NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2531 7.8827 121.4458 61.2160 38.7034 173.7749 17 V 4.2897 8.7802 126.1691 61.8957 32.5965 174.6094 18 G 3.7504 9.0708 114.7141 46.1693 0.0000 173.5210 19 G 4.1153 7.6795 109.8000 44.5590 0.0000 172.5896 20 Y 4.9537 7.7051 116.6367 55.3385 42.2338 174.7919 21 T 4.2677 8.6097 117.1543 64.1281 68.3736 175.0708 22 C 4.2438 8.5870 125.5435 60.4318 35.4205 175.2741 23 G 4.0666 8.7424 106.5853 44.4591 0.0000 172.7364 24 A 4.1407 8.7222 125.7883 54.1186 18.5215 176.7412 25 N 4.2375 8.8106 119.6261 54.5022 36.2812 175.2973 26 T 4.2390 7.5653 107.5290 62.4189 70.2417 174.9131 27 V 4.1133 7.0296 121.5812 60.0648 31.3369 173.8600 28 P 4.4224 0.0000 0.0000 65.0239 31.7939 178.1578 29 Y 4.9427 6.7387 115.4168 56.8794 38.8688 174.8115 30 Q 4.6394 7.2376 123.3963 56.3588 29.2580 175.5001 31 V 4.9066 8.9574 118.4792 59.6624 36.5182 174.1138 32 S 4.9635 8.7509 116.5588 56.5761 65.1144 172.6848 33 L 4.5031 8.6629 127.8209 53.5219 42.8349 174.9726 34 N 5.8191 9.1493 123.6312 50.0879 41.7131 174.9391 *37 S 4.1632 8.2549 119.7229 58.2549 63.9951 174.3876 38 G 3.9838 9.6877 108.7107 46.0866 0.0000 172.2841 39 Y 4.5239 6.6277 114.9853 56.2622 39.9515 172.5812 40 H 4.6695 8.9672 121.7055 56.2139 30.3542 174.7280 41 F 5.0899 8.0484 120.5484 57.3588 40.0997 174.2227 42 C 4.7844 6.8157 114.6230 55.7992 44.9796 173.6234 43 G 4.1069 8.6274 109.0587 46.0175 0.0000 172.2143 44 G 4.5210 7.7995 105.0294 46.5396 0.0000 172.7201 45 S 5.4822 8.6757 115.3668 56.4525 66.9293 173.6360 46 L 4.7381 9.3043 127.7814 54.7311 42.3660 176.9772 47 I 4.5433 8.5704 119.3241 60.9022 39.4437 174.7041 48 N 5.0075 7.8228 118.5453 52.0702 41.9811 174.6415 49 S 4.2793 8.9551 116.8608 61.1434 63.1037 175.2829 50 Q 4.7796 8.8322 117.9791 55.2122 30.0798 174.8307 51 W 5.5606 8.4247 118.5872 55.9327 33.4002 174.7132 52 V 5.1422 9.1341 117.3784 59.4807 35.2458 174.8502 53 V 4.9470 8.8400 123.4004 60.6022 33.8049 174.9844 54 S 5.1251 8.8407 116.1339 57.7203 66.1656 172.0874 55 A 4.5561 8.5197 121.3238 51.0170 19.7940 178.6036 56 A 3.7798 8.3876 124.8951 55.2677 18.4582 179.0553 57 H 4.5458 8.3569 109.4422 57.3230 28.7411 175.2640 58 C 4.7788 7.8941 117.3102 56.8325 40.4238 173.1761 59 Y 4.2166 7.6486 122.2015 57.9819 38.6956 175.6047 60 K 4.1622 7.2507 124.3126 55.0450 36.2886 175.4550 61 S 4.2294 8.0641 117.1787 58.4705 64.5947 174.2270 62 G 3.6600 8.3183 110.0910 46.3451 0.0000 173.4763 63 I 4.3188 7.0890 119.0925 59.9649 40.0293 176.2739 64 Q 4.7385 8.8161 128.2998 54.3944 30.9636 174.3517 65 V 4.4500 8.7454 127.3292 62.0027 33.6933 174.7342 66 R 5.0257 8.8029 126.2835 54.6467 32.6717 175.1121 67 L 4.7212 9.2385 124.7233 52.6510 44.8382 177.2736 *69 G 3.9950 8.2792 106.9661 45.4001 0.0000 172.4649 70 E 4.5384 8.3079 119.5496 54.8191 30.7633 173.4779 71 D 4.7680 8.1436 121.6160 54.7382 44.0114 174.5645 72 N 4.9207 8.6523 126.1289 51.8952 38.2744 176.0524 73 I 3.6027 8.2206 120.3321 62.7764 37.6391 176.7871 74 N 4.6919 8.3436 117.3249 53.0420 38.9560 174.9431 75 V 4.2659 7.6227 118.1126 60.7066 34.1528 174.7520 76 V 3.7418 8.5883 127.5438 63.4109 31.6805 174.9484 77 E 4.4876 9.3404 126.5878 55.7875 29.5906 178.8005 78 G 4.0163 7.9804 108.7579 46.2818 0.0000 175.0347 79 N 4.4631 7.8387 117.0182 55.2382 39.2856 174.9383 80 E 4.6162 7.8898 115.2802 56.3050 31.2724 176.1101 81 Q 4.5220 9.1150 119.0050 54.1424 32.5494 174.3931 82 F 5.6354 8.7969 122.2938 55.9597 41.2263 175.0642 83 I 4.6937 8.7946 124.4460 59.4188 41.0245 175.4207 84 S 4.7421 8.7180 122.3954 58.2339 64.3115 173.2004 85 A 4.3552 8.6740 126.0711 52.2298 18.2492 177.6959 86 S 4.3279 9.2446 119.3687 60.7519 63.1018 174.4691 87 K 4.7286 7.6518 116.9452 55.6665 35.8211 174.4595 88 S 5.2968 8.8277 118.0445 56.9825 65.5350 173.4865 89 I 4.4989 9.2837 126.2389 59.5543 39.0179 175.1152 90 V 4.2760 8.3625 127.3844 61.9282 32.7573 175.3596 91 H 3.4528 8.4919 126.3183 55.4116 30.0817 174.5411 92 P 4.2618 0.0000 0.0000 