8389 59.1013 29.3882 178.3404 28 A 4.3010 8.6467 121.3153 55.6553 18.4543 179.6761 29 V 3.5178 7.9450 116.2371 66.0672 31.5376 178.1571 30 R 3.8935 7.9571 118.1674 59.5803 29.8856 178.6879 31 R 3.9529 8.4030 118.0738 59.1911 30.0874 178.9354 32 L 3.9221 8.1312 118.8465 57.8317 41.5969 179.7045 33 K 4.0717 8.1618 118.2342 59.7190 31.8224 179.0366 34 Q 3.9505 7.8427 118.3264 59.1906 28.9690 177.9226 35 S 4.4624 7.6337 113.0849 58.4721 63.2009 175.0504 36 G 3.7911 8.0976 110.6294 45.0299 0.0000 173.3719 37 V 3.9653 7.3203 119.8513 61.9912 32.4204 175.5069 38 Y 4.7284 8.6892 126.2499 58.0624 39.1203 174.6622 39 V 4.9756 8.5626 122.8766 61.1648 33.9616 174.3716 40 A 5.3940 8.7708 127.7394 50.6919 23.1507 174.7258 41 I 5.0358 8.7608 119.9243 59.9459 39.9101 174.8030 42 A 5.2309 9.1846 127.1967 50.6980 21.6007 175.0519 43 T 4.4673 9.1124 116.5612 61.2436 71.5707 174.5232 44 G 3.8203 8.5507 111.4547 46.0949 0.0000 174.3469 45 R 3.8744 7.5657 119.4889 55.6791 30.7334 175.6223 46 A 2.9342 7.4298 121.9142 50.1484 19.6286 175.8048 47 P 3.6018 0.0000 0.0000 65.5231 31.8215 179.0107 48 F 4.3941 6.9551 112.0937 56.5061 35.9965 175.2800 *50 F 4.6416 7.6584 109.2885 57.3519 39.7246 177.3621 51 E 3.6369 7.9782 124.1407 60.2240 29.4544 177.0448 52 H 4.1158 8.1238 118.0941 59.2649 30.0395 177.2355 53 V 3.8163 7.7047 120.8576 65.4562 31.2954 177.9715 54 R 3.9612 7.7967 117.6958 59.3584 29.9361 179.2526 55 K 3.9720 8.2141 118.2609 59.4391 31.4744 179.5204 56 Q 4.0627 8.1539 118.5147 58.2184 28.4444 177.6957 57 L 4.5899 7.7739 116.7248 53.1647 42.5372 176.4203 58 G 3.8846 7.4570 105.5487 46.6861 0.0000 174.1494 59 I 4.4349 8.0708 120.6907 59.6199 38.5380 175.7001 60 D 5.2350 8.6828 124.8405 53.0209 41.2223 174.9849 61 S 5.0423 7.9659 114.5123 57.5316 66.7777 172.9626 62 F 5.3621 8.5737 117.5750 56.4965 41.8242 172.8822 63 V 4.8513 9.1764 120.6526 61.4834 33.6490 174.5489 64 S 5.1442 9.2962 122.6292 55.8728 67.1086 173.4297 65 F 4.4478 9.2422 115.0572 58.7634 36.6975 175.6540 66 N 4.1933 9.1647 110.2125 54.3509 36.8297 176.0961 67 G 4.0710 8.4776 105.4926 45.4993 0.0000 175.1007 68 Q 4.4246 8.4096 118.1757 57.0850 29.4056 174.7113 69 Y 4.8338 7.9427 119.7694 56.3072 41.7642 173.3851 70 V 4.7224 8.9665 128.0033 60.9991 34.3690 174.3047 71 V 4.4575 8.1004 127.9681 60.8054 34.3960 173.8945 72 F 4.9049 8.9668 129.0225 56.6714 42.0917 174.8554 73 E 3.9795 8.7132 127.3602 56.1197 27.3232 175.9306 74 G 3.9890 8.3769 106.6822 45.0458 0.0000 173.3059 75 N 4.9128 7.7293 117.4943 50.7049 40.8289 174.3663 76 V 3.6569 8.3129 122.1996 63.4390 31.9761 175.0112 77 L 4.5168 8.9857 130.1141 56.6180 43.7860 176.0457 78 Y 4.8712 7.4189 118.4759 56.1601 42.3030 173.6327 79 K 4.8473 7.6848 124.7479 55.4476 35.8493 175.6673 80 Q 4.3663 9.1494 125.2175 53.4701 30.1927 172.9233 81 P 4.4555 0.0000 0.0000 61.7170 32.4546 176.2142 82 L 4.3320 8.9057 122.9775 54.4433 42.6645 177.6270 83 R 3.9914 8.7320 121.3540 56.2052 30.5738 177.2321 84 R 3.9217 9.0327 123.8056 59.6787 30.0525 177.3899 85 E 3.9677 8.3502 118.2586 59.7937 29.5080 179.0860 86 K 4.1864 8.0593 117.4804 59.2079 32.1806 179.4853 87 V 3.6111 8.1945 119.1794 65.7140 31.3334 178.1070 88 R 3.6936 8.3526 118.6447 59.2714 29.9815 178.2910 89 A 4.1051 7.9411 120.1504 55.2118 18.2464 179.2178 90 L 3.7247 7.6874 118.6796 57.9533 42.3682 179.0221 91 T 4.0655 7.9275 115.4791 66.7269 68.2755 176.5437 92 E 4.0925 8.4662 120.5459 59.3563 29.3896 178.5146 93 E 4.3515 8.6983 116.1762 57.5003 29.9586 177.1032 94 A 4.8480 8.0354 119.2304 53.7117 20.5833 178.0190 95 H 4.3747 8.1557 117.2276 58.8770 29.6732 177.2824 96 K 3.9692 8.1751 121.0865 59.0836 32.1896 176.8393 97 N 4.6320 8.1688 112.7232 52.6102 38.8493 175.2857 98 G 3.7967 7.7997 106.1556 46.4357 0.0000 173.2966 99 H 5.0837 8.6081 117.8520 53.3268 29.6803 173.4338 100 P 4.6966 0.0000 0.0000 62.2381 33.5129 174.6087 101 L 5.9600 9.0320 118.6566 52.1126 46.6121 175.9107 102 V 4.4312 7.8881 118.9967 61.3299 34.5663 175.0682 103 F 5.0882 8.8677 127.4183 56.2456 41.3769 173.9777 *105 D 4.7031 8.1516 117.3489 53.5328 40.2538 