NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -1 H 5.0414 8.3448 115.7059 55.3450 30.3073 172.6669 *2 I 4.2024 7.5468 119.6964 62.4160 39.0457 174.6791 3 I 4.6772 8.2381 126.3133 59.4360 39.7438 174.2856 4 L 5.2314 8.4667 128.1320 53.1266 45.0456 174.6513 5 K 5.0924 9.1489 127.9625 55.0728 34.6412 174.8803 6 L 4.9119 8.7391 126.8465 52.6707 43.9508 176.3035 7 G 3.9235 8.9114 112.5318 45.8375 0.0000 174.6125 8 G 3.9108 9.0755 112.3675 48.4188 0.0000 176.0372 9 S 4.1111 8.1646 113.7113 61.2078 63.4081 175.5541 10 V 3.7212 8.0451 119.8906 65.1743 31.3549 176.4502 11 I 4.2141 7.6139 111.1875 60.9715 38.3534 174.4857 12 T 5.3614 7.8665 111.5479 59.8325 72.5125 172.8573 13 R 4.7346 8.7109 117.4841 54.3255 32.3480 174.5450 14 K 4.2142 8.7915 124.2477 54.2385 33.0595 175.8341 15 D 5.6756 8.1053 135.0000 54.6546 43.2000 175.2874 16 S 4.5035 7.3744 109.8064 56.7787 65.1499 174.3663 17 E 4.0011 8.9549 124.8157 59.1001 29.3816 177.2051 18 E 4.2981 7.7299 116.1021 54.4783 30.7404 174.4562 19 P 4.1730 0.0000 0.0000 63.0865 32.1406 175.3874 20 A 4.8880 7.8307 122.3160 50.9154 22.9665 176.0282 21 I 4.3477 8.5045 120.5322 61.2181 38.5102 177.2370 22 D 4.6051 8.9483 125.7376 52.6506 38.8961 176.5912 23 R 3.8916 8.1801 124.0802 59.3218 30.3525 177.1361 24 D 4.3467 8.0644 117.7898 57.4914 40.9163 178.3280 25 N 4.3587 8.7948 117.3349 56.0521 38.4770 177.3588 26 L 3.8864 7.9860 121.6496 58.3686 42.2720 178.9007 27 E 4.0673 8.2886 118.5332 59.1925 29.2069 179.4926 28 R 3.8604 7.8527 118.4644 59.4747 30.1442 178.6190 29 I 3.6638 8.2218 119.8471 64.2155 37.0972 178.0823 30 A 3.9588 8.3822 122.0568 55.4115 18.1149 179.6499 31 S 4.3517 8.1592 112.8727 61.0988 62.4758 176.2050 32 E 3.9618 8.4937 121.5696 59.4117 29.1740 179.4874 33 I 3.8343 8.1280 120.2056 64.1186 36.9533 178.4056 34 G 3.7808 8.2892 105.9009 48.2615 0.0000 175.1190 35 N 4.4986 8.1386 117.8470 55.7912 38.6277 177.2426 36 A 4.0223 8.0894 121.3562 52.6911 19.7102 177.3415 37 S 3.5877 8.0622 111.0542 58.5373 61.1526 170.4775 38 P 4.4300 0.0000 0.0000 62.8587 32.1277 177.5692 39 S 4.2014 8.5572 115.3636 60.5814 63.4751 174.3035 40 S 4.4281 7.7714 114.7544 56.6246 64.0771 171.9624 41 L 5.2127 7.8666 128.7129 52.8144 45.1980 173.8412 *43 I 4.3038 8.0313 117.0760 61.4687 38.7720 174.9749 44 V 5.0395 8.5743 126.3012 61.5461 33.9134 174.1533 45 H 5.4553 9.1214 121.8238 53.6503 32.2220 173.1440 46 G 4.2830 8.9184 107.4373 46.2075 0.0000 173.4399 47 A 4.6291 8.9409 121.4844 51.5526 21.0503 179.1371 48 G 4.3529 8.2062 104.8691 45.5694 0.0000 175.9627 49 S 4.3579 8.8880 118.2161 59.5132 62.9762 175.4901 50 F 4.4938 8.9600 120.3604 59.7720 39.0936 175.6119 51 G 4.0445 8.4066 104.3724 45.0747 0.0000 175.1429 52 H 4.0680 7.9379 116.3014 57.8961 29.4414 175.3728 53 P 4.0048 0.0000 0.0000 65.6833 30.8620 178.5070 54 F 4.3558 7.5997 115.2293 60.0427 39.3413 177.5401 55 A 4.2773 8.2471 120.6721 55.3517 18.1405 179.6782 56 G 3.5932 8.7097 104.2481 48.1930 0.0000 175.2359 57 E 3.8021 7.6210 121.1877 58.3744 29.6540 177.7754 58 Y 4.4495 7.6340 113.1476 56.3241 39.5737 175.5133 59 R 3.9437 8.3605 118.6831 57.0919 28.2769 176.2789 60 I 4.1161 7.7032 118.1922 62.7969 37.6271 177.0270 61 G 4.3804 9.3886 112.9608 45.8843 0.0000 172.5892 62 S 4.8339 7.4502 112.8165 55.5916 65.6167 173.5865 63 E 4.2569 8.5033 120.4044 56.3247 29.7163 176.7952 64 I 4.2479 8.2661 124.8527 60.3716 37.5845 175.4795 65 E 4.1594 8.6627 126.2877 58.3081 30.2271 177.0016 66 N 4.8471 7.6399 116.2341 52.4710 42.1755 175.5522 67 E 4.2447 8.5378 123.5008 58.2432 29.7589 179.2261 68 E 4.0738 8.3536 119.3730 59.3423 29.6611 178.5208 69 D 4.4815 8.0601 118.4969 57.9019 40.8642 177.8399 70 L 4.2090 8.1717 121.3041 57.0926 41.5831 178.7296 71 R 4.0012 