NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2441 7.8827 121.4510 61.2345 38.5809 173.7800 17 V 4.2694 8.6860 126.4851 61.9910 32.5169 174.7465 18 G 3.8013 8.6223 114.3287 46.7027 0.0000 173.1991 19 G 4.2135 7.6109 109.4054 44.2391 0.0000 172.4433 20 Y 4.9684 8.0650 117.1131 55.0603 41.7615 175.0683 21 T 4.2674 8.5452 116.7327 64.1125 68.8550 175.7692 22 C 4.1257 8.5784 125.7682 59.6297 36.4960 175.8135 23 G 3.9777 7.9186 103.2686 45.0487 0.0000 172.8080 24 A 4.3115 8.4838 125.7568 53.2492 18.6209 176.6128 25 N 4.2725 8.9114 118.7444 54.4420 36.2333 175.5375 26 T 4.1294 7.7460 108.6942 63.1543 69.8907 174.9919 27 V 4.1022 7.0995 121.8632 60.3870 31.2751 173.7660 28 P 4.4614 0.0000 0.0000 64.4307 32.1730 178.2104 29 Y 5.1038 6.9474 115.8912 56.8921 38.8172 174.7245 30 Q 4.5458 7.3048 123.5107 56.2915 29.5589 175.5193 31 V 4.8370 9.0534 119.2101 59.6854 35.9594 174.1679 32 S 4.7975 8.7853 117.4707 56.6811 64.4284 172.7242 33 L 4.6235 8.5511 127.8552 53.4773 43.1548 175.1180 34 N 5.6441 9.0365 122.6574 49.8753 42.1747 174.8793 *37 S 4.2309 8.4062 120.3329 58.3359 64.1296 174.5504 38 G 3.9487 10.2017 107.5888 46.0252 0.0000 172.5663 39 Y 4.5172 6.5661 114.8319 56.0953 39.9684 172.6667 40 H 4.5263 8.8358 121.9154 56.0914 30.3738 174.7654 41 F 5.0263 7.9371 120.5214 57.0027 39.8194 173.9563 42 C 4.7013 6.8190 114.9693 56.2351 44.8365 173.4235 43 G 4.2306 8.7865 109.1626 45.9119 0.0000 172.3482 44 G 4.6277 7.4125 102.5583 46.6765 0.0000 172.6240 45 S 5.4434 8.4739 115.1782 56.3882 66.9191 173.7556 46 L 4.6931 9.3151 127.7269 54.9828 42.3658 177.0393 47 I 4.4869 8.4936 119.2300 59.7090 38.7750 174.4538 48 N 4.4619 7.4526 117.6155 52.6475 39.4296 175.0268 49 S 4.2891 8.4423 111.7883 60.6207 63.2862 175.0349 50 Q 4.4632 8.2178 119.9175 55.2710 29.9874 173.9933 51 W 5.6216 8.0813 115.4605 55.7182 33.5237 174.1823 52 V 4.9842 9.2491 124.2588 61.1569 34.3556 174.1673 53 V 4.8790 8.8794 126.9487 61.8851 33.7174 174.8334 54 S 5.0666 9.1911 120.3687 57.7051 66.0772 172.1124 55 A 4.6848 8.5446 120.3175 50.8024 20.2963 178.3709 56 A 3.7982 8.4303 124.4419 55.4599 18.3597 179.2939 57 H 4.5254 8.3043 108.9018 57.2784 28.6782 175.3739 58 C 4.6138 7.9280 117.1678 57.4292 40.5476 173.3141 59 Y 4.2012 7.7042 122.0889 57.9760 38.6091 175.4093 60 K 3.9946 7.2196 124.6576 54.4408 36.4453 175.6906 61 S 4.2932 7.9398 114.8678 58.7369 64.0942 174.1336 62 G 3.7893 8.6930 108.0099 45.8418 0.0000 173.1229 63 I 4.2654 7.5689 120.4922 60.4787 38.7250 174.4303 64 Q 4.7588 9.0494 128.6994 54.2508 31.3344 174.2540 65 V 4.3083 8.7483 127.3886 62.1861 33.1898 174.6230 66 R 5.0890 8.9775 127.8080 54.7350 32.0336 175.3970 67 L 4.6723 9.2448 124.8782 52.8149 44.5655 177.6480 *69 G 4.6199 8.2461 107.6862 45.4913 0.0000 172.9934 70 E 4.3619 8.2378 118.3335 55.8570 30.2102 174.4134 71 D 4.8530 8.2115 117.6713 55.3999 43.8571 174.5643 72 N 4.9013 8.9075 120.1641 52.6814 39.0144 175.9977 73 I 3.8675 8.6997 120.0861 62.1440 37.9793 176.2533 74 N 4.7337 8.5614 117.9445 53.1655 39.5619 174.9472 75 V 4.3702 7.2822 116.1659 60.5711 34.2225 174.9842 76 V 4.1139 8.3754 126.0713 62.5997 31.3758 175.2429 77 E 4.3631 9.3741 127.5181 55.5309 31.2454 175.6670 78 G 3.8093 8.8631 104.7946 44.6264 0.0000 173.4907 79 N 4.1846 8.8011 112.4203 53.9411 36.3289 173.6207 80 E 5.0540 7.4378 115.6682 55.4545 31.3029 175.8490 81 Q 4.4373 9.0839 121.6548 54.2001 32.5774 174.1824 82 F 5.5884 8.7473 123.0412 56.1617 40.6114 175.3605 83 I 4.6696 8.8358 124.9906 59.1728 40.8295 175.5148 84 S 4.5500 8.7685 122.6796 58.4258 64.0428 173.5340 85 A 4.3356 8.5308 125.9477 52.5105 18.3365 177.2659 86 S 4.4363 9.1690 117.4081 59.7491 63.5733 174.6556 87 K 4.7383 7.6881 117.5269 54.6157 36.3731 175.6667 88 S 4.9382 8.8114 118.8787 57.2659 66.0103 174.0374 89 I 4.3696 9.4263 128.6130 59.3935 37.7959 175.0788 90 V 4.0521 8.1277 127.0403 62.3376 32.5465 175.0479 91 H 3.9568 8.9341 127.7274 56.1326 29.9899 174.4736 