NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2383 7.8827 121.4450 61.1486 38.9388 173.9448 17 V 4.3365 8.3096 123.7988 61.5843 33.8155 174.1756 18 G 3.7874 8.9636 113.2444 46.4620 0.0000 173.0237 19 G 4.1174 7.8692 109.2720 43.7460 0.0000 171.7203 20 Y 4.9477 7.9805 116.8707 55.0669 42.0971 174.5720 21 T 4.4475 8.5624 116.1666 63.5184 68.5364 175.7400 22 C 4.2724 8.4887 125.3818 61.3500 40.2920 173.6265 23 G 4.1461 8.3271 101.3880 42.6075 0.0000 173.1431 24 A 4.0926 8.3234 124.6206 53.1525 18.4466 177.5908 25 N 4.1379 8.6237 121.7694 55.5914 35.3944 175.0761 26 T 4.3463 7.7693 110.2586 62.0379 69.3145 174.1631 27 V 4.0407 6.9281 120.1517 60.7740 31.2508 173.8060 28 P 4.4012 0.0000 0.0000 64.5787 32.0178 178.0510 29 Y 5.2027 6.7972 115.7832 56.2867 38.5975 174.4468 30 Q 4.6275 7.5249 123.2422 56.1463 29.9774 175.1411 31 V 4.8636 9.0567 125.4048 61.1576 35.7245 173.7078 32 S 5.1561 8.7908 119.0525 56.4377 65.1278 172.5013 33 L 4.7789 8.5337 127.3165 53.1565 43.5675 175.0402 34 N 5.9398 9.1800 121.9182 49.9276 42.3827 174.6210 *37 S 4.1578 8.3029 119.3568 58.1915 63.9985 174.0478 38 G 4.0002 9.4475 108.4697 46.4469 0.0000 172.3669 39 Y 4.5994 6.4294 115.0239 55.9302 40.2184 172.9396 40 H 4.5671 8.8240 121.6689 56.3044 30.2507 174.7540 41 F 5.0949 7.9806 119.8699 56.7453 39.6356 173.5748 42 C 4.9117 6.7638 115.3386 56.3329 40.1380 172.6308 43 G 4.5099 8.8694 108.0671 45.1737 0.0000 172.1974 44 G 4.6090 8.4523 105.4636 46.1101 0.0000 172.3300 45 S 5.4275 8.9689 115.5463 56.4185 66.8081 173.5798 46 L 4.8023 9.1449 127.3907 54.7479 42.4514 177.1382 47 I 4.4258 8.6693 120.0879 61.1492 38.8372 174.5930 48 N 4.4818 7.7777 117.3850 52.0365 39.2843 175.0231 49 S 4.1159 8.5182 112.7509 61.1147 62.7668 175.8173 50 Q 4.4317 8.1594 116.9009 55.2158 29.8263 174.5709 51 W 5.5251 8.0691 118.1955 54.7784 33.5862 174.4196 52 V 5.1592 9.1381 122.4782 61.0879 34.7263 174.4536 53 V 4.9869 8.7484 125.8347 60.4758 34.3771 174.8319 54 S 5.0423 8.9295 116.7077 57.7156 66.0971 172.1115 55 A 4.8316 8.5376 120.6219 50.9642 20.0806 178.6707 56 A 3.8673 8.2412 124.2777 55.1763 18.5074 179.1281 57 H 4.5531 8.2441 109.3189 57.2581 28.6065 175.2340 58 C 4.8287 7.7721 117.2018 56.9557 40.4836 173.1750 59 Y 4.2728 7.8091 122.6020 57.6194 38.7447 175.2208 60 K 4.0722 7.3076 124.5079 55.0273 36.3113 174.9759 61 S 4.3291 8.0333 115.0361 57.8801 64.2001 173.6895 62 G 3.6030 8.5459 111.9626 46.1854 0.0000 173.2593 63 I 4.5906 7.2743 118.5569 59.6638 40.0498 175.9844 64 Q 4.7597 8.9554 126.9510 54.2436 32.1360 174.0007 65 V 4.6901 8.8699 126.3252 61.3386 34.0551 174.4385 66 R 5.2334 8.8817 126.4842 54.5340 33.1487 174.7594 67 L 4.8857 9.1585 124.1698 52.5288 45.1577 177.0042 *69 G 4.1580 8.2592 106.4424 46.2921 0.0000 172.4845 70 E 4.7164 8.5129 119.0154 55.0480 30.5766 174.1727 71 D 4.8155 8.1790 118.7492 54.1974 44.1258 173.9055 72 N 5.2794 8.4267 115.3855 51.8513 39.8812 176.2810 73 I 3.6680 8.5645 120.1359 62.6714 37.8076 176.3101 74 N 4.7511 9.0120 117.6760 52.9060 39.1952 174.6768 75 V 4.2672 7.4805 118.4407 60.7789 33.9611 174.8594 76 V 4.2329 8.4859 127.2333 62.3640 31.1388 174.7862 77 E 4.5456 9.3056 127.7781 56.1428 29.7509 176.4696 78 G 4.2842 7.9105 110.0980 45.6512 0.0000 174.6161 79 N 4.8093 7.7363 115.9069 53.5301 39.2289 174.2038 80 E 4.8682 7.8090 116.1191 54.9136 32.7463 175.8629 81 Q 4.3128 8.5807 118.8803 54.3576 32.9811 174.2536 82 F 5.5772 8.8544 122.8164 56.0404 41.1203 174.8290 83 I 4.6887 8.8011 124.9729 59.4021 40.7799 175.7175 84 S 4.7161 8.5833 121.0823 58.0525 64.4812 173.1769 85 A 4.6621 8.1630 124.4137 51.8604 18.6867 177.7026 86 S 4.5715 8.9330 116.5443 59.9484 64.6110 174.3086 87 K 4.6699 7.4431 117.0177 55.9323 35.6599 174.8530 88 S 5.2904 8.6509 115.9021 56.9869 66.9933 173.9456 89 I 4.6180 9.0885 123.7923 59.6952 40.2391 174.9632 90 V 4.2900 8.4765 127.2241 61.7848 32.9323 175.3009 91 H 3.6336 8.5193 125.9307 55.2847 30.1768 174.4507 92 P 4.2369 0.0000 0.0000 65.6309 