174.6889 106 A 4.1793 8.7760 119.9596 55.5237 18.6433 179.7822 107 E 4.2621 8.5027 114.4126 58.5806 31.0056 176.2745 108 K 2.7921 9.0947 121.6146 55.7982 35.9607 175.4101 *110 R 4.2216 8.4606 115.3237 55.8980 31.8800 174.2264 111 A 4.9348 8.3206 124.1287 50.6629 20.6038 178.4851 112 S 4.3884 8.8539 116.6618 60.3552 63.9963 174.9189 113 I 4.5203 7.6161 119.6564 59.0323 39.6080 175.3809 114 G 3.7840 8.4876 112.9317 45.0727 0.0000 172.4319 115 D 4.0102 8.1611 115.5782 54.4870 40.0319 173.4477 116 H 4.3593 7.6278 115.9768 54.4506 31.2674 173.1572 117 P 4.3310 0.0000 0.0000 66.5372 31.0142 178.4002 118 H 4.4332 8.1986 115.4106 58.5526 28.4977 177.6527 119 I 3.0111 7.4096 120.2317 64.4365 37.0528 177.3422 120 H 4.3308 7.7688 115.6028 59.1739 28.4251 177.6300 121 V 3.8641 7.7934 119.4993 65.8977 30.6840 179.4348 122 S 3.8327 8.0755 112.5311 58.7397 62.9124 175.7409 *124 A 4.8644 8.3185 127.0694 53.2233 20.2336 179.9705 125 S 4.3178 7.9166 108.8256 60.8348 63.1649 175.0659 126 L 4.4680 7.5456 119.6386 54.0750 41.7219 176.2772 127 K 3.9999 8.3679 117.5778 57.9276 29.7098 175.6315 128 F 4.6682 8.0955 114.8421 55.4361 42.3935 175.1683 129 A 4.4554 8.4237 125.9253 51.0836 19.6109 176.8909 130 H 4.1379 8.6552 119.5407 55.5880 30.2139 173.6113 131 P 4.4513 0.0000 0.0000 61.8343 32.0892 174.2775 132 P 4.5453 0.0000 0.0000 62.6563 32.5857 175.7894 133 V 4.4696 8.2960 123.7659 61.2698 32.5274 175.4831 134 D 4.5263 9.3383 126.3405 52.8585 42.9319 173.9506 135 P 4.7831 0.0000 0.0000 64.5885 31.9352 177.6086 136 L 4.3065 8.0139 117.8526 54.2724 42.2858 177.8054 137 Y 3.9359 7.8708 122.5958 60.7278 38.7789 178.0349 138 Y 4.0033 7.1566 116.2697 59.1792 38.3460 176.8848 139 E 3.7758 6.7771 120.3245 58.1397 29.4950 177.1896 140 N 4.7365 7.6123 112.7102 52.0619 38.7905 174.3041 141 K 4.4670 7.0395 117.8514 54.2222 35.3935 175.4602 142 D 4.3358 8.3765 121.5710 54.0349 41.5431 175.9450 143 I 4.2948 7.8840 124.0090 59.7841 39.2959 175.8047 144 Y 3.6523 7.7877 121.4175 58.7055 39.0035 175.1721 145 Q 4.6280 6.9848 117.5329 55.1420 32.0735 172.5197 146 A 4.9211 8.4031 124.3240 50.3485 23.7386 174.6757 147 L 4.9097 8.6573 118.4015 52.8046 45.2326 175.7066 148 L 4.5483 8.5355 126.0250 53.2776 44.2619 174.9972 149 F 5.4955 8.8448 126.0536 56.1184 39.4641 174.6948 150 C 4.6916 7.9157 117.0514 57.4203 32.6636 173.7928 151 R 4.4399 9.6068 118.6281 54.7721 30.5219 178.0680 152 A 4.4866 8.2802 121.5005 54.8679 18.4734 179.2695 153 E 4.3516 8.1186 112.8007 57.6682 29.7005 177.4250 154 E 4.6461 7.9232 117.4667 55.9937 31.1712 177.2658 155 E 4.2838 8.0318 117.4680 59.1838 29.7107 178.4531 156 E 3.7513 8.0968 119.8676 58.8356 29.6430 176.8319 157 P 4.0914 0.0000 0.0000 65.9235 31.3774 178.0746 158 Y 4.3279 7.2955 114.4564 61.1049 37.6078 178.4342 159 V 3.5581 7.4066 117.7290 66.3581 31.6395 178.0395 160 R 4.1060 8.2178 116.3377 59.2953 30.1147 178.3744 161 N 4.4750 8.7226 114.1165 54.2205 40.3340 175.1209 162 Y 5.5598 8.1654 117.5893 54.5486 38.3535 174.2171 163 P 4.6415 0.0000 0.0000 64.2865 32.3894 178.0341 164 E 4.1495 8.0614 116.8519 57.4180 30.1849 175.6328 165 F 5.6873 7.9588 117.7081 55.7456 42.8020 174.6162 166 R 4.6550 8.9393 120.5630 54.7726 32.7818 174.0071 167 F 4.9403 9.2500 125.6050 56.2415 40.4153 175.5010 168 V 4.3814 8.4825 124.8317 60.8193 33.6417 174.5954 169 R 4.6042 8.7653 129.4679 56.0230 30.3204 175.9933 170 W 5.0022 8.4567 120.2149 56.0408 29.7067 173.8644 171 H 4.5933 6.8993 116.8802 54.2877 32.3628 172.6929 172 D 4.3148 7.8615 121.5569 56.7259 40.8929 178.7143 173 V 4.4192 7.4738 109.4123 59.6596 32.1547 174.3492 174 S 4.7130 7.1689 114.0091 57.0785 65.7436 172.6134 175 T 4.7612 8.6868 120.6047 60.3019 71.1961 172.5766 176 D 4.8911 9.3841 127.3849 54.1637 42.8485 175.8398 177 V 3.9525 8.6393 122.5251 61.2459 33.3747 174.3237 178 L 5.1120 8.1078 127.6947 51.7135 45.6474 174.1607 179 P 5.1481 0.0000 0.0000 62.1249 32.9179 175.8172 180 A 4.1656 8.4393 125.9630 54.0882 18.6876 177.8550 181 G 4.0419 9.1961 111.2016 45.0798 0.0000 173.9370 182 G 4.0083 7.8540 109.1181 44.8907 0.0000 173.8457 183 S 