92 P 4.3854 0.0000 0.0000 65.0536 31.4042 177.1781 93 S 4.6943 8.0266 112.3397 58.0243 63.1189 173.2583 94 Y 4.2848 7.9599 122.6782 57.9806 38.8977 175.0106 95 N 4.4647 8.2516 125.7555 51.5513 40.2410 174.8961 96 S 3.9505 7.9370 119.6729 59.2789 63.7553 174.5732 97 N 4.4501 8.7662 119.2540 54.9076 38.9108 176.0892 98 T 3.9407 7.7541 106.0324 60.7876 69.9677 175.0690 99 L 3.7400 8.0176 120.4929 55.3272 39.9902 173.9397 100 N 4.4261 7.6573 117.5146 54.7941 39.3415 174.6436 101 N 4.6248 8.7069 120.4125 54.3709 35.8964 175.2118 102 D 4.7624 8.0054 117.5601 52.9831 39.5404 174.3260 103 I 4.7697 7.1383 120.7563 59.2783 42.3753 172.9463 104 M 5.4459 9.1560 127.6249 54.0652 36.0326 173.5343 105 L 5.3594 9.2819 125.1845 53.3733 44.9302 175.4593 106 I 5.0137 9.1325 122.6571 59.4976 41.0225 174.2637 107 K 3.7344 8.6115 129.1156 54.7334 33.1833 175.9977 108 L 4.2457 8.2767 128.3030 54.3926 41.8175 177.2535 109 K 4.0291 8.7527 124.3215 58.9851 32.5926 177.0879 110 S 4.6247 7.7215 111.2152 55.6296 65.6109 172.8020 111 A 4.3853 8.4429 127.0928 51.8198 18.6085 177.4918 112 A 4.1455 8.8939 124.6963 52.1285 19.6209 177.7576 113 S 4.5383 8.4613 116.0666 57.1381 63.3067 174.2823 114 L 4.5061 8.4358 125.7371 54.3946 41.1392 176.7552 115 N 4.8627 8.7400 119.0354 52.3256 39.5389 174.8455 116 S 4.3908 8.7079 111.4093 61.3809 63.3552 175.1969 117 R 4.1552 7.5039 117.8521 56.9681 30.4856 176.3879 118 V 4.4387 8.3712 116.8241 60.9919 33.1709 173.5598 119 A 5.1267 8.6030 128.5368 50.2248 22.8541 175.2914 120 S 4.9719 8.7585 114.6715 58.0441 64.4089 173.0690 121 I 4.3757 8.5193 121.7738 59.2168 40.0652 175.0251 122 S 4.4279 8.4030 124.5682 58.3602 64.0579 173.8268 123 L 4.4055 8.3504 123.2336 53.1302 42.5881 175.2391 124 P 4.4690 0.0000 0.0000 63.1614 32.3100 176.2699 125 T 4.1309 8.2797 109.2728 62.9425 69.9822 174.9181 *127 S 4.8773 7.5576 113.9139 57.9236 64.0412 174.1423 128 C 4.4083 8.4232 118.6421 56.7144 40.7202 173.5723 129 A 4.2825 8.0736 125.1478 51.7571 19.1761 177.3460 130 S 4.3958 8.0909 114.4778 56.5234 65.3859 172.9851 *132 A 4.2813 8.1831 122.6610 53.4482 19.0790 177.3503 133 G 3.9400 9.1160 111.0726 45.1621 0.0000 174.0007 134 T 3.9570 7.6222 117.9604 63.6510 69.4387 173.2815 135 Q 4.6891 8.6063 127.8297 55.8050 30.1425 175.2444 136 C 5.2919 9.4639 122.8271 55.0655 45.2591 172.3172 137 L 5.1353 9.0418 122.3167 53.6224 43.9826 174.9150 138 I 5.3897 9.0402 127.7768 58.9935 39.5649 175.0043 139 S 4.9020 8.3776 119.5604 56.7211 66.4945 172.8954 140 G 3.8179 7.6179 107.7324 46.1621 0.0000 173.3483 141 W 4.5701 8.8405 117.0697 56.2563 29.3923 176.9012 142 G 4.1607 8.4581 109.1279 44.1354 0.0000 173.5146 143 N 3.7607 8.6442 118.2409 54.4719 38.9044 174.4862 144 T 5.0455 8.1613 113.0640 60.5337 69.5524 174.3128 145 K 4.6224 7.7017 121.3898 54.9053 34.6114 176.4307 146 S 4.2312 8.6603 118.9932 60.5558 63.1476 174.0402 147 S 4.4031 8.0788 113.5866 59.0579 63.2188 171.3495 148 G 3.8334 8.0084 114.7687 43.8840 0.0000 170.3329 149 T 4.6585 8.1825 114.6708 60.3812 70.5197 175.1539 150 S 4.3289 9.2560 123.5866 57.9753 65.3872 172.3710 151 Y 4.8296 8.5421 126.0493 56.0708 38.8471 174.3728 152 P 4.6631 0.0000 0.0000 62.5384 32.9624 175.9643 153 D 4.6190 8.7850 118.6282 56.4381 41.4344 177.0790 154 V 5.6030 7.4048 109.7325 58.4683 34.3683 175.8600 155 L 3.0978 8.6326 125.1216 54.9933 43.1737 175.7439 156 K 4.9093 8.1623 125.0507 54.8714 35.1185 174.6122 157 C 5.2853 8.6601 119.9872 55.1447 43.0433 172.9567 158 L 4.9573 8.4899 122.6778 53.8429 45.6498 174.3746 159 K 5.1608 9.0110 125.5013 55.1156 33.5797 175.7165 160 A 4.8532 9.0801 126.5572 49.5844 22.9942 173.3385 161 P 4.9923 0.0000 0.0000 61.6475 34.1866 175.0360 162 I 4.3367 8.5560 122.8625 61.3353 37.8977 176.3323 163 L 4.6721 8.6663 127.9283 53.8418 42.8345 177.0928 164 S 4.4030 8.4639 114.4809 58.0152 63.9970 175.0509 165 D 4.4060 8.7221 121.6271 57.6394 40.3791 179.4256 166 S 4.1236 7.9788 115.1438 61.9358 