NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9581 8.3393 109.7425 45.9270 0.0000 173.2604 2 S 4.4566 8.3818 112.9911 57.1271 63.2662 172.8453 3 A 4.1389 7.9514 123.5541 52.1458 19.6830 178.9679 4 M 3.8722 8.5985 119.6617 56.2122 32.6299 176.0860 5 A 4.4753 8.2795 127.0806 51.7161 19.8232 176.8893 6 L 4.1983 8.7784 121.5375 54.3317 43.4621 176.7173 7 K 4.4579 9.1740 123.6264 55.6606 33.1045 176.3358 8 V 4.0750 8.3685 127.9224 60.7966 32.6245 175.2020 9 G 3.9426 8.6245 117.0029 45.9276 0.0000 171.5466 10 V 4.9233 8.5093 123.5368 60.7261 34.7857 174.6816 11 V 5.0402 8.0343 125.5976 60.6713 35.1472 174.2223 12 G 4.5541 8.1402 108.2757 43.5921 0.0000 171.6009 13 N 5.0432 8.1093 116.2269 50.1288 42.6902 172.5336 14 P 3.4942 0.0000 0.0000 61.9460 31.8601 175.5978 15 P 3.7630 0.0000 0.0000 62.9663 32.0461 178.0242 16 F 3.8192 7.6882 119.2915 59.9727 39.2643 175.4617 17 V 4.7445 7.2115 119.0583 61.1462 34.6028 174.6426 18 F 4.5892 9.0046 125.7587 55.6949 42.6801 173.7509 19 Y 4.3321 8.4197 119.4911 57.8321 39.7058 175.8383 20 G 3.2973 9.1029 117.3726 47.5810 0.0000 173.7110 *26 A 4.2555 8.8875 121.8078 50.9624 21.7178 178.4861 27 F 5.2748 7.8369 111.3444 56.1913 42.8832 173.8251 28 T 4.5283 8.9695 112.4519 59.9337 73.0918 172.1270 29 G 3.1403 8.6887 106.7174 43.6534 0.0000 174.8985 30 I 3.6378 7.5703 119.8956 64.7737 36.4503 179.0092 31 S 4.4198 8.2243 115.5026 61.8005 62.5999 176.8793 32 L 4.1583 7.7927 121.1155 57.6421 41.3979 179.0977 33 D 4.0541 8.0771 119.2269 56.9428 40.6131 178.9159 34 V 3.8314 7.8677 118.7494 65.8721 31.6430 177.8438 35 W 4.3744 8.5073 128.1043 60.7454 30.5630 178.0788 36 R 3.8146 8.3886 117.9200 59.1205 29.4591 178.9048 37 A 4.2942 7.9827 121.9711 54.4720 18.0802 179.9015 38 V 3.2504 7.5875 116.3463 66.0006 31.5755 178.0807 39 A 3.7476 7.3482 120.7652 55.1222 17.7175 179.4144 40 E 3.8442 8.3799 117.6797 59.5294 29.3169 179.7977 41 S 4.0715 7.7510 113.0528 60.4994 63.0213 175.4765 42 Q 4.0948 6.8380 119.9965 54.5563 29.1069 175.8627 43 K 3.8574 7.4409 120.3633 55.2854 29.7235 180.5387 44 W 5.0512 8.1712 119.2015 57.0264 30.5556 176.2265 45 N 5.1170 8.7965 119.3261 52.0646 40.4472 174.1973 46 S 5.0794 8.6149 117.3121 56.6769 67.1136 173.5023 47 E 4.3329 8.4645 122.5394 54.6710 32.1071 173.8669 48 Y 4.7851 8.3829 125.1006 57.2389 39.4141 175.5372 49 V 4.3899 8.6497 123.6492 60.7100 34.5188 174.6149 50 R 4.5513 9.1301 129.1533 56.9263 30.7585 175.5256 51 Q 4.6060 9.1753 125.2683 54.1792 30.8859 176.5264 52 N 4.3546 8.8308 121.3074 56.4898 39.5242 175.1933 53 S 4.6369 7.4536 110.7958 56.0541 67.0441 175.2153 54 I 3.7057 8.3267 122.6641 64.6211 36.8590 178.9308 55 S 4.0912 8.6358 114.9017 61.1838 62.8744 176.4098 56 A 4.0540 7.9684 124.2512 54.9871 18.0504 179.8844 57 G 3.5305 8.2161 104.3046 48.6700 0.0000 176.1064 58 I 3.6762 8.0192 122.3827 64.4945 37.0507 178.6823 59 T 3.8518 7.9741 116.4748 66.4741 68.1864 176.6769 60 A 4.2230 7.8052 123.8365 54.2072 18.3051 179.8907 61 V 3.7217 7.7034 118.0082 65.3271 31.4442 178.1280 62 A 4.0568 8.0049 121.9731 55.4338 18.2873 179.1461 63 E 4.3333 8.1416 114.1218 57.6646 29.9953 179.9258 64 G 4.0981 7.6856 106.3391 47.0012 0.0000 175.0660 65 E 4.1006 8.2785 120.9100 58.0019 29.6788 176.7920 66 L 4.7796 7.3815 117.2202 52.9130 45.5047 176.5437 67 D 4.5380 8.6073 121.1476 56.3954 41.7933 176.7140 68 I 4.4351 7.0796 116.0172 59.6511 41.6555 172.7793 69 L 4.9084 8.7044 130.5385 53.1674 44.1616 175.1881 70 I 4.0565 9.6364 120.0557 58.7419 40.7791 175.7791 71 G 4.7988 8.8014 109.1497 43.7103 0.0000 172.1697 72 P 3.4481 0.0000 0.0000 61.2685 29.5887 175.6412 73 I 4.1705 