30.8567 176.9959 93 S 4.7181 7.7214 112.4335 58.0280 62.9158 173.2109 94 Y 4.4206 8.0277 123.0421 57.6205 38.9993 174.3277 95 N 4.5924 8.1597 125.9382 51.3838 39.5689 175.0621 96 S 3.8794 7.6605 120.2673 59.6529 63.5924 175.3906 97 N 4.3815 8.4282 119.5034 55.6036 38.5006 176.1343 98 T 3.9909 7.7747 105.2466 60.7482 69.8909 174.7862 99 L 3.7954 7.8524 121.0754 55.6170 39.7289 173.7939 100 N 4.5115 7.6916 117.7445 54.4439 39.8076 174.4947 101 N 4.6251 8.6691 120.3108 54.1231 35.7419 175.8553 102 D 4.6648 7.7681 118.1815 52.7918 39.9268 175.2779 103 I 4.8139 7.0884 120.9004 59.4126 42.3605 172.9554 104 M 5.4372 9.1018 126.0359 54.3262 36.3093 173.1825 105 L 5.4220 9.2259 123.5318 53.0948 45.2777 175.4903 106 I 5.0085 9.1705 123.5479 59.4711 40.6845 174.3243 107 K 3.8344 8.6969 128.5824 54.4993 34.5373 175.1934 108 L 4.5556 8.0097 126.5793 53.7603 42.7889 178.1440 109 K 3.8780 8.9027 122.6405 58.8847 32.5014 177.5874 110 S 4.6496 7.3851 111.9352 56.1306 66.7432 173.3543 111 A 4.4663 8.3328 123.8444 51.7579 18.9353 177.4206 112 A 4.3154 8.6884 123.7024 51.9069 19.6940 177.6160 113 S 4.5424 9.0094 117.6637 57.1381 63.5928 174.3909 114 L 4.4338 8.4915 126.1886 54.2938 42.3895 176.3507 115 N 4.9530 8.9274 120.0614 51.8812 40.0462 174.7040 116 S 4.1578 8.8286 112.7788 61.7925 62.8988 175.5882 117 R 4.2548 8.7045 117.4959 56.3525 30.6610 176.4070 118 V 4.4114 7.8514 117.2820 60.9443 33.3488 173.6662 119 A 5.2373 8.6938 128.4566 50.3272 23.1024 174.6708 120 S 5.1450 8.6699 113.6226 57.1600 65.4944 173.0653 121 I 4.5256 8.1015 120.2952 59.1771 39.8853 175.3377 122 S 4.4646 8.3652 122.8393 57.9752 63.8097 173.7455 123 L 4.4065 8.0792 123.2336 52.9981 42.6826 175.2473 124 P 4.4909 0.0000 0.0000 63.0562 32.1589 176.2143 125 T 4.1300 8.2583 109.0686 62.6534 70.0209 174.6447 *127 S 4.7196 7.5508 114.3125 58.0473 64.0310 173.7023 128 C 4.4736 8.3657 117.5204 56.3479 40.8698 173.3244 129 A 4.5319 7.9114 124.1690 51.1532 19.9785 177.6750 130 S 4.2275 8.1094 116.4241 57.7841 64.1289 173.5492 *132 A 4.2309 8.1926 124.5372 53.4273 19.3407 175.9967 133 G 4.0942 8.8648 109.0878 45.7573 0.0000 174.8660 134 T 4.0019 7.6943 116.3505 63.7596 69.5510 173.7966 135 Q 4.7356 8.5337 124.3660 55.3977 30.1259 175.7023 136 C 5.2616 9.2169 120.0334 55.0136 43.6772 172.3880 137 L 5.1717 9.1203 122.3573 53.4607 44.3923 174.9725 138 I 5.2550 9.0230 127.1472 58.7498 39.9299 174.8898 139 S 5.4547 9.0141 119.8626 54.7682 66.9445 173.1192 140 G 4.0607 7.1407 107.4363 45.0777 0.0000 172.2599 141 W 4.8027 8.3155 117.6245 56.4369 29.6053 177.1909 142 G 4.1363 8.4130 107.8459 44.9921 0.0000 173.4889 143 N 3.9253 8.3229 118.8597 54.0237 39.1056 174.9564 144 T 5.1727 8.1779 112.8146 60.3060 69.4793 173.8959 145 K 4.6348 7.8244 120.9918 54.8516 35.0719 176.2429 146 S 4.2586 8.8064 118.3042 61.2337 63.5542 175.7575 147 S 4.5459 8.9428 120.4219 53.6103 61.4572 173.4156 148 G 4.3074 6.9798 112.8688 44.5304 0.0000 169.3757 149 T 4.7309 7.8718 116.2442 61.6311 71.2669 174.1853 150 S 4.4821 9.6430 121.9178 57.1082 65.7667 172.0563 151 Y 4.7810 8.7300 125.7580 55.5667 39.1589 174.3842 152 P 4.6765 0.0000 0.0000 62.6739 32.7540 175.4245 153 D 4.9798 8.6543 116.8104 54.4704 43.0861 176.5994 154 V 5.6839 7.7080 110.3755 58.2338 34.5321 175.4728 155 L 3.2884 7.9147 125.2361 55.2958 43.1095 176.0070 156 K 4.7866 8.3733 124.2615 54.7310 35.8134 174.4879 157 C 5.2344 8.6967 120.1236 55.1343 44.5368 173.0297 158 L 4.9309 8.4204 122.7862 53.9278 45.4203 174.4842 159 K 5.0610 8.9998 125.8780 55.1895 33.4158 175.8340 160 A 4.8725 9.2374 126.0498 49.6717 23.1888 173.6243 161 P 5.0433 0.0000 0.0000 61.9662 33.9254 175.0585 162 I 4.3085 8.3805 121.9541 61.1912 38.2207 175.7753 163 L 4.8820 8.5606 126.7012 53.1608 43.3582 176.9318 164 S 4.3631 7.9970 115.7016 58.1505 63.8914 175.3249 165 D 4.4362 8.7310 122.0186 57.3674 40.4879 179.0921 166 S 4.1482 8.1218 114.7568 61.7460 62.6340 176.7724 167 S 4.2149 7.8851 118.0186 60.5054 62.6558 