8.3573 117.7432 59.6015 30.2888 179.0962 72 R 4.1506 8.0577 117.7773 59.5760 30.1907 178.7860 73 R 4.2080 8.2439 117.7615 59.0307 29.9756 179.3375 74 R 3.4595 8.0846 118.2581 59.2019 30.0997 178.8671 75 F 4.0908 7.9229 119.6696 61.0552 39.3893 177.4654 76 G 2.3323 7.8370 105.5048 46.7887 0.0000 175.4686 77 F 3.7524 7.8166 122.8593 60.9941 39.2718 177.0982 78 A 3.8592 7.5276 119.7528 54.9859 18.2732 179.3066 79 L 3.5646 7.2286 118.7571 58.5836 42.1371 179.2896 80 T 3.8615 8.0636 115.9736 66.6266 68.3160 176.4695 81 Q 3.8248 7.8741 121.4702 58.9638 29.0183 177.4702 82 N 4.1085 7.8947 118.1340 56.6074 39.0202 176.8578 83 W 3.8288 7.7660 119.9114 59.7466 29.1855 178.7200 84 V 3.8721 8.2047 117.9865 65.2632 30.8533 178.0849 85 K 3.7636 8.1034 119.9102 59.2979 32.0426 178.7734 86 K 3.7625 8.0737 118.8496 59.2669 31.8889 178.8530 87 L 3.2883 7.6433 120.0479 58.1495 41.8786 178.5725 88 N 4.0123 7.7386 116.9250 56.5646 38.5819 176.8785 89 S 4.0966 8.1707 116.0865 61.5456 62.9945 176.3429 90 H 4.1504 7.8039 119.9217 58.4465 28.4397 177.8090 91 V 3.4564 7.7803 120.3709 66.2527 31.3147 177.8546 92 C 4.0770 8.3195 116.7439 62.8490 27.8731 175.5714 93 D 4.3490 8.3132 120.5500 57.7186 40.1236 179.1457 94 A 3.9889 7.9122 120.8232 54.9727 18.4494 179.7139 95 L 3.8038 7.9667 117.7134 57.7681 41.5888 179.6052 96 L 4.1907 8.2893 119.3364 57.4858 41.3982 179.1666 97 A 3.7103 8.1267 119.9011 54.2532 18.1960 178.3796 98 E 4.4579 7.6258 115.9105 55.7749 29.4591 177.1552 99 G 3.7792 8.6311 107.7179 46.0576 0.0000 173.3413 100 I 4.3381 7.3996 120.4457 58.7038 38.3680 175.4899 101 P 4.4646 0.0000 0.0000 61.8516 29.5687 173.7267 102 A 4.7320 7.7337 126.1147 51.4020 20.8448 176.7836 103 V 4.1878 8.4862 122.6985 60.9048 34.2474 176.1497 104 S 4.9958 8.2407 124.5745 57.4872 65.1173 172.6974 *106 Q 3.8294 8.5732 120.1400 55.7677 29.6403 174.7069 107 P 4.0664 0.0000 0.0000 65.7909 31.3958 178.4242 108 S 4.3537 8.2562 109.1203 59.5841 62.7543 174.3490 109 A 4.6503 8.1882 123.9532 52.8207 19.5693 177.8977 110 F 5.0339 8.1473 106.7853 56.4005 39.9124 174.0232 111 I 4.5430 7.7075 121.4990 59.7151 40.1844 174.9698 112 R 4.9236 8.6701 123.0048 54.3825 34.2302 174.3079 113 A 5.3253 9.0145 122.1032 50.6833 23.1987 174.8567 114 H 4.9052 9.3010 118.3773 54.7142 33.1902 173.4462 115 A 3.7377 9.8071 129.8841 53.2420 15.9790 177.6537 116 G 3.9766 9.1502 108.2566 46.5287 0.0000 174.4516 117 R 4.5499 7.5975 118.8521 54.0574 32.0921 175.7658 118 I 4.0431 8.0988 121.8393 61.4332 37.4734 174.8599 119 S 4.1372 8.4716 122.8567 58.3980 63.1498 173.8535 120 H 4.8054 8.2434 116.8044 53.8960 32.3362 173.7085 121 A 4.6644 7.5996 126.5333 50.8657 21.4796 175.8639 122 D 4.5750 8.8588 124.0029 54.6366 41.8789 175.9498 123 I 4.7534 8.4535 119.5860 60.7264 38.5134 177.5238 124 S 4.2801 8.6999 119.5329 61.6456 63.1978 175.7280 125 L 3.7039 7.7216 122.0201 57.5331 41.3853 178.8265 126 I 3.7470 7.7627 119.2727 64.8728 37.0094 177.9724 127 R 3.9281 7.6867 118.2740 59.6761 29.9106 179.2833 128 S 4.1919 7.7822 114.2894 61.7721 62.5819 176.3038 129 Y 4.2444 7.6997 118.3600 61.2707 37.9828 178.5192 130 L 4.1851 8.2797 119.9763 57.9130 41.4769 179.4899 131 E 4.0841 8.4104 118.1092 59.0440 29.3764 178.1653 132 E 4.5568 8.1855 116.6787 55.1338 30.7533 175.3923 133 G 3.4335 7.6212 111.5975 45.5828 0.0000 172.4282 *135 V 4.0665 7.3156 120.4058 62.1431 32.8633 171.8709 136 P 4.5568 0.0000 0.0000 62.5494 32.3549 176.0737 137 V 4.4782 8.8697 124.0328 61.4985 34.0919 175.1580 138 V 4.8344 8.4922 121.8447 60.4269 34.5150 174.2709 139 Y 5.1289 7.7165 118.1073 55.6215 40.4874 174.6801 140 G 3.8758 8.5725 108.3523 47.3963 0.0000 172.2169 141 D 4.7884 8.7301 122.1372 53.3870 45.5493 174.0910 142 V 4.5734 7.9800 