7.1485 121.9803 60.6397 38.8185 176.5882 74 S 4.7459 8.6174 124.3006 58.6273 63.5513 174.5887 75 V 3.1341 8.3629 125.7400 61.9479 31.2207 175.2189 76 T 4.6560 7.8767 117.6906 58.5879 72.0440 173.2908 77 P 4.2528 0.0000 0.0000 66.6113 31.0859 179.4726 78 E 4.0178 8.0105 115.3283 61.2129 30.0540 180.7531 79 R 4.3815 8.0051 118.3405 59.0046 30.0465 178.9336 80 A 4.3823 8.3604 119.5687 54.6883 18.4347 178.9527 81 A 4.2169 7.7121 117.8459 52.9625 19.2060 178.0105 82 I 3.6656 7.3494 122.1956 61.7483 37.6038 176.2766 83 E 4.0452 8.5973 121.9355 57.3582 30.1927 174.2399 84 G 4.0363 9.2381 111.3822 44.2549 0.0000 172.4327 85 I 5.0522 6.9067 110.5161 59.4216 40.9337 174.7975 86 T 4.7448 8.5057 116.0699 60.8148 70.9372 172.7207 87 F 5.1275 8.9368 126.3489 56.8623 40.6832 175.6989 88 T 4.5693 8.7088 112.8102 60.9155 70.3559 174.1585 89 Q 4.3241 9.1530 121.0606 55.2397 29.2481 175.5095 90 P 4.6497 0.0000 0.0000 63.0926 31.9189 175.8846 91 Y 4.8692 8.4847 118.6997 56.9368 39.5309 175.2646 92 F 4.6221 7.4040 121.5297 57.0293 43.2241 172.5172 93 S 4.5470 7.2911 119.8332 56.6744 63.5341 172.8521 94 S 4.7459 8.5000 122.6234 56.4154 65.4281 172.7686 95 G 4.4111 8.4543 109.6283 44.4278 0.0000 171.8344 96 I 4.6407 8.3584 122.8928 59.8105 39.3131 175.1461 97 G 4.7906 8.9283 115.9643 44.7544 0.0000 170.8372 98 L 5.3498 8.3393 118.0446 52.9095 46.4199 175.2383 99 L 5.1730 8.8983 125.8929 53.3490 44.1481 175.1772 100 I 4.8400 8.7314 119.2734 58.0989 41.7848 173.2424 101 P 4.6131 0.0000 0.0000 62.1184 32.2292 177.9573 102 G 3.8271 8.4873 108.6355 48.4187 0.0000 176.1111 103 T 4.1696 7.8916 109.8854 63.8520 69.4142 175.6206 104 A 4.4287 7.9999 122.3572 52.6052 18.8273 178.7170 105 T 3.9427 7.5318 115.1729 66.5510 68.4007 174.5543 106 P 4.4392 0.0000 0.0000 65.3252 31.6835 177.8369 107 L 3.9455 8.0379 117.7838 56.7118 41.5550 177.1548 108 F 4.6497 7.6854 116.5397 55.6875 38.0212 175.0583 109 R 4.5192 8.7774 122.5256 55.9388 31.7897 176.0881 110 S 4.5453 7.3500 110.9251 56.1099 65.4964 176.3371 111 V 3.5035 8.1239 114.0205 64.2158 30.6377 179.0072 112 G 3.6846 7.9843 104.9962 47.4681 0.0000 174.7061 113 D 4.2914 7.7262 119.1817 55.8484 41.1865 178.0996 114 L 4.2800 7.9405 120.5688 56.0814 41.5394 177.1840 115 K 4.1072 6.9384 119.4458 58.2377 32.2717 176.7276 116 N 4.4833 9.1437 124.7269 54.0547 37.9331 175.3145 117 K 4.4057 7.7926 123.0566 54.7694 33.2609 182.0276 118 E 4.5293 9.0910 124.6650 56.2321 29.4341 175.0807 119 V 4.7585 8.5018 124.3363 61.0735 33.6812 174.2993 120 A 5.1097 8.8894 130.2477 51.3841 20.4208 176.4727 121 V 4.8587 8.5547 113.8579 59.6634 36.6988 174.6121 122 V 4.6397 8.5235 122.7989 61.5709 32.5057 175.9584 123 R 4.0712 8.7905 124.9055 57.1123 30.0203 175.5455 124 D 4.4214 8.8323 118.3977 55.6551 40.0382 173.0817 125 T 4.7660 7.5038 105.1932 58.7203 71.9569 174.6800 126 T 3.8958 8.3725 112.3252 64.7044 68.5274 176.2527 127 A 4.2678 7.6314 123.9444 54.9735 18.2727 179.6972 128 V 3.5961 7.7713 116.6633 66.4623 31.5669 178.0852 129 D 4.3048 7.9776 118.0682 57.1549 40.6941 178.6838 130 W 4.3943 8.2549 119.3589 59.6678 29.0461 178.5275 131 A 4.2795 8.7254 121.3297 55.3112 17.8335 179.5093 132 N 4.3810 8.3818 115.1601 56.4207 38.4200 177.4879 133 F 4.1223 8.3973 121.3369 60.9588 39.4555 175.7580 134 Y 4.5305 7.9081 113.8652 57.0003 38.0719 175.2949 135 Q 3.4817 8.0857 117.9561 56.8230 26.9271 173.5613 136 A 4.7575 7.9316 119.4823 52.0299 19.8763 178.9845 137 D 4.6556 8.9703 120.4483 52.7745 40.1365 174.3383 138 V 4.1633 8.1422 124.2000 63.2944 32.8479 175.7688 139 R 4.5970 8.9358 127.5388 54.8928 32.3786 171.4686 140 E 4.8347 8.8093 125.1421 