175.6910 168 C 4.3700 7.9033 122.6058 59.7148 43.2860 175.6925 169 K 3.9843 8.3626 119.0335 59.3629 31.6704 179.3173 170 S 4.2779 7.9876 114.7945 61.1826 62.7835 176.0828 171 A 4.0202 7.4697 121.6539 53.5991 19.6927 177.2704 172 Y 4.8887 7.5713 114.0923 55.1647 38.2853 172.6410 173 P 4.4083 0.0000 0.0000 64.0195 32.2426 177.2807 174 G 3.9865 9.0196 110.1661 46.1331 0.0000 173.6800 175 Q 4.5342 8.1436 117.3399 55.5189 30.5343 175.6411 176 I 4.4361 7.8624 119.2344 60.0082 38.3487 175.2127 177 T 4.6345 8.1928 115.1831 59.5918 71.1254 174.8616 178 S 4.3617 8.5575 114.4608 60.1568 63.2598 174.2259 179 N 4.9924 8.1642 118.5530 53.3777 38.5188 173.8516 180 M 5.9877 8.0116 116.7017 53.0526 36.4197 174.3554 181 F 5.0820 8.2164 114.0615 56.0657 41.8448 173.5580 182 C 5.8521 9.2654 115.9669 54.8592 40.6399 172.7355 183 A 4.9467 8.7219 121.2847 51.2309 22.3222 175.9396 184A G 3.9302 6.6899 105.9398 44.7178 0.0000 172.4425 184 Y 4.6857 8.3800 118.2021 56.1208 41.4766 176.5990 185 L 4.2188 8.6323 123.9811 57.3600 41.9972 178.9785 186 E 3.7263 8.3705 116.7824 57.9475 29.7102 176.4467 187 G 4.1728 7.3728 102.9043 44.3449 0.0000 170.6536 188A G 4.2950 9.0470 107.6743 44.7839 0.0000 174.0611 188 K 4.9044 7.5501 116.3886 53.8508 35.4386 175.2848 189 D 4.6204 8.0642 123.1934 54.4531 45.8107 175.7692 190 S 4.6958 8.4569 116.1040 58.6570 65.3270 173.2448 191 C 4.8197 8.6392 117.1007 55.8015 47.8164 173.3427 192 Q 4.1459 8.2469 120.9797 57.5852 28.3783 176.1474 193 G 4.5977 9.1891 112.8005 45.9416 0.0000 175.5689 194 D 4.5717 8.4350 120.3431 55.8506 41.7151 177.8278 195 S 4.3459 7.8821 115.5753 60.5809 63.3180 175.5404 196 G 4.1481 8.6754 112.7416 46.2671 0.0000 173.7338 197 G 4.1786 7.7491 106.9425 45.1586 0.0000 171.4666 198 P 5.1836 0.0000 0.0000 62.3738 33.6242 175.6736 199 V 4.6101 8.4451 120.2484 61.5048 34.4471 174.0221 200 V 4.8521 8.9307 128.9322 61.2671 34.2082 173.7476 201 C 5.0850 8.7320 123.9057 55.9666 44.3723 174.4860 202 S 3.6253 9.9333 118.7444 59.6652 60.2291 173.3046 203 G 3.9242 8.4938 104.7784 45.5134 0.0000 174.0008 204 K 4.7034 7.7274 117.9415 52.9808 35.3347 175.4174 *209 L 4.2871 8.2764 122.4457 55.4554 42.3014 175.9446 210 Q 4.5769 8.8550 125.4989 56.3851 31.2317 175.6922 211 G 5.3688 7.9866 104.5814 45.8982 0.0000 171.4407 212 I 5.1542 8.2225 119.5029 58.8793 41.1920 175.4322 213 V 3.8802 9.1043 127.6889 63.9126 31.8471 174.3223 214 S 4.8692 8.4899 120.4929 58.8173 64.3800 173.5306 215 W 4.9656 7.5794 114.1813 56.0747 32.0103 172.0371 216 G 3.9077 8.3484 105.9410 46.3252 0.0000 172.7955 217 S 4.7262 8.6485 114.6212 56.5210 63.0118 172.3530 *219 G 4.4969 8.0372 118.6766 45.6725 0.0000 171.0614 220 C 5.0126 8.4002 116.5092 56.0520 41.6077 173.7429 221A A 3.9258 8.4420 121.4051 53.2565 16.0182 177.3866 221 Q 4.5267 7.4869 121.2787 56.4666 29.7541 175.8212 222 K 4.2623 8.2314 119.9270 57.0070 32.7757 175.9251 223 N 4.2537 9.3450 121.1067 54.0015 36.8794 175.3351 224 K 4.3043 7.3747 117.2431 53.5236 32.2326 173.8863 225 P 4.6291 0.0000 0.0000 62.1123 33.2318 176.5034 226 G 3.8053 8.4655 107.0201 45.5601 0.0000 172.8680 227 V 4.3559 7.6734 120.7243 60.6607 34.2261 174.0624 228 Y 4.9047 8.0795 124.4898 55.9721 41.8096 175.0900 229 T 4.3614 8.5128 119.6816 63.6302 70.0289 174.3638 230 K 5.0059 9.2405 128.1227 55.1467 31.2742 177.0493 231 V 3.9281 8.6705 125.6968 65.9889 31.4016 174.8503 232 C 4.3241 8.3498 112.3633 58.2655 41.4174 174.7931 233 N 4.2987 8.0678 117.1340 54.2617 38.5568 175.0538 234 Y 4.8439 7.9464 117.9501 57.5722 39.1545 177.6498 235 V 3.6868 8.0871 121.9565 66.3844 31.6209 178.1550 236 S 4.1250 8.1176 114.3862 61.2970 62.6448 176.3785 237 W 4.1526 8.2667 130.5999 60.3888 30.4855 177.9244 238 I 3.0720 8.2565 120.0087 64.2785 36.5212 178.5123 239 K 3.7213 8.0684 119.3427 59.4750 31.6124 179.2771 240 Q 3.8418 7.7442 118.7926 59.2791 29.3708 178.0320 241 T 3.7372 7.5229 117.1114 66.4548 67.9163 176.8757 242 I 2.4022 7.1464 114.8545 63.4240 37.0603 178.0745 