114.8144 60.4016 32.9084 176.0972 143 V 4.7710 9.2393 123.8281 60.6887 35.4224 174.6142 144 L 4.5118 8.9311 126.1559 55.6227 42.7274 175.3560 145 D 5.4024 8.8078 123.4479 52.5002 42.8702 175.9393 146 S 4.2937 9.1446 120.7861 59.5095 64.0265 174.0482 147 D 4.3284 8.3544 121.8136 53.7031 40.0778 176.4762 148 R 3.8914 8.4632 127.9729 58.8200 30.4189 177.8683 149 R 4.0942 8.7713 117.1679 58.2380 30.4767 177.9994 150 L 4.2378 7.9846 116.6014 55.3030 43.6616 177.4561 151 K 4.0902 8.1911 121.1423 56.2097 30.8790 175.8946 152 F 5.5327 7.1098 114.8800 55.9431 43.5435 174.1432 153 S 5.0941 9.2161 117.6329 56.4680 67.3472 173.4710 154 V 4.1786 8.5485 122.8336 63.0578 32.3482 175.1228 155 I 4.6467 8.9391 129.8515 59.5815 39.1945 176.0998 156 S 4.8042 9.1394 122.7430 57.0154 64.4342 175.5851 157 G 3.6943 8.6369 106.9718 47.8937 0.0000 175.3681 158 D 4.4128 8.1687 120.6165 57.5498 40.8579 178.5123 159 Q 4.0037 7.8259 118.2317 59.2483 28.7376 179.3559 160 L 4.0304 7.9660 119.6173 58.0332 41.7914 179.5754 161 I 3.8267 8.1541 118.6612 63.8780 37.4301 177.4084 162 N 4.2541 8.3663 118.0429 56.9324 38.5572 176.1589 163 H 3.9327 8.8453 120.5038 59.5249 29.9060 177.2075 164 F 4.3510 8.3054 119.1833 60.2220 38.5338 178.1474 165 S 4.2181 7.9555 114.4360 61.2648 62.6657 176.0080 166 L 4.0887 7.3212 120.9373 58.4584 41.9702 179.0900 167 R 4.1039 7.4786 116.1524 58.3105 30.1539 177.1841 168 L 3.9808 8.6132 118.5301 55.3207 41.4234 175.2403 *170 P 4.1918 0.0000 0.0000 62.5982 32.8522 176.9089 171 E 4.0415 8.6743 119.7878 59.0969 30.0764 176.5461 172 R 4.8019 7.6853 116.0128 54.1849 35.0190 173.7590 173 V 4.9262 8.2984 120.2551 61.2685 34.7892 174.2208 174 I 5.0491 8.7031 127.5409 59.5382 41.1668 174.0731 175 L 4.8697 9.3094 127.4953 52.9018 44.3831 175.6775 176 G 4.2787 9.0896 112.6115 45.2838 0.0000 172.1686 177 T 5.0924 8.8878 122.7249 59.8982 71.0839 173.8582 178 D 4.8660 8.7162 120.2932 53.1980 39.9154 175.7851 179 V 4.6546 7.2121 112.5036 59.8302 35.9835 175.9343 180 D 4.5568 8.9716 119.8348 56.0776 41.0664 176.4007 181 G 4.2299 7.3142 103.0203 46.1877 0.0000 172.1103 182 V 4.2030 8.1452 120.4570 62.7224 32.6573 175.9234 183 Y 5.0904 8.6470 125.0065 56.3413 40.1314 175.8587 184 T 4.1719 8.5768 110.3211 64.4429 69.3279 174.4141 185 R 4.4454 7.6766 119.0771 54.7767 34.3034 173.7343 186 N 4.3856 8.6660 117.0123 53.2850 38.1429 173.3493 187 P 3.9636 0.0000 0.0000 65.0790 31.3970 177.7913 188 K 4.1275 8.0967 117.4828 57.9760 32.2700 178.0101 189 K 4.4944 8.1078 115.3397 57.5344 34.5318 175.9398 190 H 4.7703 7.9019 117.7570 52.8856 29.4192 172.2077 191 P 4.3375 0.0000 0.0000 64.8312 31.3835 177.1943 192 D 4.6117 8.0121 115.0395 52.7464 39.9474 176.1155 193 A 4.0487 7.9412 122.6922 53.3592 19.0474 177.2751 194 R 4.7020 8.7684 121.6498 53.8971 32.5579 175.6878 195 L 3.2272 8.6488 125.4817 55.7604 42.4558 175.9313 196 L 4.7518 8.5207 126.3031 53.3747 42.9130 176.2161 197 D 4.6953 8.6440 121.5952 54.2165 41.1787 175.8380 198 V 4.8321 7.3844 116.9772 61.2052 34.7446 174.4056 199 I 4.4496 8.2368 128.0698 60.8903 41.6647 179.0982 *219 G 3.4687 8.9736 125.8114 46.4507 0.0000 172.0344 *221 V 4.0120 7.8684 125.3276 62.2734 32.9437 177.3351 222 G 3.6919 7.4725 105.9091 46.5841 0.0000 175.3369 223 K 4.2265 7.6485 119.8054 58.4544 33.2556 178.5230 224 I 3.7493 7.5060 118.7786 64.2341 37.8802 177.6012 225 R 3.8288 8.0400 118.8980 59.5589 29.7450 177.9531 226 E 3.9693 8.2705 117.9552 59.7545 29.5944 179.0880 227 L 4.0801 7.7193 118.1349 57.0485 41.5715 179.6735 228 L 3.9558 7.9160 119.5278 57.7321 41.7562 178.8094 229 L 3.8768 7.5036 119.1173 58.0138 41.5951 179.4080 230 L 3.8847 7.7720 119.2943 58.2863 42.1137 178.5282 231 A 4.6132 8.1257 122.3179 55.1292 18.0410 179.1646 232 