55.7090 30.4501 176.5691 141 T 4.7574 8.7760 112.8088 59.8316 72.2554 174.8006 142 N 4.3833 8.9145 119.5372 55.9851 39.0750 175.2455 143 N 4.8526 7.5553 114.1541 50.5309 41.2689 174.9447 144 L 3.6427 8.2043 121.6108 58.4439 41.9345 178.8487 145 T 3.7224 7.7752 115.0336 66.5161 68.2913 176.3144 146 A 3.9554 8.4978 122.6840 55.0268 18.1626 179.5982 147 A 3.9161 7.8755 119.4085 55.2719 18.4462 179.9036 148 I 3.7449 7.9193 118.5752 64.4407 37.3123 178.7011 149 T 4.3352 8.2458 117.0043 66.3227 67.6979 176.5713 150 L 4.1099 7.7001 121.2035 57.0809 41.4349 178.9773 151 L 4.0413 7.2232 118.5284 57.9387 42.1651 178.3940 152 Q 4.2239 8.5717 120.0110 58.2051 29.0613 178.6062 153 K 4.8058 8.4042 126.9164 53.9933 30.5038 183.2681 154 K 4.6996 8.0999 108.5057 55.6105 33.5562 173.8989 155 Q 4.5083 8.8293 120.5430 55.7270 32.0878 176.5275 156 V 4.5821 7.6410 108.6728 59.7337 34.1616 175.2030 157 E 4.6181 8.8163 121.0664 56.5700 30.1527 175.5120 158 A 4.4168 7.1861 119.9969 51.3911 22.7731 175.1860 159 V 4.6633 8.0660 118.7745 61.3827 34.5900 173.8391 160 M 5.0064 8.8189 128.6665 54.3288 33.4359 174.5933 161 F 4.6525 8.7896 126.3137 57.1152 44.3420 172.3882 162 D 4.6475 7.4122 120.8754 54.9909 41.0772 177.9413 163 R 3.9832 9.4109 124.1899 59.3931 30.0793 177.0177 164 P 4.4461 0.0000 0.0000 65.5786 31.4223 178.4762 165 A 4.7186 8.2127 120.6204 54.6295 18.4205 179.6007 166 L 4.0630 8.1365 117.2024 58.0488 41.8175 179.7003 167 I 3.8023 8.1212 119.8523 64.5750 36.8491 177.7515 168 Y 4.0915 8.1500 119.1964 60.8526 38.8945 177.2820 169 Y 4.0924 8.3078 120.6045 61.0131 38.8491 178.2400 170 T 3.9166 8.2306 110.5764 64.8978 68.4907 176.2472 171 R 3.9402 7.6258 119.2496 57.9921 30.2044 177.8009 172 Q 4.2249 7.3243 116.2076 55.8325 30.7707 175.3327 173 N 5.1082 7.1673 116.5804 50.1094 39.3951 173.6956 174 P 4.2870 0.0000 0.0000 65.2957 31.9956 179.1962 175 N 4.3967 8.1381 115.3372 55.4840 37.2461 176.8984 176 L 3.9925 7.7465 118.2493 55.4452 42.0669 176.1879 177 N 4.1706 7.8989 116.1560 54.5818 37.6362 173.1295 178 L 4.8848 8.0016 117.2778 53.9395 44.1886 177.1782 179 E 4.7514 9.2989 118.7523 54.8238 34.3351 175.7713 180 V 4.6639 8.3908 123.7383 61.0772 32.1647 175.6578 181 T 4.1704 8.4446 121.4882 62.5302 69.0937 174.8753 182 E 4.2456 8.7470 116.2839 56.8908 30.2553 176.2050 183 I 3.6957 7.3420 120.5543 62.8063 37.0831 176.4833 184 R 4.5246 8.2098 123.6381 54.0761 30.3362 173.3929 185 V 3.6289 8.3511 125.9900 64.9167 32.2682 175.6454 186 S 4.2440 6.7203 110.0498 57.6684 66.6373 175.1935 187 L 5.0498 8.3727 119.3587 52.9760 44.1775 176.2320 188 E 4.8019 9.3846 123.6512 53.7274 33.4483 173.7085 189 P 4.7463 0.0000 0.0000 62.7019 33.5005 174.3171 190 Y 5.3378 8.7392 119.7435 56.7731 40.2405 175.1059 191 G 4.7191 9.1542 109.6025 45.4443 0.0000 171.3909 192 F 5.6364 9.2218 118.2316 56.0393 42.1561 175.3034 193 V 4.5007 8.5907 120.4445 61.2037 33.7629 174.6633 194 L 5.0723 8.5926 126.8097 52.2700 45.8440 175.4726 195 K 4.4934 8.3066 121.0697 55.9386 33.4406 175.6100 196 E 3.9778 8.7723 128.2451 57.2871 30.2504 176.1736 197 N 4.2473 8.8750 121.8774 54.2012 36.5003 174.3866 198 S 4.2635 7.6968 112.7409 57.5207 62.9222 172.9793 199 P 4.5553 0.0000 0.0000 64.3448 31.5520 176.8423 200 L 4.4697 7.9342 119.3847 56.3293 42.5753 178.2439 201 Q 4.0370 8.0086 119.6765 59.5072 28.8020 178.9165 202 K 3.9702 8.1346 119.5184 59.9381 32.3022 178.7193 203 T 3.9479 8.0134 115.4114 66.7153 68.3990 176.6278 204 I 3.9005 8.2497 121.7976 64.4450 37.1138 178.1898 205 N 4.4094 8.6183 117.6826 56.3777 38.3549 177.5040 206 V 3.6110 7.8603 119.4467 66.1926 31.6219 177.9135 207 E 