243 A 4.0125 7.3688 121.3164 54.1247 18.2673 178.6827 244 S 4.5958 7.3648 110.7638 58.5616 63.3636 174.1092 245 N 4.7125 7.8033 124.4551 53.4841 39.2612 174.0673 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 4.24 1.80 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 1.43 0.63 0.91 0.00 0.00 17 V 8.31 4.34 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.93 0.00 0.00 18 G 8.96 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 19 G 7.87 4.12 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 0.00 20 Y 7.98 4.95 0.00 3.00 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 21 T 8.56 4.45 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 22 C 8.49 4.27 0.00 2.66 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 23 G 8.33 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.32 4.09 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 25 N 8.62 4.14 0.00 2.89 2.93 0.00 0.00 7.01 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 T 7.77 4.35 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 27 V 6.93 4.04 1.70 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 0.33 0.00 0.00 0.74 0.00 0.00 28 P 0.00 4.40 0.00 2.36 2.38 0.00 3.58 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 2.18 2.00 0.00 29 Y 6.80 5.20 0.00 3.22 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 30 Q 7.52 4.63 0.00 1.79 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.45 0.00 0.00 0.00 0.00 0.00 1.92 2.45 0.00 31 V 9.06 4.86 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 0.91 0.00 0.00 1.12 0.00 0.00 32 S 8.79 5.16 0.00 3.00 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 33 L 8.53 4.78 0.00 0.35 1.06 0.81 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 34 N 9.18 5.94 0.00 2.43 2.50 0.00 0.00 6.55 6.99 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 *37 S 8.30 4.16 0.00 3.69 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 38 G 9.45 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 0.00 0.00 0.00 39 Y 6.43 4.60 0.00 3.09 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 40 H 8.82 4.57 0.00 2.87 3.19 0.00 5.86 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.98 5.09 0.00 3.10 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 C 6.76 4.91 0.00 2.06 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 43 G 8.87 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 8.45 4.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.97 5.43 0.00 3.82 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 46 L 9.14 4.80 0.00 1.86 1.67 1.09 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.67 4.43 1.90 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 1.55 0.92 1.02 0.00 0.00 48 N 7.78 4.48 0.00 2.93 2.98 0.00 0.00 6.27 8.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.52 4.12 0.00 4.04 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 50 Q 8.16 4.43 0.00 2.15 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.10 6.82 0.00 0.00 0.00 0.00 0.00 2.31 2.37 0.00 51 W 8.07 5.53 0.00 3.14 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 0.00 0.00 0.00 0.00 52 V 9.14 5.16 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 1.15 0.00 0.00 0.98 0.00 0.00 53 V 8.75 4.99 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 0.71 0.00 0.00 1.05 0.00 0.00 54 S 8.93 5.04 0.00 3.89 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 8.54 4.83 1.16 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 56 A 8.24 3.87 0.25 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 57 H 8.24 4.55 0.00 3.37 3.57 0.00 5.55 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 58 C 7.77 4.83 0.00 3.24 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 59 Y 7.81 4.27 0.00 2.96 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 60 K 7.31 4.07 0.00 1.24 1.20 0.00 0.61 0.00 0.00 0.99 0.00 0.00 2.61 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.96 0.88 7.81 61 S 8.03 4.33 0.00 3.71 