E 3.9674 8.4269 115.5977 59.4438 29.6455 179.1769 233 K 4.5195 7.5019 115.1634 56.4180 32.6303 177.6070 234 G 4.0664 8.2216 106.8756 44.8620 0.0000 174.0744 235 V 4.5598 7.9784 119.2967 60.8405 35.0625 174.1185 236 E 5.0221 8.7539 125.2854 54.6832 32.5408 175.6443 237 S 4.9433 8.6571 118.9199 56.9809 66.7489 172.5243 238 E 5.0889 8.7345 118.4083 54.7919 33.3155 175.1076 239 I 4.8307 8.6901 125.7464 60.3768 39.2463 175.0667 240 I 4.9233 8.6368 125.7624 60.0414 42.5373 173.3165 241 N 5.4041 8.9549 121.8539 51.7957 39.2342 174.2678 242 A 4.5438 9.0030 128.1698 52.4204 19.1588 177.8343 243 A 4.0228 8.6103 118.3331 53.6066 18.9303 177.8017 244 V 4.1040 7.5571 116.7294 60.4838 32.4408 173.2873 245 P 4.1162 0.0000 0.0000 64.6433 31.7280 176.4583 246 G 4.0618 9.4275 111.3770 45.9795 0.0000 175.1140 247 N 4.2853 7.9472 117.6720 56.4962 38.4274 177.2082 248 I 3.6792 7.7695 120.5052 64.4289 37.4081 177.9313 249 E 3.8762 8.8368 120.4388 59.2801 29.4629 179.1559 250 R 3.8939 8.6215 118.1634 59.1212 30.1786 178.8360 251 A 3.9728 8.6565 120.9124 55.3647 18.2347 179.4242 252 L 4.0276 8.3588 116.5037 57.9103 41.7961 179.0291 253 L 4.4158 7.5953 115.4680 54.6212 41.9899 177.6245 254 G 3.9487 8.3853 108.1732 45.2136 0.0000 173.5855 255 E 4.3846 7.7351 118.5854 54.6779 30.6036 176.2890 256 E 3.9669 8.6441 120.5965 57.2716 29.9441 177.0863 257 V 4.5104 7.9127 121.5740 60.9848 34.9243 174.6384 258 R 4.2145 8.5417 124.5049 54.9535 31.1462 177.9101 259 G 4.1645 7.3518 107.3764 45.9605 0.0000 170.8937 260 T 4.7639 7.5880 116.9015 61.7851 71.8346 173.7213 261 R 4.8280 8.3682 125.7650 55.0924 32.5263 176.2062 262 I 4.2447 8.4145 124.5646 61.4849 37.4591 175.3925 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 -1 H 8.34 5.04 0.00 3.24 3.50 0.00 5.33 0.00 0.00 0.00 0.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *2 I 7.55 4.20 1.89 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 1.36 1.38 0.93 0.00 0.00 3 I 8.24 4.68 1.91 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.02 0.96 0.00 0.00 4 L 8.47 5.23 0.00 1.74 1.49 1.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 5 K 9.15 5.09 0.00 1.90 1.68 0.00 1.68 0.00 0.00 1.69 0.00 0.00 2.91 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.42 1.55 7.81 6 L 8.74 4.91 0.00 1.64 1.56 0.92 0.89 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 7 G 8.91 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 8 G 9.08 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 0.00 0.00 0.00 9 S 8.16 4.11 0.00 4.08 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 V 8.05 3.72 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 0.98 0.00 0.00 11 I 7.61 4.21 1.82 0.00 0.00 0.77 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 1.07 0.90 0.00 0.00 12 T 7.87 5.36 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 1.42 0.00 0.00 13 R 8.71 4.73 0.00 1.79 1.91 0.00 3.06 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.56 0.00 14 K 8.79 4.21 0.00 1.75 1.72 0.00 1.85 0.00 0.00 1.58 0.00 0.00 2.62 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.30 1.34 7.81 15 D 8.11 5.68 0.00 2.71 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 16 S 7.37 4.50 0.00 3.78 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 17 E 8.95 4.00 0.00 1.94 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 2.28 2.32 0.00 18 E 7.73 4.30 0.00 1.98 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.32 0.00 19 P 0.00 4.17 0.00 0.49 1.13 0.00 3.03 0.00 0.00 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.41 0.00 20 A 7.83 4.89 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 21 I 8.50 4.35 1.87 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.34 0.94 0.00 0.00 22 D 8.95 4.61 0.00 