63.0226 176.8520 167 S 4.5317 8.0733 118.9883 60.8990 62.4628 176.0743 168 C 4.3503 8.3768 121.6664 59.7459 42.8006 175.8311 169 K 4.0309 8.5325 120.7975 59.3856 31.7363 179.5775 170 S 4.2168 8.5799 114.8920 61.2778 62.6747 176.4754 171 A 3.8757 7.9759 123.7723 53.7926 19.6720 177.3270 172 Y 4.8173 7.8439 113.9111 55.3397 38.4878 173.0655 173 P 4.5846 0.0000 0.0000 63.5107 32.1580 178.0609 174 G 3.9754 9.0046 109.4771 46.0398 0.0000 173.6304 175 Q 4.5244 8.1805 116.8718 55.4294 29.6835 175.1850 176 I 4.5102 7.8412 119.8647 59.7463 38.8848 175.4344 177 T 4.5451 8.2324 116.0041 59.6505 70.8394 175.4230 178 S 4.2852 8.5657 115.1741 60.6356 63.0936 174.5408 179 N 4.9514 8.1980 118.1847 53.2386 38.4962 173.7847 180 M 5.6401 7.8581 116.9725 53.8645 36.1581 174.4731 181 F 5.0807 8.8250 114.6161 56.0939 42.1496 172.3258 182 C 5.4906 9.0377 116.4432 55.7925 40.9386 172.7320 183 A 5.0030 9.3960 123.1096 51.2086 22.3777 174.5740 184A G 3.9574 7.5882 106.6503 44.4626 0.0000 173.3945 184 Y 4.6441 8.4992 119.4785 56.2749 41.3651 176.1627 185 L 4.2203 8.6227 124.6676 56.9958 42.1667 178.5108 186 E 4.1032 8.2086 116.7116 56.9990 29.6202 177.4863 187 G 3.8796 7.7249 105.7887 45.6147 0.0000 173.4966 188A G 3.9731 9.4599 106.7361 44.6774 0.0000 173.2245 188 K 4.7943 7.5460 117.3750 55.0367 35.1205 174.9097 189 D 4.8037 8.8636 124.2651 53.5459 45.4104 174.1590 190 S 4.9453 8.6511 115.1684 58.0602 65.0794 173.3962 191 C 4.7799 9.6451 119.4330 55.1830 45.7747 172.4582 192 Q 4.2923 8.7313 118.5443 58.1396 28.4087 178.2812 193 G 4.2560 9.2611 111.0196 45.7658 0.0000 174.1655 194 D 4.6209 8.7269 119.4823 56.1949 41.5295 176.7587 195 S 4.4604 8.1083 115.2045 60.5009 63.5179 175.1948 196 G 4.2087 8.9623 112.4420 46.4954 0.0000 173.8829 197 G 4.4457 7.8119 107.3318 44.6556 0.0000 171.3163 198 P 5.0254 0.0000 0.0000 62.6884 33.2493 175.9503 199 V 4.3659 8.6866 121.5162 61.3577 33.9508 173.5782 200 V 4.8540 8.8204 128.5555 61.2440 33.8403 173.7846 201 C 5.0613 8.9887 124.9237 55.5827 43.9838 174.6447 202 S 3.7302 9.7017 121.4523 59.7321 60.0425 173.0351 203 G 3.9146 8.2564 102.8870 45.8820 0.0000 173.3774 204 K 4.6929 7.5928 117.7034 53.0222 35.1628 175.5662 *209 L 4.3710 8.2226 122.7503 55.4551 41.9078 175.7455 210 Q 4.4336 8.8257 125.8203 56.7396 30.5679 175.9441 211 G 5.3070 8.1335 104.4366 45.3969 0.0000 171.4195 212 I 5.2371 8.2010 120.3575 58.7785 40.8962 175.1737 213 V 3.4761 8.9932 127.3743 64.1429 31.7457 174.0641 214 S 4.9693 8.5216 121.5723 58.2476 64.4133 174.5494 215 W 5.0237 7.6451 114.0910 55.6358 32.4389 172.6320 216 G 3.6575 8.2869 106.1312 46.5965 0.0000 172.9283 217 S 4.6748 8.4401 115.1609 56.6882 62.2885 172.5932 *219 G 4.4614 7.9814 118.6837 45.5798 0.0000 170.8678 220 C 4.9259 8.1533 116.1008 56.5511 40.9688 174.0728 221A A 3.9201 9.3882 125.4397 53.1499 16.5774 177.1871 221 Q 4.5050 7.3671 117.9711 56.2996 29.5941 176.0755 222 K 4.2127 8.4099 120.1706 58.1842 33.2904 176.3047 223 N 4.2329 9.1524 117.7622 54.1104 36.8873 175.3382 224 K 4.2624 7.4766 117.9726 53.5897 32.2488 173.9465 225 P 4.6267 0.0000 0.0000 61.9721 33.0504 177.0463 226 G 3.6595 8.4481 106.1306 46.0939 0.0000 172.7122 227 V 4.4618 7.6232 121.3283 60.6696 34.1394 174.0669 228 Y 4.9646 8.1736 124.5479 56.0145 41.9485 174.9619 229 T 4.3709 8.7667 120.5421 63.6028 69.9761 174.3653 230 K 5.0670 9.3468 128.4912 55.1888 31.1665 177.0074 231 V 3.9743 8.8967 125.7948 65.7994 31.4371 174.7000 232 C 4.5335 8.4116 112.6873 58.4933 41.3069 175.0783 233 N 4.1620 8.1410 117.3819 54.7716 38.5027 175.5556 234 Y 4.6960 8.1180 117.3201 57.4054 38.8974 177.3721 235 V 3.6892 7.8735 120.5771 66.3290 31.5714 177.8218 236 S 4.1245 8.1138 114.2483 61.2948 62.6759 176.3603 237 W 4.1366 8.2684 130.5337 60.4690 30.5309 177.8040 238 I 3.2789 8.5279 120.1481 64.4479 36.5880 178.6665 239 K 3.8141 8.2086 119.3339 59.3823 31.6210 179.5914 240 Q 3.9180 8.1494 118.0883 58.9688 28.7283 178.6293 241 T 3.7058 