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 62 G 8.55 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 I 7.27 4.59 1.86 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 1.37 1.07 0.94 0.00 0.00 64 Q 8.96 4.76 0.00 1.98 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.81 0.00 0.00 0.00 0.00 0.00 2.16 2.22 0.00 65 V 8.87 4.69 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 0.96 0.00 0.00 0.91 0.00 0.00 66 R 8.88 5.23 0.00 1.58 1.93 0.00 2.63 0.00 0.00 2.25 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 1.23 0.00 67 L 9.16 4.89 0.00 1.60 1.59 0.95 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 *69 G 8.26 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 8.51 4.72 0.00 2.23 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 2.40 2.16 0.00 71 D 8.18 4.82 0.00 2.77 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 8.43 5.28 0.00 2.88 2.84 0.00 0.00 7.19 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 73 I 8.56 3.67 1.48 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.57 -0.38 0.00 0.00 74 N 9.01 4.75 0.00 2.82 2.88 0.00 0.00 6.59 8.43 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 75 V 7.48 4.27 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 0.74 0.00 0.00 0.95 0.00 0.00 76 V 8.49 4.23 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 1.07 0.00 0.00 77 E 9.31 4.55 0.00 2.02 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.41 0.00 78 G 7.91 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 79 N 7.74 4.81 0.00 2.79 2.81 0.00 0.00 7.01 7.65 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 80 E 7.81 4.87 0.00 1.27 1.57 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 2.40 2.59 0.00 81 Q 8.58 4.31 0.00 1.99 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.74 0.00 0.00 0.00 0.00 0.00 2.21 2.27 0.00 82 F 8.85 5.58 0.00 2.79 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 83 I 8.80 4.69 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 1.23 0.70 0.97 0.00 0.00 84 S 8.58 4.72 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 8.16 4.66 1.18 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 0.00 0.00 86 S 8.93 4.57 0.00 3.75 3.90 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 87 K 7.44 4.67 0.00 1.85 1.90 0.00 1.46 0.00 0.00 1.91 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.27 1.48 7.81 88 S 8.65 5.29 0.00 4.00 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 89 I 9.09 4.62 2.06 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 1.26 0.98 1.13 0.00 0.00 90 V 8.48 4.29 2.02 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 0.63 0.00 0.00 0.75 0.00 0.00 91 H 8.52 3.63 0.00 2.75 3.07 0.00 5.66 0.00 0.00 0.00 0.00 6.68 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 4.24 0.00 2.14 2.18 0.00 2.72 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.90 0.00 93 S 7.72 4.72 0.00 3.95 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 94 Y 8.03 4.42 0.00 2.99 2.88 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 95 N 8.16 4.59 0.00 2.60 2.47 0.00 0.00 6.55 7.62 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 96 S 7.66 3.88 0.00 3.97 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 97 N 8.43 4.38 0.00 2.77 2.78 0.00 0.00 6.81 7.07 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 98 T 7.77 3.99 4.11 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 1.10 0.00 0.00 99 L 7.85 3.80 0.00 1.54 1.94 0.87 1.32 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 0.00 100 N 7.69 4.51 0.00 2.76 2.66 0.00 0.00 7.28 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 N 8.67 4.63 0.00 3.11 2.67 0.00 0.00 7.22 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 7.77 4.66 0.00 3.08 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 0.00 103 I 7.09 4.81 1.49 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 1.40 1.34 0.04 0.00 0.00 104 M 9.10 5.44 0.00 2.27 1.83 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.66 0.00 105 