4.6026 7.9466 115.5686 55.9415 66.6096 176.6705 184 K 3.9782 8.4968 123.0165 60.0311 32.3104 179.1902 185 A 3.7876 7.7955 121.7355 54.8624 18.0511 179.0198 186 E 3.6718 7.5643 117.0123 59.0908 29.7306 178.9480 187 G 3.6245 7.6418 105.1701 47.7673 0.0000 175.4646 188 I 3.6215 7.5467 121.7082 63.1990 38.6393 178.0923 189 R 4.2501 7.2623 120.9442 56.4831 25.9263 176.3620 *192 I 4.1862 7.5777 115.5181 60.5210 40.3739 179.0579 193 E 3.9261 8.2156 120.6433 59.3691 29.5240 179.3681 194 K 3.9617 7.9608 116.3956 59.4143 32.1817 178.3830 195 L 3.8787 7.7140 116.4995 55.3168 41.8333 176.8878 196 G 3.7828 7.5342 106.6738 46.7275 0.0000 173.3703 197 I 4.4359 7.9517 120.4476 58.9579 39.1578 175.9466 198 D 4.5525 8.4498 125.0473 53.6886 41.8255 177.2691 199 K 3.6699 8.7902 122.5192 59.6954 32.1721 179.1330 200 K 3.9356 7.9811 116.4336 59.1398 32.1787 176.9309 201 D 4.8957 8.6265 117.0554 53.8367 42.6089 175.6299 202 V 4.8089 7.9538 121.0300 61.6332 33.2179 174.4376 203 Y 5.2456 9.3577 125.1623 56.4821 41.7206 174.5020 204 A 5.3146 8.6165 121.2078 50.8579 23.4288 175.2179 205 F 5.2357 9.4637 119.6239 55.8017 42.3259 174.8919 206 G 4.3526 9.4776 110.2942 44.9801 0.0000 172.3609 207 D 4.6103 9.0831 114.9381 54.5120 44.4479 175.4298 208 G 4.2519 8.3719 107.4717 43.3523 0.0000 174.3270 209 L 3.9954 8.3163 118.6501 57.5039 41.6050 179.0764 210 N 4.6171 8.1221 113.5556 54.1507 37.5008 175.0077 211 D 4.7645 8.0373 118.5242 54.4935 42.0572 177.5688 212 I 3.8247 7.7040 121.4960 64.5995 37.3346 178.8586 213 E 3.8448 8.1396 117.0640 57.0719 28.8156 178.0265 *215 L 4.3128 8.0138 119.5274 54.2458 43.5043 179.1021 216 S 4.2676 8.0642 111.7286 60.2061 63.6576 175.4113 217 F 4.2692 8.1831 123.2997 60.9064 39.2596 176.1392 218 V 3.5097 7.5366 111.7684 60.6239 32.1956 176.3778 219 G 3.5190 8.3398 108.3203 49.2218 0.0000 174.0354 220 T 4.5896 7.6860 120.0868 61.2308 71.5846 173.2695 221 G 4.2599 9.7382 115.1170 44.2036 0.0000 171.3873 222 V 4.9040 8.9739 123.9252 60.8415 34.0928 173.7245 223 A 5.4685 7.9346 131.4417 50.9081 21.4516 178.2677 *225 G 3.8434 8.7866 100.6717 45.7177 0.0000 173.2460 226 N 4.9261 7.9347 115.7785 52.5242 39.3566 174.8168 227 A 4.6388 7.7980 119.2857 50.7839 19.8964 177.7907 228 H 4.2778 8.1206 119.1458 56.2229 30.6473 176.6465 229 E 4.0272 8.4893 124.1580 59.5003 29.0611 179.4259 230 E 4.0569 8.3847 117.1936 58.6753 29.8433 178.8100 231 V 3.8591 7.8484 118.8134 65.6391 31.6316 178.1948 232 K 4.0245 7.9101 117.6933 59.0699 31.6629 179.1524 233 R 3.8643 7.9652 119.2206 59.4016 30.0215 177.8797 234 V 3.8673 7.2088 107.4891 62.1788 32.0249 176.4621 235 A 4.1960 7.3435 123.7293 52.1671 18.6491 177.3769 236 D 4.6621 8.7697 122.0004 56.1042 41.8428 176.6457 237 F 4.6570 7.8221 118.9755 57.0583 42.9147 172.4291 238 V 4.5372 7.4396 125.5711 61.5268 32.7569 174.9957 239 T 4.7238 8.5570 123.1177 60.2929 70.2826 173.5773 240 K 4.1574 8.6095 122.6729 55.1180 32.9366 175.1415 241 P 4.6320 0.0000 0.0000 62.1882 31.8695 178.1436 242 V 3.6413 8.5171 120.2129 64.9126 31.0820 176.7150 243 D 4.8286 8.0349 116.9777 52.9373 38.0565 176.2756 244 K 4.5764 7.9371 119.7385 56.7612 33.1018 176.3609 245 E 4.0579 8.5243 113.9583 57.3731 27.4847 177.2528 246 G 4.0707 7.7475 106.3357 48.5178 0.0000 176.0931 247 I 3.8540 7.8567 121.9432 63.6443 37.2493 178.2155 248 W 4.1175 8.2773 128.7740 60.5852 30.5958 177.1414 249 Y 4.1614 9.0292 120.0404 60.6560 38.1996 178.2899 250 G 3.8876 8.6645 106.6095 48.0876 0.0000 175.6304 251 L 3.9522 8.0817 121.8667 57.0722 41.5487 179.6649 252 K 3.6862 7.5387 119.5393 59.4861 31.8926 178.9402 253 Q 3.7338 7.3863 116.9896 58.7364 28.6908 178.2391 254 L 3.9508 7.5889 117.0319 54.6158 41.6841 177.0639 255 Q 3.5043 7.4314 116.7747 56.9040 26.6374 174.7911 256 L 4.0420 7.8330 119.5071 56.1120 42.1449 177.4092 257 I 3.9526 7.1733 123.3700 61.2176 37.7283 175.0630 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 G 8.35 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 3 R 8.37 4.03 0.00 1.90 1.59 0.00 2.29 0.00 0.00 2.88 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.67 