7.5179 116.9148 66.5831 68.4058 177.0339 242 I 2.7441 7.2036 121.4778 63.7876 36.6976 178.1946 243 A 4.1104 7.6808 120.6415 53.7052 18.3038 178.5799 244 S 4.6217 7.3331 110.5770 58.2508 63.7591 174.0128 245 N 4.6956 8.0485 125.5606 53.7529 39.1114 173.9936 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 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.60 0.85 0.00 0.00 17 V 8.69 4.27 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 1.02 0.00 0.00 0.94 0.00 0.00 18 G 8.62 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 0.00 0.00 0.00 19 G 7.61 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 Y 8.07 4.97 0.00 2.96 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 21 T 8.55 4.27 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 1.25 0.00 0.00 22 C 8.58 4.13 0.00 2.74 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 7.92 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 24 A 8.48 4.31 1.33 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 0.00 0.00 25 N 8.91 4.27 0.00 2.89 2.91 0.00 0.00 7.13 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 7.75 4.13 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 27 V 7.10 4.10 1.72 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 0.30 0.00 0.00 0.76 0.00 0.00 28 P 0.00 4.46 0.00 2.40 2.31 0.00 3.74 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.00 0.00 29 Y 6.95 5.10 0.00 3.28 3.40 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 30 Q 7.30 4.55 0.00 1.75 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.73 0.00 0.00 0.00 0.00 0.00 1.93 2.53 0.00 31 V 9.05 4.84 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 0.91 0.00 0.00 0.92 0.00 0.00 32 S 8.79 4.80 0.00 2.96 3.29 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 33 L 8.55 4.62 0.00 0.53 0.74 0.74 0.20 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 34 N 9.04 5.64 0.00 2.36 2.41 0.00 0.00 6.78 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 8.41 4.23 0.00 3.81 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 38 G 10.20 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 39 Y 6.57 4.52 0.00 3.04 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 8.84 4.53 0.00 2.85 3.18 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 7.94 5.03 0.00 2.97 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 42 C 6.82 4.70 0.00 2.23 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 43 G 8.79 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 44 G 7.41 4.63 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 0.00 0.00 0.00 45 S 8.47 5.44 0.00 3.85 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 46 L 9.32 4.69 0.00 1.86 1.83 1.09 0.78 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 47 I 8.49 4.49 1.90 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 1.17 1.33 0.96 0.00 0.00 48 N 7.45 4.46 0.00 2.94 3.00 0.00 0.00 5.99 7.64 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 49 S 8.44 4.29 0.00 4.21 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 Q 8.22 4.46 0.00 2.06 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.01 6.91 0.00 0.00 0.00 0.00 0.00 1.91 2.15 0.00 51 W 8.08 5.62 0.00 3.28 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 52 V 9.25 4.98 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 1.05 0.00 0.00 0.99 0.00 0.00 53 V 8.88 4.88 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 1.02 0.00 0.00 54 S 9.19 5.07 0.00 3.86 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.54 4.68 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 56 A 8.43 3.80 0.30 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 57 H 8.30 4.53 0.00 3.38 3.56 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 7.93 4.61 0.00 3.24 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 59 Y 7.70 4.20 0.00 2.96 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 60 K 7.22 3.99 0.00 1.32 1.23 0.00 1.08 0.00 0.00 1.30 