65.3090 31.0359 177.0869 93 S 4.6747 7.7413 112.8175 58.0288 63.5857 173.1774 94 Y 4.2775 8.0628 123.2621 57.8774 38.9438 174.6448 95 N 4.4534 8.1830 125.4408 51.2320 40.4215 175.0667 96 S 3.9128 7.8359 120.6184 60.4187 63.4206 175.5042 97 N 4.3692 7.9212 118.1910 55.3582 38.3885 175.5579 98 T 4.1540 7.3017 104.3834 60.1062 70.1688 174.0489 99 L 3.7010 7.9774 121.0395 55.6278 39.9299 173.9593 100 N 4.4925 7.5409 116.6984 54.5802 39.4962 174.5912 101 N 4.9007 8.7060 119.7222 54.0824 36.0613 175.5271 102 D 4.8390 8.0174 117.2512 53.1743 39.5117 174.6013 103 I 4.9199 7.2410 121.0780 59.4580 42.2631 173.0173 104 M 5.4862 9.2605 124.3875 54.1709 35.1440 173.2658 105 L 5.2818 9.3472 120.9684 53.2704 44.8291 175.4179 106 I 4.9516 9.0331 124.0132 59.4256 40.3425 174.3852 107 K 3.6117 8.8106 129.4121 54.8424 33.1903 175.7955 108 L 4.3635 8.3073 127.6954 54.0918 42.4836 178.0197 109 K 4.0261 8.8067 124.3216 59.1178 32.6868 177.3554 110 S 4.6162 7.4290 110.5616 56.1488 66.8917 173.4717 111 A 4.3834 8.4024 125.0307 51.8648 18.8020 177.3811 112 A 4.1426 8.9048 123.9592 52.0178 19.5959 178.4915 113 S 4.4529 7.9518 117.6717 57.1514 62.3453 173.4169 114 L 4.3344 8.2988 124.5604 54.5882 42.5133 176.0924 115 N 4.8557 8.5768 125.1703 52.0859 38.4777 175.3080 116 S 4.3198 8.8612 109.4752 61.3553 63.6696 175.6901 117 R 4.1785 8.5630 118.0125 56.8412 30.4151 176.6168 118 V 4.5504 7.5447 118.0084 61.1586 34.5884 173.2180 119 A 5.0926 8.5060 126.9863 50.9244 22.8929 175.3865 120 S 5.0424 8.6970 114.4687 57.8165 64.8425 173.1091 121 I 4.4194 8.3412 121.8581 59.3242 39.8210 175.5407 122 S 4.4292 8.3796 124.1323 58.2854 64.0695 173.9199 123 L 4.3974 8.3487 123.1310 53.5601 42.3630 175.3373 124 P 4.5189 0.0000 0.0000 62.9832 32.2857 176.2558 125 T 4.1492 8.2269 108.7745 62.5084 69.9775 174.6208 *127 S 4.8085 7.5610 114.6269 58.0137 64.0582 173.8085 128 C 4.4275 8.3798 117.8435 56.4134 40.7261 173.6990 129 A 4.2439 8.0782 126.0377 51.8529 19.1601 177.8138 130 S 4.2214 8.1843 117.4082 57.6786 64.1879 173.2669 *132 A 4.2280 8.1626 123.8018 53.5411 19.1550 177.3357 133 G 3.9657 9.1553 110.4790 45.2687 0.0000 174.2488 134 T 4.0040 7.5341 117.5830 63.5357 69.4619 173.4890 135 Q 4.5714 8.5815 127.7778 55.8815 30.1288 175.3019 136 C 5.2609 9.1885 122.5030 55.1482 46.4789 172.3035 137 L 5.1641 9.0132 122.5535 53.5761 43.9587 174.9964 138 I 5.1782 9.2244 127.4093 58.8714 39.8640 174.8911 139 S 4.9292 8.5912 119.2391 56.4530 66.5862 173.0679 140 G 3.7671 7.3336 108.4730 46.1843 0.0000 172.8431 141 W 4.7449 8.5739 117.1074 56.2870 29.4497 177.0687 142 G 4.1022 8.3258 108.8320 44.1699 0.0000 173.6117 143 N 3.6308 8.5524 118.3064 54.2947 38.8919 174.5455 144 T 5.1593 8.2025 113.3677 60.6306 69.6125 174.4451 145 K 4.6549 7.6474 121.2233 54.7288 34.7730 176.5129 146 S 4.2706 8.6436 118.6734 61.1663 63.1272 175.1646 147 S 4.4256 7.4235 114.5871 57.0726 64.4280 174.3285 148 G 4.5769 9.1525 123.8322 46.2225 0.0000 172.7550 149 T 3.4331 8.8781 125.4366 63.8766 65.7166 171.8512 150 S 4.3381 9.1483 121.8687 57.5440 64.1530 172.5444 151 Y 4.6287 8.5727 126.4569 55.6424 39.1272 174.3028 152 P 4.6457 0.0000 0.0000 62.5220 32.8808 176.3160 153 D 4.5128 8.8856 120.2093 57.4540 41.1440 177.0674 154 V 5.3711 7.4201 109.7531 58.8916 33.8200 175.8053 155 L 3.2697 8.2717 124.9851 55.1440 43.0195 175.9754 156 K 4.8550 8.1415 124.8375 54.9073 35.0592 174.6175 157 C 5.2751 8.3977 119.8143 55.2801 40.9677 172.8556 158 L 4.9115 8.5176 121.5837 54.0248 45.7071 174.1204 159 K 5.1593 8.9464 125.3595 55.1591 33.5410 175.7539 160 A 4.7607 8.9590 126.1430 49.8685 23.1463 173.6169 161 P 5.0112 0.0000 0.0000 61.9641 33.9464 174.9903 162 I 4.4109 8.2426 122.0801 61.1300 38.1513 175.8021 163 L 4.8372 8.7240 127.3691 53.3804 43.2084 177.0626 164 S 4.3405 8.4593 115.2803 58.1683 64.0358 175.1365 165 D 4.4265 8.7700 122.4012 57.5207 40.4883 179.2838 166 S 4.1524 8.0269 114.3994 61.6810 63.1857 176.6607 167 S 4.1910 7.8102 120.4488 