3.9516 8.1918 118.1822 59.7882 29.2701 179.3488 208 M 4.1855 8.5380 119.1150 58.3662 31.9077 178.8749 209 L 4.1958 8.3893 119.5384 57.7057 41.7692 179.2686 210 N 4.3998 8.4571 116.8022 56.3728 38.5609 177.4320 211 L 4.0071 8.1331 120.4001 57.6193 41.6737 179.2364 212 L 3.9261 8.2256 120.3050 58.6297 41.9330 178.7860 213 Y 4.0874 8.3697 116.1452 60.5408 37.8958 177.8687 214 S 4.4996 8.1482 115.2691 58.6866 63.7853 175.4244 215 R 3.9360 7.8643 120.2609 57.4631 27.6822 183.4102 216 V 3.4297 7.6164 120.5692 66.9780 31.2736 178.3640 217 I 3.6916 7.5645 118.9463 64.1468 36.9471 178.0665 218 A 4.1682 8.0759 123.8080 55.7381 18.2543 180.0423 219 E 3.9625 7.8800 116.4955 61.1317 29.4225 181.8429 220 F 4.8824 7.9629 118.8677 61.0970 39.0793 177.9678 221 T 4.1093 8.6201 117.8985 67.4063 68.2800 177.3142 222 E 4.2099 8.7992 122.8775 61.6953 29.4585 181.9954 223 R 4.0653 8.0895 120.1086 60.7659 29.5659 181.1085 224 W 5.0755 7.7531 116.3499 56.9478 29.6561 177.4664 225 L 4.7330 7.9813 117.8571 55.5712 43.7911 175.4882 226 G 3.8172 8.3753 112.1966 45.8421 0.0000 173.9774 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 G 8.34 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 2 S 8.38 4.46 0.00 4.07 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 3 A 7.95 4.14 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 M 8.60 3.87 0.00 1.94 1.98 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.51 0.00 5 A 8.28 4.48 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 6 L 8.78 4.20 0.00 1.54 1.39 0.40 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 7 K 9.17 4.46 0.00 1.54 1.63 0.00 1.66 0.00 0.00 1.50 0.00 0.00 2.66 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.27 7.81 8 V 8.37 4.08 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.32 0.00 0.00 0.18 0.00 0.00 9 G 8.62 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 10 V 8.51 4.92 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.29 0.00 0.00 11 V 8.03 5.04 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 0.75 0.00 0.00 0.94 0.00 0.00 12 G 8.14 4.55 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 0.00 0.00 0.00 13 N 8.11 5.04 0.00 2.88 2.67 0.00 0.00 6.84 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 14 P 0.00 3.49 0.00 1.81 0.49 0.00 3.42 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.05 0.00 15 P 0.00 3.76 0.00 1.94 1.92 0.00 3.76 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.90 0.00 16 F 7.69 3.82 0.00 3.17 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 17 V 7.21 4.74 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.20 0.00 0.00 0.91 0.00 0.00 18 F 9.00 4.59 0.00 2.69 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 Y 8.42 4.33 0.00 2.94 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 20 G 9.10 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 0.00 0.00 0.00 *26 A 8.89 4.26 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 27 F 7.84 5.27 0.00 2.49 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 T 8.97 4.53 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 1.22 0.00 0.00 29 G 8.69 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 0.00 0.00 0.00 30 I 7.57 3.64 1.26 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.42 1.11 0.00 0.00 31 S 8.22 4.42 0.00 4.10 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 32 L 7.79 4.16 0.00 1.74 1.65 0.53 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 33 D 8.08 4.05 0.00 2.28 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 V 7.87 3.83 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 0.95 0.00 0.00 1.21 0.00 0.00 35 W 8.51 4.37 0.00 3.39 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 36 R 8.39 3.81 0.00 1.97 1.97 0.00 3.21 0.00 0.00 3.