L 9.23 5.42 0.00 1.74 1.82 0.04 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 106 I 9.17 5.01 1.93 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 1.20 0.89 0.90 0.00 0.00 107 K 8.70 3.83 0.00 0.79 1.09 0.00 1.35 0.00 0.00 1.35 0.00 0.00 2.66 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.66 0.21 7.81 108 L 8.01 4.56 0.00 1.55 1.55 0.98 1.06 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 0.00 109 K 8.90 3.88 0.00 1.66 1.83 0.00 1.61 0.00 0.00 1.67 0.00 0.00 2.91 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.56 7.81 110 S 7.39 4.65 0.00 3.82 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 A 8.33 4.47 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 0.00 112 A 8.69 4.32 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 0.00 113 S 9.01 4.54 0.00 3.74 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 0.00 114 L 8.49 4.43 0.00 1.66 1.71 0.96 1.05 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 0.00 115 N 8.93 4.95 0.00 2.87 2.91 0.00 0.00 6.63 8.23 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 0.00 116 S 8.83 4.16 0.00 3.89 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 0.00 117 R 8.70 4.25 0.00 1.86 2.16 0.00 3.10 0.00 0.00 3.27 7.35 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.55 4.72 0.00 4.00 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 0.00 128 C 8.37 4.47 0.00 2.94 2.97 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 0.00 129 A 7.91 4.53 1.11 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 0.00 0.00 130 S 8.11 4.23 0.00 3.96 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 *132 A 8.19 4.23 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 0.00 133 G 8.86 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 7.69 4.00 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 1.15 0.00 0.00 135 Q 8.53 4.74 0.00 1.93 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.80 0.00 0.00 0.00 0.00 0.00 2.31 2.34 0.00 136 C 9.22 5.26 0.00 2.84 2.97 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 0.00 137 L 9.12 5.17 0.00 1.74 1.55 0.99 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.02 5.26 1.87 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 1.46 0.98 0.00 0.00 139 S 9.01 5.45 0.00 3.52 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 0.00 140 G 7.14 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 0.00 141 W 8.32 4.80 0.00 3.18 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 0.00 142 G 8.41 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 0.00 0.00 0.00 143 N 8.32 3.93 0.00 2.20 2.56 0.00 0.00 7.35 7.63 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 0.00 144 T 8.18 5.17 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 1.27 0.00 0.00 145 K 7.82 4.63 0.00 1.79 1.70 0.00 1.75 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.28 1.30 7.81 146 S 8.81 4.26 0.00 3.98 4.10 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 0.00 147 S 8.94 4.55 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 0.00 148 G 6.98 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 T 7.87 4.73 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 150 S 9.64 4.48 0.00 3.76 3.61 0.00 0.00 0.00 0.00 0.00 0.00 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 8.73 4.78 0.00 2.96 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 0.00 152 P 0.00 4.68 0.00 2.25 2.08 0.00 3.98 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.06 0.00 153 D 8.65 4.98 0.00 2.67 3.02 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 0.00 154 V 7.71 5.68 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 0.71 0.00 0.00 0.97 0.00 0.00 155 L 7.91 3.29 0.00 1.68 1.21 0.52 -0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.37 4.79 0.00 1.64 1.49 0.00 1.60 0.00 0.00 1.56 0.00 0.00 2.82 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.45 7.81 157 C 8.70 5.23 0.00 1.28 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 L 8.42 4.93 0.00 