60.6800 62.6052 175.8895 168 C 4.3534 8.3635 121.2784 59.7853 43.2399 175.8790 169 K 4.0184 8.5313 119.4247 59.3253 31.4308 179.2440 170 S 4.2854 8.4424 114.5066 61.0231 62.8168 176.4026 171 A 3.9300 7.7342 123.5200 53.6113 19.7646 177.2317 172 Y 4.8279 7.7254 113.7084 54.9740 38.1860 172.7979 173 P 4.4514 0.0000 0.0000 64.2289 32.1441 176.9814 174 G 3.9923 9.0809 110.3058 46.2336 0.0000 173.5389 175 Q 4.5878 8.3773 116.3631 55.2221 30.3779 175.4597 176 I 4.4703 7.8424 119.5742 59.8428 38.6403 175.2146 177 T 4.6155 8.1882 114.9497 59.5478 71.0755 175.0394 178 S 4.3615 8.5482 114.7756 60.1895 63.2779 174.3722 179 N 5.1521 8.1817 118.4285 53.3536 38.5320 173.8015 180 M 5.5840 7.8512 117.1808 53.8793 36.4028 174.5810 181 F 5.1109 8.7184 114.7429 55.8905 41.9699 172.6550 182 C 5.4114 9.0678 117.2717 56.1027 40.8828 172.4810 183 A 5.0260 9.4038 122.7673 50.9647 22.3962 175.4156 184A G 3.8208 7.1427 107.5654 44.7142 0.0000 172.5185 184 Y 4.6154 8.4432 119.5915 55.9323 40.7741 176.7008 185 L 4.1139 8.6158 124.6246 57.3546 41.9915 178.2995 186 E 4.2486 8.2991 115.9353 56.0762 30.2062 177.7738 187 G 3.7585 7.8112 107.7442 45.1421 0.0000 171.1860 188A G 4.2900 9.0224 107.4159 44.8420 0.0000 174.2013 188 K 4.8584 7.1011 116.6970 54.2772 35.5976 175.2780 189 D 4.6151 8.5262 122.5941 53.8758 45.7257 175.2897 190 S 4.8481 8.8445 117.2570 58.3833 65.0475 172.7494 191 C 4.7060 9.5363 118.8812 55.5320 42.7410 172.1921 192 Q 4.2516 8.6546 119.1560 58.0555 28.3112 178.0782 193 G 4.5358 9.2726 110.6522 45.7240 0.0000 173.7857 194 D 4.7180 8.5696 118.9646 55.0504 41.8874 176.7052 195 S 4.4346 8.0494 115.2541 60.4175 63.5097 175.5908 196 G 4.2315 8.9528 112.5663 46.4408 0.0000 173.8002 197 G 4.3446 7.9578 107.3816 45.2797 0.0000 171.3295 198 P 5.0978 0.0000 0.0000 62.4000 33.4447 175.7207 199 V 4.4490 8.5101 120.6960 61.4350 34.2259 173.8665 200 V 4.7118 8.6064 128.6791 61.2346 33.9282 173.6790 201 C 5.1122 8.9457 125.1736 55.4672 43.3917 174.5280 202 S 3.7282 9.8955 120.8707 59.6294 60.0632 173.5197 203 G 3.9527 8.6089 105.9473 45.2705 0.0000 173.9844 204 K 4.6840 7.6491 118.4604 53.1529 34.8954 175.2128 *209 L 4.2501 8.3170 123.4313 55.3717 42.5537 175.8034 210 Q 4.6306 8.9893 125.3842 56.2829 31.6378 175.6324 211 G 5.2859 7.9618 104.6031 45.8814 0.0000 171.5412 212 I 5.3011 8.1878 119.4966 58.9096 41.2895 175.2886 213 V 3.6566 9.0300 127.7230 64.0173 31.7894 174.1735 214 S 4.8791 8.4562 121.0023 58.4615 64.3790 174.1995 215 W 4.9440 7.3965 113.8392 55.8647 31.9633 172.3665 216 G 3.9002 8.3981 105.7850 46.2731 0.0000 173.4246 217 S 4.6458 8.5784 116.0845 56.7714 62.4322 172.8545 *219 G 4.2512 8.0170 118.4966 45.7005 0.0000 170.9846 220 C 4.7765 8.2153 116.0712 56.5242 45.5184 173.8615 221A A 3.7062 9.0188 126.6521 53.2772 16.7540 176.6847 221 Q 4.6908 7.2388 115.0573 55.4768 30.3417 175.8492 222 K 4.2011 8.4957 122.4186 57.9653 32.5379 175.8582 223 N 4.1942 9.3182 123.7803 54.5048 38.3277 174.7379 224 K 4.2597 7.6706 111.5084 53.6832 32.6781 173.6039 225 P 4.6225 0.0000 0.0000 62.1604 33.2483 178.0097 226 G 3.5924 8.4500 106.1418 46.0995 0.0000 172.7313 227 V 4.4210 7.6802 122.6544 60.7260 33.8210 174.1394 228 Y 4.8832 8.2881 124.5756 55.9345 42.1053 175.0459 229 T 4.3177 8.4127 119.7421 63.6180 70.0103 174.2538 230 K 4.8093 9.3028 128.1519 55.5100 31.6482 177.2781 231 V 3.9519 8.7777 126.9710 65.9030 31.3582 174.9461 232 C 4.3764 8.3454 112.5209 57.9409 41.5506 174.6134 233 N 4.3261 8.0452 117.2985 54.1322 38.6266 174.8935 234 Y 4.8502 8.0436 117.5471 57.2857 39.6268 177.4033 235 V 3.6803 8.1322 121.3958 66.3831 31.4412 178.0415 236 S 4.1406 8.1017 114.2151 61.3133 62.6936 176.2915 237 W 4.2140 8.3055 130.5555 60.4488 30.5477 177.8098 238 I 3.0379 8.2829 120.0847 64.1605 36.5095 178.5021 239 K 3.7199 7.9203 119.0565 59.4383 31.6823 179.1493 240 Q 3.8288 7.7463 118.3086 59.5465 29.0466 178.1467 241 T 3.7324 7.5319 116.7538 66.5289 67.9182 176.7442 242 I 2.6065 7.1664 121.3857 63.7900 