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.90 0.61 7.81 61 S 7.94 4.29 0.00 3.92 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 62 G 8.69 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 63 I 7.57 4.27 1.88 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 1.50 0.71 0.90 0.00 0.00 64 Q 9.05 4.76 0.00 1.97 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.92 0.00 0.00 0.00 0.00 0.00 2.10 2.22 0.00 65 V 8.75 4.31 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 8.98 5.09 0.00 1.51 1.74 0.00 2.62 0.00 0.00 2.47 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 1.15 0.00 67 L 9.24 4.67 0.00 1.60 1.63 0.96 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 *69 G 8.25 4.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 E 8.24 4.36 0.00 2.13 1.89 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 2.37 2.02 0.00 71 D 8.21 4.85 0.00 2.78 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 72 N 8.91 4.90 0.00 2.85 2.82 0.00 0.00 7.14 7.97 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 73 I 8.70 3.87 1.42 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.55 -0.52 0.00 0.00 74 N 8.56 4.73 0.00 2.83 2.90 0.00 0.00 6.64 7.76 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 75 V 7.28 4.37 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 0.78 0.00 0.00 0.95 0.00 0.00 76 V 8.38 4.11 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 0.83 0.00 0.00 0.97 0.00 0.00 77 E 9.37 4.36 0.00 1.96 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 2.28 2.44 0.00 78 G 8.86 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 79 N 8.80 4.18 0.00 2.92 2.89 0.00 0.00 6.76 7.66 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 80 E 7.44 5.05 0.00 1.64 1.68 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 2.66 2.38 0.00 81 Q 9.08 4.44 0.00 1.97 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.78 0.00 0.00 0.00 0.00 0.00 2.23 2.29 0.00 82 F 8.75 5.59 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 83 I 8.84 4.67 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 1.25 0.83 0.94 0.00 0.00 84 S 8.77 4.55 0.00 3.76 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 85 A 8.53 4.34 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 86 S 9.17 4.44 0.00 3.73 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 K 7.69 4.74 0.00 1.55 1.64 0.00 1.58 0.00 0.00 1.70 0.00 0.00 2.84 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.43 1.41 7.81 88 S 8.81 4.94 0.00 3.96 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 89 I 9.43 4.37 2.03 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.97 1.04 0.00 0.00 90 V 8.13 4.05 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 0.66 0.00 0.00 0.76 0.00 0.00 91 H 8.93 3.96 0.00 2.89 3.10 0.00 5.65 0.00 0.00 0.00 0.00 6.70 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 4.39 0.00 2.09 2.15 0.00 3.14 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.24 0.00 93 S 8.03 4.69 0.00 3.94 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 94 Y 7.96 4.28 0.00 2.89 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 95 N 8.25 4.46 0.00 2.59 2.42 0.00 0.00 6.57 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 96 S 7.94 3.95 0.00 3.97 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 97 N 8.77 4.45 0.00 2.70 2.78 0.00 0.00 6.86 8.04 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 98 T 7.75 3.94 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 1.09 0.00 0.00 99 L 8.02 3.74 0.00 1.39 1.85 0.73 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.66 4.43 0.00 2.74 2.64 0.00 0.00 7.26 7.10 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 0.00 101 N 8.71 4.62 0.00 2.89 2.56 0.00 0.00 7.23 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 8.01 4.76 0.00 3.06 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 7.14 4.77 1.42 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.16 0.09 0.00 0.00 