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.95 0.00 37 A 7.98 4.29 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 0.00 0.00 0.00 0.00 0.00 38 V 7.59 3.25 1.83 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 0.83 0.00 0.00 1.02 0.00 0.00 39 A 7.35 3.75 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 E 8.38 3.84 0.00 2.07 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 41 S 7.75 4.07 0.00 3.89 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 42 Q 6.84 4.09 0.00 0.93 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.74 6.86 0.00 0.00 0.00 0.00 0.00 1.56 1.16 0.00 43 K 7.44 3.86 0.00 1.95 1.74 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.29 1.26 7.81 44 W 8.17 5.05 0.00 3.30 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 45 N 8.80 5.12 0.00 2.67 2.73 0.00 0.00 6.70 7.57 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 46 S 8.61 5.08 0.00 3.49 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 47 E 8.46 4.33 0.00 1.89 1.62 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 2.14 2.22 0.00 48 Y 8.38 4.79 0.00 2.91 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 0.00 0.00 0.00 0.00 49 V 8.65 4.39 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 1.01 0.00 0.00 0.89 0.00 0.00 50 R 9.13 4.55 0.00 2.36 1.95 0.00 2.79 0.00 0.00 3.01 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.67 0.00 51 Q 9.18 4.61 0.00 1.93 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.58 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 52 N 8.83 4.35 0.00 2.63 2.82 0.00 0.00 6.83 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 53 S 7.45 4.64 0.00 4.27 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 54 I 8.33 3.71 2.00 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 1.69 0.64 0.94 0.00 0.00 55 S 8.64 4.09 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 56 A 7.97 4.05 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 G 8.22 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 I 8.02 3.68 1.83 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 1.40 0.91 0.83 0.00 0.00 59 T 7.97 3.85 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 60 A 7.81 4.22 1.31 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 61 V 7.70 3.72 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 1.00 0.00 0.00 0.88 0.00 0.00 62 A 8.00 4.06 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 E 8.14 4.33 0.00 2.08 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.19 0.00 64 G 7.69 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 65 E 8.28 4.10 0.00 2.12 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.23 0.00 66 L 7.38 4.78 0.00 1.52 1.33 0.80 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 67 D 8.61 4.54 0.00 2.42 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 I 7.08 4.44 1.62 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 1.46 0.04 0.00 0.00 69 L 8.70 4.91 0.00 1.61 1.35 0.81 0.90 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 70 I 9.64 4.06 0.67 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 0.86 0.35 -0.38 0.00 0.00 71 G 8.80 4.80 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 72 P 0.00 3.45 0.00 0.92 0.93 0.00 3.89 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.80 0.00 73 I 7.15 4.17 2.34 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.63 1.13 0.00 0.00 74 S 8.62 4.75 0.00 3.79 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 75 V 8.36 3.13 1.79 