36.8585 177.9338 243 A 4.2521 7.8235 119.4332 53.3428 18.1819 177.8449 244 S 4.7092 7.4191 110.2894 57.4601 63.9576 174.0591 245 N 4.6622 8.0585 123.6279 54.1255 39.4688 174.1370 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 4.25 1.79 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.51 0.86 0.00 0.00 17 V 8.78 4.29 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 0.98 0.00 0.00 0.92 0.00 0.00 18 G 9.07 3.75 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 0.00 0.00 0.00 19 G 7.68 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 7.71 4.95 0.00 2.97 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 T 8.61 4.27 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 1.26 0.00 0.00 22 C 8.59 4.24 0.00 2.75 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 G 8.74 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 A 8.72 4.14 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 N 8.81 4.24 0.00 2.87 2.90 0.00 0.00 7.10 7.54 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 26 T 7.57 4.24 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 1.30 0.00 0.00 27 V 7.03 4.11 1.74 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 0.30 0.00 0.00 0.76 0.00 0.00 28 P 0.00 4.42 0.00 2.37 2.41 0.00 3.65 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.00 0.00 29 Y 6.74 4.94 0.00 3.27 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 Q 7.24 4.64 0.00 1.82 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.74 0.00 0.00 0.00 0.00 0.00 1.88 2.47 0.00 31 V 8.96 4.91 2.23 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 0.89 0.00 0.00 1.03 0.00 0.00 32 S 8.75 4.96 0.00 3.27 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 33 L 8.66 4.50 0.00 0.69 1.01 0.77 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 34 N 9.15 5.82 0.00 2.46 2.52 0.00 0.00 6.77 7.18 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 *37 S 8.25 4.16 0.00 3.68 3.66 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 38 G 9.69 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 39 Y 6.63 4.52 0.00 3.10 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 40 H 8.97 4.67 0.00 2.91 3.22 0.00 5.86 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 41 F 8.05 5.09 0.00 3.12 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 42 C 6.82 4.78 0.00 2.12 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 43 G 8.63 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 0.00 0.00 0.00 0.00 44 G 7.80 4.52 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 45 S 8.68 5.48 0.00 3.80 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 46 L 9.30 4.74 0.00 1.86 1.68 1.07 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.57 4.54 1.89 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 1.37 0.93 0.94 0.00 0.00 48 N 7.82 5.01 0.00 2.79 2.92 0.00 0.00 6.93 7.16 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 49 S 8.96 4.28 0.00 4.07 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 50 Q 8.83 4.78 0.00 1.87 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.81 0.00 0.00 0.00 0.00 0.00 2.26 2.16 0.00 51 W 8.42 5.56 0.00 3.28 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 V 9.13 5.14 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 0.82 0.00 0.00 0.98 0.00 0.00 53 V 8.84 4.95 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 1.09 0.00 0.00 54 S 8.84 5.13 0.00 3.89 3.75 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 55 A 8.52 4.56 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 8.39 3.78 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.36 4.55 0.00 3.37 3.58 0.00 5.55 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.89 4.78 0.00 3.14 3.24 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 59 Y 7.65 4.22 0.00 3.00 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 7.25 4.16 0.00 1.47 1.27 0.00 0.61 0.00 0.00 0.96 0.00 0.00 2.55 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.00 