104 M 9.16 5.45 0.00 2.13 1.82 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.63 0.00 105 L 9.28 5.36 0.00 1.76 1.98 1.02 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 106 I 9.13 5.01 1.92 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.91 0.94 0.00 0.00 107 K 8.61 3.73 0.00 0.79 1.11 0.00 1.32 0.00 0.00 1.33 0.00 0.00 2.62 0.00 0.00 2.60 0.00 0.00 0.00 0.00 0.72 0.21 7.81 108 L 8.28 4.25 0.00 1.43 1.59 0.91 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.75 4.03 0.00 1.90 1.80 0.00 1.59 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.42 1.40 7.81 110 S 7.72 4.62 0.00 3.78 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 0.00 111 A 8.44 4.39 1.23 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 0.00 112 A 8.89 4.15 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 0.00 113 S 8.46 4.54 0.00 3.76 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 L 8.44 4.51 0.00 1.64 1.62 0.96 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.74 4.86 0.00 2.90 2.92 0.00 0.00 6.54 8.09 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 0.00 116 S 8.71 4.39 0.00 4.02 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 0.00 117 R 7.50 4.16 0.00 1.96 2.04 0.00 3.16 0.00 0.00 3.35 7.39 0.00 0.00 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0.00 1.20 0.00 0.00 *127 S 7.56 4.88 0.00 4.00 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 0.00 128 C 8.42 4.41 0.00 2.94 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 0.00 129 A 8.07 4.28 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 S 8.09 4.40 0.00 3.96 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 *132 A 8.18 4.28 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 G 9.12 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 T 7.62 3.96 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 8.61 4.69 0.00 2.06 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 6.80 0.00 0.00 0.00 0.00 0.00 2.34 2.40 0.00 136 C 9.46 5.29 0.00 2.76 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 9.04 5.14 0.00 1.74 1.57 0.95 1.17 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 9.04 5.39 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 0.77 1.80 0.97 0.00 0.00 139 S 8.38 4.90 0.00 3.51 3.56 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 0.00 140 G 7.62 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 0.00 141 W 8.84 4.57 0.00 2.98 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 0.00 142 G 8.46 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 0.00 143 N 8.64 3.76 0.00 2.35 2.67 0.00 0.00 7.12 7.40 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 0.00 144 T 8.16 5.05 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 145 K 7.70 4.62 0.00 1.91 1.70 0.00 1.74 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.27 1.32 7.81 146 S 8.66 4.23 0.00 3.86 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 0.00 147 S 8.08 4.40 0.00 3.77 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 G 8.01 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 0.00 0.00 0.00 149 T 8.18 4.66 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 1.25 0.00 0.00 150 S 9.26 4.33 0.00 3.82 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 0.00 151 Y 8.54 4.83 0.00 3.02 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 0.00 152 P 0.00 4.66 0.00 2.54 2.10 0.00 4.20 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.04 0.00 153 D 8.79 4.62 0.00 2.81 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 7.40 5.60 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 1.08 0.00 0.00 0.97 0.00 0.00 155 L 8.63 3.10 0.00 1.26 1.23 -0.69 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.16 4.91 0.00 1.68 1.50 0.00 1.61 0.00 0.00 1.55 0.00 0.00 2.82 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.47 7.81 157 C 8.66 5.29 0.00 1.31 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 0.00 0.00 0.00 158 