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 0.08 0.00 0.00 0.62 0.00 0.00 76 T 7.88 4.66 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 1.23 0.00 0.00 77 P 0.00 4.25 0.00 2.11 2.11 0.00 3.51 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 78 E 8.01 4.02 0.00 2.06 1.87 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 2.23 1.97 0.00 79 R 8.01 4.38 0.00 2.19 2.35 0.00 3.40 0.00 0.00 3.38 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.70 0.00 80 A 8.36 4.38 1.44 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 0.00 0.00 81 A 7.71 4.22 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 I 7.35 3.67 1.98 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 1.16 1.02 0.89 0.00 0.00 83 E 8.60 4.05 0.00 1.98 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 0.00 2.23 1.88 0.00 84 G 9.24 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 I 6.91 5.05 1.76 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.80 0.82 0.00 0.00 86 T 8.51 4.74 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 87 F 8.94 5.13 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 88 T 8.71 4.57 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 89 Q 9.15 4.32 0.00 2.04 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.90 0.00 0.00 0.00 0.00 0.00 2.48 2.57 0.00 90 P 0.00 4.65 0.00 1.99 1.91 0.00 3.65 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 1.99 2.04 0.00 91 Y 8.48 4.87 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 92 F 7.40 4.62 0.00 2.95 2.37 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 93 S 7.29 4.55 0.00 3.58 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 94 S 8.50 4.75 0.00 3.18 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 95 G 8.45 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.36 4.64 1.67 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 1.08 0.95 0.92 0.00 0.00 97 G 8.93 4.79 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 98 L 8.34 5.35 0.00 1.44 1.29 0.93 0.42 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 99 L 8.90 5.17 0.00 1.71 1.45 0.97 0.82 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 I 8.73 4.84 1.63 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 1.20 0.68 0.01 0.00 0.00 101 P 0.00 4.61 0.00 2.23 2.03 0.00 3.63 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.08 0.00 102 G 8.49 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 0.00 103 T 7.89 4.17 4.27 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 1.23 0.00 0.00 104 A 8.00 4.43 1.60 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 0.00 105 T 7.53 3.94 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 0.00 106 P 0.00 4.44 0.00 2.05 2.12 0.00 3.77 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 2.05 2.13 0.00 107 L 8.04 3.95 0.00 1.58 1.27 0.93 0.56 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 0.00 108 F 7.69 4.65 0.00 3.03 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 0.00 109 R 8.78 4.52 0.00 1.77 1.95 0.00 3.51 0.00 0.00 3.39 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 110 S 7.35 4.55 0.00 3.90 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 0.00 111 V 8.12 3.50 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 0.00 0.00 0.43 0.00 0.00 0.77 0.00 0.00 112 G 7.98 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 0.00 0.00 0.00 113 D 7.73 4.29 0.00 2.73 2.58 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 0.00 114 L 7.94 4.28 0.00 1.96 1.84 0.87 0.53 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 0.00 115 K 6.94 4.11 0.00 1.78 1.76 0.00 1.89 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.48 