1.09 7.81 61 S 8.06 4.23 0.00 3.75 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 G 8.32 3.66 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 0.00 0.00 0.00 63 I 7.09 4.32 1.84 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 1.32 0.65 0.92 0.00 0.00 64 Q 8.82 4.74 0.00 2.02 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.90 0.00 0.00 0.00 0.00 0.00 2.15 2.24 0.00 65 V 8.75 4.45 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 0.97 0.00 0.00 0.89 0.00 0.00 66 R 8.80 5.03 0.00 1.53 1.76 0.00 2.65 0.00 0.00 2.33 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 1.19 0.00 67 L 9.24 4.72 0.00 1.57 1.68 0.98 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 *69 G 8.28 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 70 E 8.31 4.54 0.00 1.98 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 0.00 1.77 2.20 0.00 71 D 8.14 4.77 0.00 2.82 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 N 8.65 4.92 0.00 2.83 2.89 0.00 0.00 7.13 8.13 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 73 I 8.22 3.60 1.42 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 1.04 0.51 -0.59 0.00 0.00 74 N 8.34 4.69 0.00 2.86 2.89 0.00 0.00 6.63 7.24 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 75 V 7.62 4.27 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 0.78 0.00 0.00 0.99 0.00 0.00 76 V 8.59 3.74 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 0.87 0.00 0.00 1.02 0.00 0.00 77 E 9.34 4.49 0.00 2.10 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 2.26 2.49 0.00 78 G 7.98 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 0.00 0.00 0.00 79 N 7.84 4.46 0.00 2.71 2.86 0.00 0.00 7.20 7.61 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 80 E 7.89 4.62 0.00 2.35 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 2.05 2.67 0.00 81 Q 9.12 4.52 0.00 2.02 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.79 0.00 0.00 0.00 0.00 0.00 2.23 2.30 0.00 82 F 8.80 5.64 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 83 I 8.79 4.69 1.87 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 1.25 0.83 0.96 0.00 0.00 84 S 8.72 4.74 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 8.67 4.36 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 9.24 4.33 0.00 3.73 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 87 K 7.65 4.73 0.00 1.86 1.83 0.00 1.49 0.00 0.00 1.86 0.00 0.00 2.91 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.25 1.50 7.81 88 S 8.83 5.30 0.00 4.13 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 89 I 9.28 4.50 2.07 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.02 1.16 0.00 0.00 90 V 8.36 4.28 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 0.59 0.00 0.00 0.73 0.00 0.00 91 H 8.49 3.45 0.00 2.66 2.93 0.00 5.65 0.00 0.00 0.00 0.00 6.67 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 4.26 0.00 2.12 2.15 0.00 2.67 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 1.48 1.84 0.00 93 S 7.74 4.67 0.00 3.95 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 94 Y 8.06 4.28 0.00 3.01 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 95 N 8.18 4.45 0.00 2.59 2.42 0.00 0.00 6.61 7.28 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 96 S 7.84 3.91 0.00 3.96 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 97 N 7.92 4.37 0.00 2.75 2.80 0.00 0.00 6.70 7.54 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 98 T 7.30 4.15 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 7.98 3.70 0.00 1.47 1.83 0.70 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.54 4.49 0.00 2.81 2.63 0.00 0.00 7.24 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 N 8.71 4.90 0.00 2.97 2.74 0.00 0.00 7.24 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 0.00 102 D 8.02 4.84 0.00 3.10 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 7.24 4.92 1.49 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 1.56 1.14 0.16 0.00 0.00 104 M 9.26 5.49 0.00 2.07 2.27 