2.70 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 23 R 8.18 3.89 0.00 1.91 1.93 0.00 3.24 0.00 0.00 3.44 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.79 0.00 24 D 8.06 4.35 0.00 2.73 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 25 N 8.79 4.36 0.00 2.87 2.87 0.00 0.00 6.70 7.22 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 26 L 7.99 3.89 0.00 1.74 1.71 0.86 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 27 E 8.29 4.07 0.00 2.05 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.42 0.00 28 R 7.85 3.86 0.00 1.90 2.12 0.00 3.24 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.67 0.00 29 I 8.22 3.66 2.05 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 1.46 0.47 0.91 0.00 0.00 30 A 8.38 3.96 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 31 S 8.16 4.35 0.00 3.96 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 32 E 8.49 3.96 0.00 2.20 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 0.00 2.51 2.48 0.00 33 I 8.13 3.83 1.98 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 1.46 0.91 0.91 0.00 0.00 34 G 8.29 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 35 N 8.14 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0.00 0.00 0.00 0.00 0.00 0.00 78 A 7.53 3.86 1.12 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 0.00 0.00 79 L 7.23 3.56 0.00 1.20 1.41 0.99 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 80 T 8.06 3.86 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 81 Q 7.87 3.82 0.00 1.80 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.77 0.00 0.00 0.00 0.00 0.00 2.43 2.39 0.00 82 N 7.89 4.11 0.00 2.77 2.42 0.00 0.00 7.25 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 83 W 7.77 3.83 0.00 3.32 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 84 V 8.20 3.87 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 1.11 0.00 0.00 85 K 8.10 3.76 0.00 1.98 1.92 0.00 1.61 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.36 1.49 7.81 86 K 8.07 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 V 8.49 4.19 1.56 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 0.47 0.00 0.00 0.76 0.00 0.00 104 S 8.24 5.00 0.00 4.12 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 *106 Q 8.57 3.83 0.00 2.24 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.88 0.00 0.00 0.00 0.00 0.00 2.33 2.53 0.00 107 P 0.00 4.07 0.00 2.12 1.91 0.00 3.00 0.00 0.00 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.83 0.00 108 S 8.26 4.35 0.00 4.12 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 0.00 109 A 8.19 4.65 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 F 8.15 5.03 0.00 3.14 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 0.00 111 I 7.71 4.54 1.62 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.43 -0.36 0.67 0.00 0.00 112 R 8.67 4.92 0.00 1.72 1.77 0.00 3.08 0.00 0.00 3.18 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.55 0.00 113 A 9.01 5.33 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 0.00 114 H 9.30 4.91 0.00 3.17 3.11 0.00 5.93 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 A 9.81 3.74 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 0.00 116 G 9.15 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 0.00 0.00 0.00 117 R 7.60 4.55 0.00 1.95 1.82 0.00 3.29 0.00 0.00 3.17 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.72 0.00 118 I 8.10 4.04 1.68 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.35 0.44 0.00 0.00 119 S 8.47 4.14 0.00 3.96 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 H 8.24 4.81 0.00 3.13 3.17 0.00 5.69 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 A 7.60 4.66 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 D 8.86 4.58 0.00 2.79 