0.00 4 K 8.29 4.96 0.00 1.65 1.80 0.00 1.57 0.00 0.00 1.74 0.00 0.00 2.78 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.54 1.41 7.81 5 I 8.69 5.10 2.03 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.53 1.09 0.00 0.00 6 V 8.86 4.92 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 0.51 0.00 0.00 0.87 0.00 0.00 7 F 9.17 5.36 0.00 3.01 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 8 F 9.26 5.39 0.00 2.98 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 9 D 8.65 5.07 0.00 2.93 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 10 I 8.32 3.77 1.78 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 1.27 0.22 0.89 0.00 0.00 11 D 7.75 4.69 0.00 2.67 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 12 G 9.20 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 13 T 7.65 4.53 4.54 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 1.55 0.00 0.00 14 L 7.53 4.16 0.00 1.62 1.64 0.91 0.44 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 15 L 7.91 4.92 0.00 1.69 1.45 0.93 0.87 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 16 D 8.54 4.99 0.00 2.91 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 17 E 8.78 3.87 0.00 1.96 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 2.31 2.36 0.00 18 Q 8.61 4.36 0.00 2.17 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.39 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 19 K 8.16 3.92 0.00 1.89 1.94 0.00 1.58 0.00 0.00 1.72 0.00 0.00 3.13 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.37 1.45 7.81 20 Q 8.13 4.49 0.00 2.46 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.96 0.00 0.00 0.00 0.00 0.00 2.41 2.26 0.00 21 L 8.21 4.71 0.00 1.55 1.56 0.91 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 22 P 0.00 4.37 0.00 2.20 1.95 0.00 3.69 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.10 0.00 23 L 8.80 3.94 0.00 1.65 1.64 0.88 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 24 S 7.92 3.95 0.00 3.93 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 T 7.89 4.06 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 0.98 0.00 0.00 26 I 7.58 3.68 2.01 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 1.48 0.96 0.88 0.00 0.00 27 E 8.05 3.90 0.00 1.89 1.75 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 2.13 2.08 0.00 28 A 8.65 4.30 1.54 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 29 V 7.94 3.52 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 0.99 0.00 0.00 0.80 0.00 0.00 30 R 7.96 3.89 0.00 1.97 2.21 0.00 3.16 0.00 0.00 3.48 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 31 R 8.40 3.95 0.00 2.07 1.96 0.00 3.44 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.14 0.00 32 L 8.13 3.92 0.00 1.88 1.73 1.02 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 33 K 8.16 4.07 0.00 1.96 1.89 0.00 1.71 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.51 1.50 7.81 34 Q 7.84 3.95 0.00 2.25 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.91 0.00 0.00 0.00 0.00 0.00 2.38 2.42 0.00 35 S 7.63 4.46 0.00 3.95 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 36 G 8.10 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 V 7.32 3.97 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 0.75 0.00 0.00 0.83 0.00 0.00 38 Y 8.69 4.73 0.00 3.06 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 39 V 8.56 4.98 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 1.04 0.00 0.00 1.05 0.00 0.00 40 A 8.77 5.39 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 I 8.76 5.04 2.09 0.00 0.00 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 1.42 0.93 0.67 0.00 0.00 42 A 9.18 5.23 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 43 T 9.11 4.47 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 0.54 0.00 0.00 44 G 8.55 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 45 R 7.57 3.87 0.00 1.66 1.69 0.00 2.93 0.00 0.00 3.09 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.35 0.00 46 A 7.43 2.93 0.32 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 47 P 0.00 3.60 0.00 2.16 2.07 0.00 3.14 0.00 0.00 