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.58 0.00 105 L 9.35 5.28 0.00 1.68 1.90 0.00 0.61 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 0.00 106 I 9.03 4.95 1.91 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 1.18 0.83 0.88 0.00 0.00 107 K 8.81 3.61 0.00 0.79 1.12 0.00 1.33 0.00 0.00 1.36 0.00 0.00 2.65 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.77 0.21 7.81 108 L 8.31 4.36 0.00 1.49 1.56 0.95 0.66 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 0.00 109 K 8.81 4.03 0.00 1.83 1.80 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.42 1.38 7.81 110 S 7.43 4.62 0.00 3.87 3.66 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 0.00 111 A 8.40 4.38 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 0.00 112 A 8.90 4.14 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 7.95 4.45 0.00 3.95 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 L 8.30 4.33 0.00 1.66 1.65 0.96 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.58 4.86 0.00 2.76 2.66 0.00 0.00 7.09 6.97 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 0.00 116 S 8.86 4.32 0.00 4.01 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 R 8.56 4.18 0.00 1.92 2.03 0.00 3.17 0.00 0.00 3.34 7.29 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.56 4.81 0.00 4.00 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 0.00 128 C 8.38 4.43 0.00 2.94 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 A 8.08 4.24 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 S 8.18 4.22 0.00 3.84 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 8.16 4.23 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 G 9.16 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 0.00 0.00 0.00 134 T 7.53 4.00 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 1.14 0.00 0.00 135 Q 8.58 4.57 0.00 2.03 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.46 0.00 136 C 9.19 5.26 0.00 2.80 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 0.00 137 L 9.01 5.16 0.00 1.74 1.56 1.04 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.22 5.18 1.87 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 1.10 0.96 0.00 0.00 139 S 8.59 4.93 0.00 3.55 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 G 7.33 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 0.00 0.00 0.00 141 W 8.57 4.74 0.00 3.17 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 G 8.33 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 0.00 0.00 0.00 143 N 8.55 3.63 0.00 2.10 2.57 0.00 0.00 7.13 7.60 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 0.00 144 T 8.20 5.16 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 1.26 0.00 0.00 145 K 7.65 4.65 0.00 1.68 1.84 0.00 1.79 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.31 1.37 7.81 146 S 8.64 4.27 0.00 3.86 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 0.00 147 S 7.42 4.43 0.00 3.93 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 G 9.15 4.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 T 8.88 3.43 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 1.41 0.00 0.00 150 S 9.15 4.34 0.00 3.79 3.64 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 0.00 151 Y 8.57 4.63 0.00 3.05 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 0.00 152 P 0.00 4.65 0.00 2.47 2.09 0.00 4.11 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.03 0.00 153 D 8.89 4.51 0.00 2.80 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 V 7.42 5.37 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 1.17 0.00 0.00 0.97 0.00 0.00 155 L 8.27 3.27 0.00 1.36 1.29 -0.70 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.14 4.86 0.00 1.56 1.50 0.00 1.56 0.00 0.00 1.75 0.00 0.00 2.80 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.26 1.46 7.81 157 C 8.40 5.28 0.00 1.56 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 0.00 0.00 0.00 0.00 158 L 8.52 4.91 0.00 1.71 1.45 1.02 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 