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 I 8.45 4.75 2.04 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.90 1.36 0.00 0.00 124 S 8.70 4.28 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 0.00 125 L 7.72 3.70 0.00 1.56 1.60 0.83 0.39 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 0.00 126 I 7.76 3.75 1.87 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.57 0.82 0.00 0.00 127 R 7.69 3.93 0.00 1.97 2.00 0.00 3.26 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 1.68 1.81 0.00 128 S 7.78 4.19 0.00 3.78 3.67 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 0.00 129 Y 7.70 4.24 0.00 3.09 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 0.00 130 L 8.28 4.19 0.00 1.84 1.75 0.97 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 131 E 8.41 4.08 0.00 2.05 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 2.35 2.50 0.00 132 E 8.19 4.56 0.00 1.99 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 0.00 2.47 2.45 0.00 133 G 7.62 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 *135 V 7.32 4.07 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 1.29 0.00 0.00 0.92 0.00 0.00 136 P 0.00 4.56 0.00 1.88 1.87 0.00 3.81 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.10 0.00 137 V 8.87 4.48 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.97 0.00 0.00 138 V 8.49 4.83 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 0.67 0.00 0.00 0.90 0.00 0.00 139 Y 7.72 5.13 0.00 2.71 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 G 8.57 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 0.00 141 D 8.73 4.79 0.00 2.69 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 0.00 0.00 0.00 0.00 142 V 7.98 4.57 1.65 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 0.59 0.00 0.00 -0.11 0.00 0.00 143 V 9.24 4.77 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 1.04 0.00 0.00 0.90 0.00 0.00 144 L 8.93 4.51 0.00 1.65 1.55 0.88 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 145 D 8.81 5.40 0.00 2.58 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 0.00 0.00 0.00 0.00 146 S 9.14 4.29 0.00 3.93 3.97 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 0.00 0.00 0.00 0.00 147 D 8.35 4.33 0.00 2.36 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 0.00 148 R 8.46 3.89 0.00 1.76 1.92 0.00 3.26 0.00 0.00 3.20 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.60 0.00 149 R 8.77 4.09 0.00 1.99 1.94 0.00 3.12 0.00 0.00 3.16 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 150 L 7.98 4.24 0.00 1.50 1.67 0.90 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 151 K 8.19 4.09 0.00 0.97 0.74 0.00 1.43 0.00 0.00 1.46 0.00 0.00 2.74 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.12 1.18 7.81 152 F 7.11 5.53 0.00 3.15 3.28 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 0.00 153 S 9.22 5.09 0.00 3.78 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 0.00 154 V 8.55 4.18 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 0.79 0.00 0.00 0.98 0.00 0.00 155 I 8.94 4.65 1.83 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 1.28 1.20 0.87 0.00 0.00 156 S 9.14 4.80 0.00 4.05 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 G 8.64 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 0.00 0.00 0.00 158 D 8.17 4.41 0.00 2.73 2.77 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.83 4.00 0.00 2.18 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.77 0.00 0.00 0.00 0.00 0.00 2.53 2.44 0.00 160 L 7.97 4.03 0.00 2.00 1.92 1.05 0.79 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 0.00 161 I 8.15 3.83 2.08 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.43 0.96 0.00 0.00 162 N 8.37 4.25 0.00 2.89 3.06 0.00 0.00 6.84 7.