1.74 1.46 1.05 1.06 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 0.00 159 K 9.00 5.06 0.00 1.82 1.83 0.00 1.85 0.00 0.00 1.77 0.00 0.00 2.74 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.49 1.65 7.81 160 A 9.24 4.87 1.18 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 0.00 0.00 161 P 0.00 5.04 0.00 2.03 2.09 0.00 3.14 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.78 0.00 162 I 8.38 4.31 1.77 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.63 0.82 0.00 0.00 163 L 8.56 4.88 0.00 1.56 1.59 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.00 4.36 0.00 4.17 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 8.73 4.44 0.00 2.74 2.80 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 0.00 166 S 8.12 4.15 0.00 4.05 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 0.00 167 S 7.89 4.21 0.00 4.03 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 0.00 168 C 7.90 4.37 0.00 3.12 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 0.00 169 K 8.36 3.98 0.00 1.86 1.91 0.00 1.80 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.55 1.62 7.81 170 S 7.99 4.28 0.00 3.84 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 7.47 4.02 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 Y 7.57 4.89 0.00 3.14 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 P 0.00 4.41 0.00 2.08 2.05 0.00 3.85 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 2.05 2.22 0.00 174 G 9.02 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 0.00 0.00 0.00 175 Q 8.14 4.53 0.00 2.49 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.41 6.52 0.00 0.00 0.00 0.00 0.00 2.29 2.59 0.00 176 I 7.86 4.44 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 1.88 1.08 0.99 0.00 0.00 177 T 8.19 4.63 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 178 S 8.56 4.36 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 0.00 179 N 8.16 4.99 0.00 3.07 3.09 0.00 0.00 6.63 8.03 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 0.00 180 M 8.01 5.99 0.00 1.79 1.97 0.00 0.00 0.00 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.45 0.00 181 F 8.22 5.08 0.00 3.08 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 0.00 182 C 9.27 5.85 0.00 2.95 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 0.00 183 A 8.72 4.95 1.16 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 184A G 6.69 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 0.00 184 Y 8.38 4.69 0.00 3.07 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 0.00 185 L 8.63 4.22 0.00 1.74 1.88 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.37 3.73 0.00 2.13 2.26 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 2.46 2.29 0.00 187 G 7.37 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 188A G 9.05 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 K 7.55 4.90 0.00 1.52 1.75 0.00 0.91 0.00 0.00 1.33 0.00 0.00 2.20 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.44 1.25 7.81 189 D 8.06 4.62 0.00 2.89 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 8.46 4.70 0.00 3.99 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 0.00 191 C 8.64 4.82 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 0.00 192 Q 8.25 4.15 0.00 2.44 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.11 5.65 0.00 0.00 0.00 0.00 0.00 2.50 2.52 0.00 193 G 9.19 4.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 D 8.44 4.57 0.00 3.02 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 0.00 195 S 7.88 4.35 0.00 4.07 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 0.00 196 G 8.68 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 G 7.75 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 0.00 0.00 0.00 0.00 198 P 0.00 5.18 0.00 2.27 2.32 0.00 3.77 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 2.26 2.25 0.00 199 V 8.45 4.61 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 0.81 0.00 0.00 0.66 0.00 0.00 200 V 8.93 4.85 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 