159 K 8.95 5.16 0.00 1.81 1.82 0.00 1.84 0.00 0.00 1.76 0.00 0.00 2.75 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.49 1.64 7.81 160 A 8.96 4.76 1.17 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 0.00 161 P 0.00 5.01 0.00 2.02 2.24 0.00 3.19 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.75 0.00 162 I 8.24 4.41 1.86 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 1.00 0.77 0.70 0.00 0.00 163 L 8.72 4.84 0.00 1.56 1.60 0.94 1.02 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 8.46 4.34 0.00 4.00 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 8.77 4.43 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 8.03 4.15 0.00 4.06 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 S 7.81 4.19 0.00 4.01 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 C 8.36 4.35 0.00 3.19 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 K 8.53 4.02 0.00 1.81 1.91 0.00 1.79 0.00 0.00 1.80 0.00 0.00 3.12 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.55 1.67 7.81 170 S 8.44 4.29 0.00 4.04 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 0.00 171 A 7.73 3.93 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 0.00 172 Y 7.73 4.83 0.00 3.10 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 0.00 173 P 0.00 4.45 0.00 2.09 2.08 0.00 3.86 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.24 0.00 174 G 9.08 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 8.38 4.59 0.00 2.48 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.45 6.56 0.00 0.00 0.00 0.00 0.00 2.31 2.62 0.00 176 I 7.84 4.47 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 1.83 1.07 1.00 0.00 0.00 177 T 8.19 4.62 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 1.25 0.00 0.00 178 S 8.55 4.36 0.00 4.01 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 179 N 8.18 5.15 0.00 3.08 3.10 0.00 0.00 6.62 7.37 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 0.00 180 M 7.85 5.58 0.00 1.79 1.99 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.60 0.00 181 F 8.72 5.11 0.00 3.08 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 0.00 182 C 9.07 5.41 0.00 3.00 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 0.00 183 A 9.40 5.03 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 184A G 7.14 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 0.00 184 Y 8.44 4.62 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 0.00 185 L 8.62 4.11 0.00 1.73 1.73 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.30 4.25 0.00 2.00 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 2.33 2.27 0.00 187 G 7.81 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 0.00 0.00 0.00 188A G 9.02 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 7.10 4.86 0.00 1.46 1.67 0.00 0.79 0.00 0.00 1.38 0.00 0.00 2.38 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.19 1.12 7.81 189 D 8.53 4.62 0.00 2.85 2.54 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 0.00 190 S 8.84 4.85 0.00 4.00 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 0.00 191 C 9.54 4.71 0.00 2.90 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 0.00 192 Q 8.65 4.25 0.00 2.29 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.51 0.00 0.00 0.00 0.00 0.00 2.56 2.55 0.00 193 G 9.27 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 0.00 0.00 0.00 0.00 194 D 8.57 4.72 0.00 2.91 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 S 8.05 4.43 0.00 3.99 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 0.00 196 G 8.95 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 0.00 197 G 7.96 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 P 0.00 5.10 0.00 2.29 2.34 0.00 3.70 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.24 0.00 199 V 8.51 4.45 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 0.92 0.00 0.00 0.55 0.00 0.00 200 V 8.61 4.71 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 0.79 0.00 0.00 0.62 0.00 0.00 