L 8.49 4.96 0.00 1.70 1.45 1.01 0.70 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 0.00 159 K 9.01 5.16 0.00 1.82 1.96 0.00 1.83 0.00 0.00 1.78 0.00 0.00 2.81 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.48 1.66 7.81 160 A 9.08 4.85 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 0.00 161 P 0.00 4.99 0.00 2.02 2.09 0.00 3.22 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.76 0.00 162 I 8.56 4.34 1.89 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.62 0.79 0.00 0.00 163 L 8.67 4.67 0.00 1.58 1.62 0.93 0.73 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 0.00 164 S 8.46 4.40 0.00 4.01 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 D 8.72 4.41 0.00 2.73 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 7.98 4.12 0.00 3.87 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 0.00 167 S 8.07 4.53 0.00 3.89 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 0.00 168 C 8.38 4.35 0.00 3.19 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 K 8.53 4.03 0.00 1.86 1.90 0.00 1.76 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.54 1.72 7.81 170 S 8.58 4.22 0.00 4.01 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 7.98 3.88 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 Y 7.84 4.82 0.00 3.18 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 0.00 173 P 0.00 4.58 0.00 2.22 2.11 0.00 3.51 0.00 0.00 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.95 0.00 174 G 9.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 Q 8.18 4.52 0.00 2.47 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.96 6.58 0.00 0.00 0.00 0.00 0.00 2.31 2.59 0.00 176 I 7.84 4.51 1.99 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.01 1.01 0.00 0.00 177 T 8.23 4.55 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 1.24 0.00 0.00 178 S 8.57 4.29 0.00 4.00 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 8.20 4.95 0.00 2.92 3.09 0.00 0.00 6.59 6.96 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 0.00 180 M 7.86 5.64 0.00 1.85 2.11 0.00 0.00 0.00 0.00 0.00 2.22 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 8.82 5.08 0.00 3.08 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 0.00 182 C 9.04 5.49 0.00 2.99 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 0.00 183 A 9.40 5.00 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 7.59 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 0.00 0.00 0.00 184 Y 8.50 4.64 0.00 3.06 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 0.00 185 L 8.62 4.22 0.00 1.74 1.72 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.21 4.10 0.00 1.98 2.03 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 2.36 2.42 0.00 187 G 7.72 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 188A G 9.46 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 0.00 188 K 7.55 4.79 0.00 1.40 1.68 0.00 0.67 0.00 0.00 1.32 0.00 0.00 2.51 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.32 1.15 7.81 189 D 8.86 4.80 0.00 2.83 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 8.65 4.95 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 0.00 191 C 9.65 4.78 0.00 2.90 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 0.00 192 Q 8.73 4.29 0.00 2.29 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.19 0.00 0.00 0.00 0.00 0.00 2.55 2.47 0.00 193 G 9.26 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 D 8.73 4.62 0.00 2.94 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 0.00 195 S 8.11 4.46 0.00 3.97 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 0.00 196 G 8.96 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 G 7.81 4.45 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 P 0.00 5.03 0.00 2.37 2.42 0.00 3.85 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.19 0.00 199 V 8.69 4.37 2.22 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 0.83 0.00 0.00 0.65 0.00 0.00 200 V 8.82 4.85 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 0.72 0.00 0.00 0.70 0.00 0.00 201 C 8.99 5.06 0.00 2.77 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 0.00 202 S 9.70 3.73 0.00 3.93 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 8.26 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 0.00 204 K 7.59 4.69 0.00 1.82 1.65 0.00 1.85 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.40 7.81 *209 L 8.22 4.37 0.00 1.53 1.66 1.06 0.79 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 8.83 4.43 0.00 2.