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 H 8.85 3.93 0.00 3.08 2.87 0.00 5.83 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 F 8.31 4.35 0.00 3.37 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 0.00 165 S 7.96 4.22 0.00 3.91 3.96 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 0.00 166 L 7.32 4.09 0.00 1.79 1.74 0.91 0.95 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 0.00 167 R 7.48 4.10 0.00 1.84 2.00 0.00 2.95 0.00 0.00 2.94 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.49 0.00 168 L 8.61 3.98 0.00 1.66 1.53 0.99 1.00 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 *170 P 0.00 4.19 0.00 2.38 2.12 0.00 3.95 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.00 0.00 171 E 8.67 4.04 0.00 2.02 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 2.39 2.36 0.00 172 R 7.69 4.80 0.00 1.76 1.76 0.00 3.48 0.00 0.00 3.27 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.60 0.00 173 V 8.30 4.93 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.96 0.00 0.00 174 I 8.70 5.05 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.67 0.93 0.00 0.00 175 L 9.31 4.87 0.00 1.59 1.59 0.95 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 176 G 9.09 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 0.00 177 T 8.89 5.09 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 1.37 0.00 0.00 178 D 8.72 4.87 0.00 2.83 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 V 7.21 4.65 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 1.12 0.00 0.00 180 D 8.97 4.56 0.00 2.88 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 G 7.31 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 V 8.15 4.20 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 0.91 0.00 0.00 0.95 0.00 0.00 183 Y 8.65 5.09 0.00 3.01 2.92 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 0.00 184 T 8.58 4.17 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 185 R 7.68 4.45 0.00 1.73 1.72 0.00 3.15 0.00 0.00 2.81 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.58 0.00 186 N 8.67 4.39 0.00 2.74 2.76 0.00 0.00 6.86 7.71 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 0.00 187 P 0.00 3.96 0.00 1.61 1.01 0.00 3.59 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.83 0.00 188 K 8.10 4.13 0.00 1.67 1.89 0.00 1.76 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.36 7.81 189 K 8.11 4.49 0.00 1.64 1.62 0.00 1.65 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.32 1.35 7.81 190 H 7.90 4.77 0.00 3.25 3.16 0.00 5.64 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 P 0.00 4.34 0.00 2.04 2.12 0.00 3.67 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 192 D 8.01 4.61 0.00 2.80 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 0.00 193 A 7.94 4.05 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 0.00 194 R 8.77 4.70 0.00 1.78 1.86 0.00 3.44 0.00 0.00 3.12 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.72 0.00 195 L 8.65 3.23 0.00 1.21 1.39 0.41 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 196 L 8.52 4.75 0.00 1.59 1.52 0.92 1.02 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 0.00 197 D 8.64 4.70 0.00 2.68 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 V 7.38 4.83 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 0.72 0.00 0.00 0.92 0.00 0.00 199 I 8.24 4.45 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.67 0.91 0.00 0.00 *219 G 8.97 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.87 4.01 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 0.98 0.00 0.00 0.95 0.00 0.00 222 G 7.47 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 0.00 0.00 0.00 223 K 7.65 4.23 0.00 1.87 1.84 0.00 1.75 0.00 0.00 1.78 0.00 0.00 2.94 