0.77 0.00 0.00 0.54 0.00 0.00 201 C 8.73 5.08 0.00 2.79 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 0.00 202 S 9.93 3.63 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 0.00 203 G 8.49 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 7.73 4.70 0.00 1.69 1.63 0.00 1.84 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.39 7.81 *209 L 8.28 4.29 0.00 1.51 1.63 1.01 0.74 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 8.85 4.58 0.00 1.94 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.32 0.00 0.00 0.00 0.00 0.00 2.40 2.32 0.00 211 G 7.99 5.37 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 0.00 212 I 8.22 5.15 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 1.30 1.12 0.97 0.00 0.00 213 V 9.10 3.88 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 0.87 0.00 0.00 1.20 0.00 0.00 214 S 8.49 4.87 0.00 3.90 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 0.00 215 W 7.58 4.97 0.00 3.33 2.93 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 0.00 216 G 8.35 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 0.00 217 S 8.65 4.73 0.00 4.27 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 *219 G 8.04 4.50 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 0.00 220 C 8.40 5.01 0.00 2.96 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221A A 8.44 3.93 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 Q 7.49 4.53 0.00 2.08 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 7.12 0.00 0.00 0.00 0.00 0.00 2.60 2.47 0.00 222 K 8.23 4.26 0.00 1.80 1.70 0.00 1.76 0.00 0.00 1.82 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.59 7.81 223 N 9.35 4.25 0.00 2.81 2.80 0.00 0.00 6.74 7.74 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 0.00 224 K 7.37 4.30 0.00 1.75 1.79 0.00 1.65 0.00 0.00 1.27 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.48 7.81 225 P 0.00 4.63 0.00 2.13 2.11 0.00 3.63 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 2.09 1.99 0.00 226 G 8.47 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 0.00 227 V 7.67 4.36 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 0.16 0.00 0.00 -0.61 0.00 0.00 228 Y 8.08 4.90 0.00 1.43 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 0.00 229 T 8.51 4.36 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 230 K 9.24 5.01 0.00 2.09 1.91 0.00 1.82 0.00 0.00 1.80 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.51 1.64 7.81 231 V 8.67 3.93 2.33 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 1.15 0.00 0.00 1.11 0.00 0.00 232 C 8.35 4.32 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 8.07 4.30 0.00 2.40 2.38 0.00 0.00 6.89 7.82 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 0.00 234 Y 7.95 4.84 0.00 3.10 3.21 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 0.00 235 V 8.09 3.69 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 1.11 0.00 0.00 1.11 0.00 0.00 236 S 8.12 4.13 0.00 3.98 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 0.00 237 W 8.27 4.15 0.00 3.49 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 I 8.26 3.07 2.01 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 1.58 0.96 0.75 0.00 0.00 239 K 8.07 3.72 0.00 1.81 1.78 0.00 1.64 0.00 0.00 1.53 0.00 0.00 2.86 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.53 7.81 240 Q 7.74 3.84 0.00 2.08 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.95 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 241 T 7.52 3.74 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 0.81 0.00 0.00 242 I 7.15 2.40 0.58 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 1.26 0.48 -0.41 0.00 0.00 243 A 7.37 4.01 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 7.36 4.60 0.00 3.81 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 0.00 245 N 7.80 4.71 0.00 3.04 2.98 0.00 0.00 6.97 7.44 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 * Residues marked with a * may have inaccurate shift predictions.