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 2.24 0.00 48 F 6.96 4.39 0.00 3.26 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 *50 F 7.66 4.64 0.00 3.23 3.20 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 51 E 7.98 3.64 0.00 1.86 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 2.32 2.25 0.00 52 H 8.12 4.12 0.00 3.27 3.30 0.00 5.92 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 V 7.70 3.82 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 1.17 0.00 0.00 1.01 0.00 0.00 54 R 7.80 3.96 0.00 1.95 2.14 0.00 3.45 0.00 0.00 2.65 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.66 0.00 55 K 8.21 3.97 0.00 1.99 1.82 0.00 1.66 0.00 0.00 1.81 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.47 7.81 56 Q 8.15 4.06 0.00 2.22 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.71 0.00 0.00 0.00 0.00 0.00 2.27 2.27 0.00 57 L 7.77 4.59 0.00 1.61 1.66 0.82 0.91 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 58 G 7.46 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 I 8.07 4.43 1.97 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 1.42 0.85 1.14 0.00 0.00 60 D 8.68 5.23 0.00 2.68 2.83 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 61 S 7.97 5.04 0.00 3.95 3.80 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 62 F 8.57 5.36 0.00 3.32 3.36 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 63 V 9.18 4.85 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 1.15 0.00 0.00 1.04 0.00 0.00 64 S 9.30 5.14 0.00 4.09 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 0.00 65 F 9.24 4.45 0.00 3.31 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 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3.06 3.35 0.00 5.66 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 P 0.00 4.70 0.00 1.97 2.07 0.00 3.83 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.39 0.00 101 L 9.03 5.96 0.00 1.12 1.08 0.87 0.60 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 0.00 102 V 7.89 4.43 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 1.14 0.00 0.00 1.05 0.00 0.00 103 F 8.87 5.09 0.00 3.12 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 *105 D 8.15 4.70 0.00 3.01 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 0.00 106 A 8.78 4.18 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 E 8.50 4.26 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.40 0.00 108 K 9.09 2.79 0.00 1.33 1.26 0.00 1.54 0.00 0.00 1.65 0.00 0.00 3.19 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.28 1.11 7.81 *110 R 8.46 4.22 0.00 1.68 1.92 0.00 3.24 0.00 0.00 3.24 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.88 0.00 111 A 8.32 4.93 1.19 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 0.00 112 S 8.85 4.39 0.00 3.99 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 0.00 113 I 7.62 4.52 1.81 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.89 0.92 0.00 0.00 114 G 8.49 3.78 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 0.00 0.00 0.00 0.00 0.00 0.00 115 D 8.16 4.01 0.00 2.65 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 0.00 116 H 7.63 4.36 0.00 3.27 3.03 0.00 5.85 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 P 0.00 4.33 0.00 2.26 2.26 0.00 3.30 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 1.73 1.90 0.00 118 H 8.20 4.43 0.00 3.29 3.52 0.00 5.62 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 I 7.41 3.01 1.66 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 0.38 0.00 0.00 120 H 7.77 4.33 0.00 3.32 3.40 0.00 5.68 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 V 7.79 3.86 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 1.09 0.00 0.00 122 S 8.08 3.83 0.00 3.87 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 *124 A 8.32 4.86 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.92 4.32 0.00 4.18 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 0.00 126 L 7.55 4.47 0.00 2.03 2.01 0.93 0.54 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 0.00 127 K 8.37 4.00 0.00 1.85 1.84 0.00 1.65 0.00 0.00 1.93 0.00 0.00 3.04 