1.55 7.81 116 N 9.14 4.48 0.00 2.94 3.00 0.00 0.00 6.97 7.19 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 0.00 117 K 7.79 4.41 0.00 1.47 1.69 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.80 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.29 7.81 118 E 9.09 4.53 0.00 1.89 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.58 0.00 119 V 8.50 4.76 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 1.14 0.00 0.00 120 A 8.89 5.11 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 0.00 121 V 8.55 4.86 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 1.00 0.00 0.00 122 V 8.52 4.64 2.40 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 0.94 0.00 0.00 0.95 0.00 0.00 123 R 8.79 4.07 0.00 1.85 1.96 0.00 3.28 0.00 0.00 3.16 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.62 0.00 124 D 8.83 4.42 0.00 2.81 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 T 7.50 4.77 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 1.41 0.00 0.00 126 T 8.37 3.90 4.42 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 1.23 0.00 0.00 127 A 7.63 4.27 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 0.00 128 V 7.77 3.60 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 1.02 0.00 0.00 129 D 7.98 4.30 0.00 2.50 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 0.00 0.00 0.00 0.00 130 W 8.25 4.39 0.00 3.49 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 0.00 131 A 8.73 4.28 1.55 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 0.00 0.00 132 N 8.38 4.38 0.00 2.95 2.91 0.00 0.00 6.66 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 0.00 133 F 8.40 4.12 0.00 2.86 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 Y 7.91 4.53 0.00 3.32 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 0.00 135 Q 8.09 3.48 0.00 2.32 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.83 0.00 0.00 0.00 0.00 0.00 2.24 2.20 0.00 136 A 7.93 4.76 1.46 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 0.00 137 D 8.97 4.66 0.00 2.93 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 V 8.14 4.16 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 0.84 0.00 0.00 1.09 0.00 0.00 139 R 8.94 4.60 0.00 1.50 1.77 0.00 3.32 0.00 0.00 3.17 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.44 0.00 140 E 8.81 4.83 0.00 1.87 1.93 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 2.35 2.34 0.00 141 T 8.78 4.76 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 1.21 0.00 0.00 142 N 8.91 4.38 0.00 2.73 2.91 0.00 0.00 6.73 8.00 0.00 0.00 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 7.56 4.85 0.00 2.91 2.87 0.00 0.00 5.92 6.67 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 0.00 144 L 8.20 3.64 0.00 1.10 1.39 0.13 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 145 T 7.78 3.72 4.38 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 1.23 0.00 0.00 146 A 8.50 3.96 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 A 7.88 3.92 1.31 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 0.00 148 I 7.92 3.74 1.53 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.35 0.66 0.00 0.00 149 T 8.25 4.34 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 150 L 7.70 4.11 0.00 1.86 1.70 0.96 0.41 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 0.00 151 L 7.22 4.04 0.00 1.62 1.82 0.95 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 152 Q 8.57 4.22 0.00 2.20 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.75 6.73 0.00 0.00 0.00 0.00 0.00 2.45 2.55 0.00 153 K 8.40 4.81 0.00 1.82 0.74 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.95 