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.54 1.82 7.81 224 I 7.51 3.75 1.89 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 1.53 1.20 0.97 0.00 0.00 225 R 8.04 3.83 0.00 2.12 2.01 0.00 3.21 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.98 0.00 226 E 8.27 3.97 0.00 2.09 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 2.42 2.50 0.00 227 L 7.72 4.08 0.00 1.82 1.72 0.94 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 228 L 7.92 3.96 0.00 1.97 1.71 0.97 0.54 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 0.00 229 L 7.50 3.88 0.00 1.82 1.76 0.96 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 230 L 7.77 3.88 0.00 1.73 1.87 0.93 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 231 A 8.13 4.61 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 232 E 8.43 3.97 0.00 2.16 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 233 K 7.50 4.52 0.00 1.74 1.80 0.00 1.65 0.00 0.00 1.70 0.00 0.00 3.05 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.44 7.81 234 G 8.22 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 0.00 235 V 7.98 4.56 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 0.99 0.00 0.00 0.94 0.00 0.00 236 E 8.75 5.02 0.00 1.84 1.81 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 2.25 2.27 0.00 237 S 8.66 4.94 0.00 3.90 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 0.00 238 E 8.73 5.09 0.00 1.92 1.84 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 2.22 2.39 0.00 239 I 8.69 4.83 1.88 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 1.24 1.13 0.94 0.00 0.00 240 I 8.64 4.92 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.67 0.97 0.00 0.00 241 N 8.95 5.40 0.00 2.80 2.76 0.00 0.00 7.26 7.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 242 A 9.00 4.54 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 0.00 243 A 8.61 4.02 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 0.00 244 V 7.56 4.10 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 1.01 0.00 0.00 245 P 0.00 4.12 0.00 2.08 2.02 0.00 3.75 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.12 0.00 246 G 9.43 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 0.00 0.00 0.00 247 N 7.95 4.29 0.00 2.79 2.89 0.00 0.00 6.83 7.17 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 0.00 248 I 7.77 3.68 2.09 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 1.53 1.14 0.92 0.00 0.00 249 E 8.84 3.88 0.00 2.01 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 2.31 2.35 0.00 250 R 8.62 3.89 0.00 2.09 1.96 0.00 3.33 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.74 0.00 251 A 8.66 3.97 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 0.00 252 L 8.36 4.03 0.00 1.67 1.78 0.93 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 253 L 7.60 4.42 0.00 1.78 1.70 1.01 0.77 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 0.00 254 G 8.39 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 0.00 255 E 7.74 4.38 0.00 2.15 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 2.31 2.27 0.00 256 E 8.64 3.97 0.00 1.95 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 2.32 0.00 257 V 7.91 4.51 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 0.83 0.00 0.00 1.01 0.00 0.00 258 R 8.54 4.21 0.00 1.84 1.82 0.00 3.38 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.62 0.00 259 G 7.35 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 0.00 260 T 7.59 4.76 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 1.23 0.00 0.00 261 R 8.37 4.83 0.00 1.83 1.76 0.00 3.03 0.00 0.00 3.17 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 262 I 8.41 4.24 1.88 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 1.09 1.07 0.92 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.