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.40 1.54 7.81 128 F 8.10 4.67 0.00 3.17 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 8.42 4.46 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 0.00 130 H 8.66 4.14 0.00 3.04 3.22 0.00 5.94 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 P 0.00 4.45 0.00 2.00 1.91 0.00 3.43 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.10 0.00 132 P 0.00 4.55 0.00 2.03 1.95 0.00 3.50 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 2.06 2.07 0.00 133 V 8.30 4.47 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 0.67 0.00 0.00 1.03 0.00 0.00 134 D 9.34 4.53 0.00 2.76 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 0.00 135 P 0.00 4.78 0.00 2.19 2.26 0.00 3.76 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 2.11 2.40 0.00 136 L 8.01 4.31 0.00 1.59 1.32 0.86 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 137 Y 7.87 3.94 0.00 3.20 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 Y 7.16 4.00 0.00 2.83 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 0.00 0.00 0.00 0.00 139 E 6.78 3.78 0.00 1.72 1.75 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 1.47 1.84 0.00 140 N 7.61 4.74 0.00 2.59 2.72 0.00 0.00 5.80 7.13 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 0.00 141 K 7.04 4.47 0.00 1.05 1.40 0.00 1.59 0.00 0.00 1.52 0.00 0.00 2.94 0.00 0.00 2.87 0.00 0.00 0.00 0.00 0.73 0.54 7.81 142 D 8.38 4.34 0.00 2.48 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 0.00 0.00 0.00 143 I 7.88 4.29 1.78 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.39 0.93 0.00 0.00 144 Y 7.79 3.65 0.00 1.58 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 0.00 0.00 0.00 0.00 145 Q 6.98 4.63 0.00 1.71 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.81 0.00 0.00 0.00 0.00 0.00 2.16 2.40 0.00 146 A 8.40 4.92 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 0.00 147 L 8.66 4.91 0.00 1.39 0.93 0.98 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 148 L 8.54 4.55 0.00 1.60 1.40 0.59 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 149 F 8.84 5.50 0.00 2.87 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 0.00 150 C 7.92 4.69 0.00 2.79 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 0.00 151 R 9.61 4.44 0.00 1.81 2.10 0.00 3.29 0.00 0.00 3.22 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 152 A 8.28 4.49 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 0.00 153 E 8.12 4.35 0.00 1.96 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 2.31 2.38 0.00 154 E 7.92 4.65 0.00 2.03 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.30 0.00 155 E 8.03 4.28 0.00 2.18 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 0.00 2.48 2.30 0.00 156 E 8.10 3.75 0.00 2.02 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 2.34 2.41 0.00 157 P 0.00 4.09 0.00 1.62 1.87 0.00 3.62 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.07 0.00 158 Y 7.30 4.33 0.00 2.64 2.39 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 0.00 159 V 7.41 3.56 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 0.91 0.00 0.00 0.91 0.00 0.00 160 R 8.22 4.11 0.00 1.73 1.94 0.00 3.18 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.78 0.00 161 N 8.72 4.48 0.00 2.61 2.41 0.00 0.00 6.85 7.94 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 0.00 162 Y 8.17 5.56 0.00 3.63 3.10 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 0.00 0.00 0.00 0.00 163 P 0.00 4.64 0.00 2.19 2.21 0.00 3.81 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.93 0.00 164 E 8.06 4.15 0.00 1.84 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 0.00 1.84 1.88 0.00 165 F 7.96 5.69 0.00 2.90 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 0.00 0.00 0.00 0.00 166 R 8.94 4.66 0.00 1.89 1.74 0.00 3.19 0.00 0.00 3.28 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.65 0.00 167 F 9.25 4.94 0.00 2.98 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 0.00 168 V 8.48 4.38 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 1.04 0.00 0.00 0.97 0.00 0.00 169 R 8.77 4.60 0.00 1.87 1.82 0.00 3.18 0.00 0.00 3.