201 C 8.95 5.11 0.00 2.77 2.87 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 0.00 202 S 9.90 3.73 0.00 3.96 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 0.00 203 G 8.61 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 0.00 204 K 7.65 4.68 0.00 1.72 1.63 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.87 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.30 1.40 7.81 *209 L 8.32 4.25 0.00 1.48 1.61 0.98 0.73 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 0.00 210 Q 8.99 4.63 0.00 1.95 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.37 0.00 0.00 0.00 0.00 0.00 2.41 2.33 0.00 211 G 7.96 5.29 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 0.00 212 I 8.19 5.30 1.92 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.74 0.95 0.00 0.00 213 V 9.03 3.66 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 1.22 0.00 0.00 214 S 8.46 4.88 0.00 3.91 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 W 7.40 4.94 0.00 3.39 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 G 8.40 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 0.00 0.00 0.00 217 S 8.58 4.65 0.00 4.32 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 *219 G 8.02 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 0.00 220 C 8.22 4.78 0.00 2.95 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221A A 9.02 3.71 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 0.00 221 Q 7.24 4.69 0.00 2.08 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.92 0.00 0.00 0.00 0.00 0.00 2.48 2.46 0.00 222 K 8.50 4.20 0.00 1.72 1.72 0.00 1.93 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.61 7.81 223 N 9.32 4.19 0.00 2.77 2.76 0.00 0.00 7.00 6.98 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 0.00 224 K 7.67 4.26 0.00 1.88 1.85 0.00 1.80 0.00 0.00 1.22 0.00 0.00 3.01 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.49 7.81 225 P 0.00 4.62 0.00 2.14 2.11 0.00 3.56 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.99 0.00 226 G 8.45 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 V 7.68 4.42 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 0.54 0.00 0.00 -0.80 0.00 0.00 228 Y 8.29 4.88 0.00 1.49 2.46 0.00 0.00 0.00 0.00 0.00 0.00 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 8.41 4.32 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 1.21 0.00 0.00 230 K 9.30 4.81 0.00 2.16 1.95 0.00 1.93 0.00 0.00 1.62 0.00 0.00 3.01 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.57 1.65 7.81 231 V 8.78 3.95 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 1.20 0.00 0.00 1.08 0.00 0.00 232 C 8.35 4.38 0.00 3.17 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 8.05 4.33 0.00 2.43 2.34 0.00 0.00 6.76 7.50 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 0.00 234 Y 8.04 4.85 0.00 3.22 3.30 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 0.00 235 V 8.13 3.68 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 1.09 0.00 0.00 236 S 8.10 4.14 0.00 3.98 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 237 W 8.31 4.21 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 0.00 238 I 8.28 3.04 1.98 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.94 0.72 0.00 0.00 239 K 7.92 3.72 0.00 1.72 1.76 0.00 1.64 0.00 0.00 1.53 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.37 1.54 7.81 240 Q 7.75 3.83 0.00 2.06 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.95 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 241 T 7.53 3.73 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 242 I 7.17 2.61 1.52 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 0.16 0.51 0.00 0.00 243 A 7.82 4.25 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 0.00 244 S 7.42 4.71 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 0.00 245 N 8.06 4.66 0.00 3.07 3.03 0.00 0.00 6.71 7.23 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 * Residues marked with a * may have inaccurate shift predictions.