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.45 0.00 0.00 0.00 0.00 0.00 2.45 2.35 0.00 211 G 8.13 5.31 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 0.00 212 I 8.20 5.24 1.93 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 0.91 0.96 0.00 0.00 213 V 8.99 3.48 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 1.16 0.00 0.00 214 S 8.52 4.97 0.00 3.91 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 0.00 215 W 7.65 5.02 0.00 3.33 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 0.00 216 G 8.29 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 0.00 217 S 8.44 4.67 0.00 4.29 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 *219 G 7.98 4.46 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 0.00 0.00 0.00 220 C 8.15 4.93 0.00 2.98 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 221A A 9.39 3.92 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 7.37 4.51 0.00 2.33 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.04 6.94 0.00 0.00 0.00 0.00 0.00 2.40 2.35 0.00 222 K 8.41 4.21 0.00 1.87 1.82 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.40 1.46 7.81 223 N 9.15 4.23 0.00 2.77 2.85 0.00 0.00 6.76 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 0.00 224 K 7.48 4.26 0.00 1.66 1.79 0.00 1.67 0.00 0.00 1.28 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.48 7.81 225 P 0.00 4.63 0.00 2.14 2.11 0.00 3.65 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.99 0.00 226 G 8.45 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 0.00 227 V 7.62 4.46 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 0.40 0.00 0.00 -0.73 0.00 0.00 228 Y 8.17 4.96 0.00 1.43 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 0.00 0.00 0.00 0.00 229 T 8.77 4.37 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 1.19 0.00 0.00 230 K 9.35 5.07 0.00 2.21 1.96 0.00 1.81 0.00 0.00 1.85 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.60 7.81 231 V 8.90 3.97 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 1.06 0.00 0.00 1.08 0.00 0.00 232 C 8.41 4.53 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 8.14 4.16 0.00 2.27 2.41 0.00 0.00 6.83 7.34 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 0.00 234 Y 8.12 4.70 0.00 3.17 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 0.00 235 V 7.87 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 1.17 0.00 0.00 1.10 0.00 0.00 236 S 8.11 4.12 0.00 3.97 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 8.27 4.14 0.00 3.48 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 I 8.53 3.28 2.05 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 1.67 0.93 0.78 0.00 0.00 239 K 8.21 3.81 0.00 1.72 1.76 0.00 1.64 0.00 0.00 1.61 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.57 7.81 240 Q 8.15 3.92 0.00 1.88 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.96 0.00 0.00 0.00 0.00 0.00 2.35 2.50 0.00 241 T 7.52 3.71 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 0.74 0.00 0.00 242 I 7.20 2.74 1.36 0.00 0.00 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 -0.30 -0.30 0.35 0.00 0.00 243 A 7.68 4.11 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 7.33 4.62 0.00 3.95 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 0.00 245 N 8.05 4.70 0.00 3.10 3.07 0.00 0.00 6.76 7.73 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 * Residues marked with a * may have inaccurate shift predictions.