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.67 0.00 170 W 8.46 5.00 0.00 3.59 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 0.00 171 H 6.90 4.59 0.00 1.40 1.95 0.00 5.95 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 D 7.86 4.31 0.00 2.49 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 0.00 173 V 7.47 4.42 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 0.59 0.00 0.00 0.94 0.00 0.00 174 S 7.17 4.71 0.00 3.63 2.68 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 0.00 175 T 8.69 4.76 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 1.31 0.00 0.00 176 D 9.38 4.89 0.00 2.74 2.50 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.64 3.95 1.73 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 -0.09 0.00 0.00 0.62 0.00 0.00 178 L 8.11 5.11 0.00 1.61 1.50 0.98 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 179 P 0.00 5.15 0.00 2.21 2.28 0.00 3.82 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.05 0.00 180 A 8.44 4.17 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 0.00 181 G 9.20 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 0.00 182 G 7.85 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 0.00 183 S 7.95 4.60 0.00 4.01 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 K 8.50 3.98 0.00 1.96 2.10 0.00 1.50 0.00 0.00 1.79 0.00 0.00 3.12 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.45 1.45 7.81 185 A 7.80 3.79 1.20 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 0.00 0.00 186 E 7.56 3.67 0.00 1.78 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 0.00 2.23 2.20 0.00 187 G 7.64 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 I 7.55 3.62 1.74 0.00 0.00 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 -0.12 0.27 0.56 0.00 0.00 189 R 7.26 4.25 0.00 1.40 1.75 0.00 3.16 0.00 0.00 3.03 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.75 0.00 *192 I 7.58 4.19 2.13 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.94 1.18 0.00 0.00 193 E 8.22 3.93 0.00 2.26 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.28 0.00 194 K 7.96 3.96 0.00 1.64 1.80 0.00 1.76 0.00 0.00 1.69 0.00 0.00 3.04 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.40 1.39 7.81 195 L 7.71 3.88 0.00 1.54 1.57 0.49 -0.51 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 0.00 196 G 7.53 3.78 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 0.00 0.00 0.00 0.00 0.00 0.00 197 I 7.95 4.44 1.93 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.73 1.03 0.00 0.00 198 D 8.45 4.55 0.00 2.87 2.53 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 0.00 199 K 8.79 3.67 0.00 1.64 1.63 0.00 1.23 0.00 0.00 0.74 0.00 0.00 2.72 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.08 1.26 7.81 200 K 7.98 3.94 0.00 1.67 1.82 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.37 1.41 7.81 201 D 8.63 4.90 0.00 2.65 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 0.00 202 V 7.95 4.81 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 1.18 0.00 0.00 1.05 0.00 0.00 203 Y 9.36 5.25 0.00 2.91 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 0.00 204 A 8.62 5.31 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 0.00 205 F 9.46 5.24 0.00 3.13 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 0.00 206 G 9.48 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 0.00 0.00 0.00 0.00 207 D 9.08 4.61 0.00 2.78 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 208 G 8.37 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 0.00 209 L 8.32 4.00 0.00 1.70 1.70 0.85 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 210 N 8.12 4.62 0.00 2.83 2.94 0.00 0.00 5.97 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 0.00 211 D 8.04 4.76 0.00 2.86 2.78 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 0.00 0.00 0.00 212 I 7.70 3.82 1.96 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 1.20 0.98 0.92 0.00 0.00 213 E 8.14 3.84 0.00 1.98 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 *215 L 8.01 4.31 0.00 2.02 1.75 1.02 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 216 S 8.06 4.27 0.00 4.01 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 0.00 217 F 8.18 4.27 0.00 3.03 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 0.00 218 V 7.54 3.51 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 0.80 0.00 0.00 0.93 0.00 0.00 219 G 8.34 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 0.00 0.00 0.00 220 T 7.69 4.59 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 1.23 0.00 0.00 221 G 9.74 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 0.00 0.00 0.00 0.00 222 V 8.97 4.90 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 0.00 0.00 0.96 0.00 0.00 0.52 0.00 0.00 223 A 7.93 5.47 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 *225 G 8.79 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 0.00 0.00 0.00 226 N 7.93 4.93 0.00 2.72 2.83 0.00 0.00 6.87 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 0.00 227 A 7.80 4.64 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 0.00 228 H 8.12 4.28 0.00 3.38 3.20 0.00 5.79 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 E 8.49 4.03 0.00 1.98 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 2.36 2.33 0.00 230 E 8.38 4.06 0.00 2.03 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 2.46 2.36 0.00 231 V 7.85 3.86 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 1.07 0.00 0.00 1.04 0.00 0.00 232 K 7.91 4.02 0.00 1.97 1.82 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.87 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.52 1.69 7.81 233 R 7.97 3.86 0.00 1.91 2.10 0.00 3.26 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.61 0.00 234 V 7.21 3.87 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 0.71 0.00 0.00 1.08 0.00 0.00 235 A 7.34 4.20 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 0.00 236 D 8.77 4.66 0.00 2.67 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 0.00 237 F 7.82 4.66 0.00 3.05 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 0.00 238 V 7.44 4.54 1.82 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 0.77 0.00 0.00 0.83 0.00 0.00 239 T 8.56 4.72 4.75 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 1.55 0.00 0.00 240 K 8.61 4.16 0.00 1.79 1.70 0.00 1.42 0.00 0.00 1.46 0.00 0.00 2.49 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.15 0.93 7.81 241 P 0.00 4.63 0.00 2.19 1.98 0.00 3.60 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 2.10 2.07 0.00 242 V 8.52 3.64 2.32 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 0.77 0.00 0.00 1.08 0.00 0.00 243 D 8.03 4.83 0.00 2.81 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 0.00 244 K 7.94 4.58 0.00 1.90 1.78 0.00 1.82 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.34 1.49 7.81 245 E 8.52 4.06 0.00 2.36 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 0.00 2.31 2.32 0.00 246 G 7.75 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 0.00 247 I 7.86 3.85 1.84 0.00 0.00 0.58 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 0.85 0.62 0.00 0.00 248 W 8.28 4.12 0.00 3.62 3.26 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 0.00 249 Y 9.03 4.16 0.00 3.26 3.34 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 0.00 250 G 8.66 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 0.00 251 L 8.08 3.95 0.00 1.62 1.52 0.87 0.91 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 0.00 252 K 7.54 3.69 0.00 1.47 1.49 0.00 1.27 0.00 0.00 0.92 0.00 0.00 2.93 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.25 1.28 7.81 253 Q 7.39 3.73 0.00 1.60 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.73 0.00 0.00 0.00 0.00 0.00 1.60 2.31 0.00 254 L 7.59 3.95 0.00 1.37 1.55 0.91 0.88 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 0.00 255 Q 7.43 3.50 0.00 2.11 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.01 6.99 0.00 0.00 0.00 0.00 0.00 2.15 2.29 0.00 256 L 7.83 4.04 0.00 1.48 1.47 0.04 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 257 I 7.17 3.95 1.31 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 1.06 0.33 0.38 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.