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.39 1.25 7.81 154 K 8.10 4.70 0.00 1.70 1.57 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.17 0.93 7.81 155 Q 8.83 4.51 0.00 2.01 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.64 0.00 0.00 0.00 0.00 0.00 2.29 2.43 0.00 156 V 7.64 4.58 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 0.76 0.00 0.00 0.96 0.00 0.00 157 E 8.82 4.62 0.00 2.09 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 2.38 2.34 0.00 158 A 7.19 4.42 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 V 8.07 4.66 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 0.98 0.00 0.00 0.89 0.00 0.00 160 M 8.82 5.01 0.00 2.16 2.03 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.56 0.00 161 F 8.79 4.65 0.00 3.18 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 162 D 7.41 4.65 0.00 2.65 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 R 9.41 3.98 0.00 1.99 2.02 0.00 3.10 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.74 0.00 164 P 0.00 4.45 0.00 2.61 2.38 0.00 3.84 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.46 0.00 165 A 8.21 4.72 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 0.00 0.00 0.00 0.00 0.00 0.00 166 L 8.14 4.06 0.00 1.99 1.82 1.08 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 167 I 8.12 3.80 2.16 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.26 1.01 0.00 0.00 168 Y 8.15 4.09 0.00 3.16 3.31 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 0.00 169 Y 8.31 4.09 0.00 3.31 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 0.00 170 T 8.23 3.92 4.27 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 1.40 0.00 0.00 171 R 7.63 3.94 0.00 1.80 1.90 0.00 3.19 0.00 0.00 3.23 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.84 0.00 172 Q 7.32 4.22 0.00 1.65 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 7.32 0.00 0.00 0.00 0.00 0.00 1.93 2.24 0.00 173 N 7.17 5.11 0.00 2.26 2.62 0.00 0.00 7.26 7.90 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 0.00 174 P 0.00 4.29 0.00 2.13 2.07 0.00 3.53 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 2.05 2.01 0.00 175 N 8.14 4.40 0.00 2.85 3.07 0.00 0.00 6.31 6.67 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 0.00 176 L 7.75 3.99 0.00 1.83 1.82 1.05 1.04 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 0.00 177 N 7.90 4.17 0.00 2.90 2.85 0.00 0.00 6.97 7.99 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 0.00 178 L 8.00 4.88 0.00 1.65 1.61 1.06 0.88 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 0.00 179 E 9.30 4.75 0.00 1.54 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.09 0.00 180 V 8.39 4.66 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 1.05 0.00 0.00 0.99 0.00 0.00 181 T 8.44 4.17 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 182 E 8.75 4.25 0.00 2.01 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 2.21 1.89 0.00 183 I 7.34 3.70 1.85 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.97 0.83 0.00 0.00 184 R 8.21 4.52 0.00 1.70 1.81 0.00 3.25 0.00 0.00 3.26 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.14 0.00 185 V 8.35 3.63 1.83 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 0.87 0.00 0.00 0.85 0.00 0.00 186 S 6.72 4.24 0.00 3.42 2.63 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 0.00 187 L 8.37 5.05 0.00 1.39 1.47 0.83 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 188 E 9.38 4.80 0.00 1.82 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.23 0.00 189 P 0.00 4.75 0.00 2.00 2.04 0.00 3.59 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.89 0.00 190 Y 8.74 5.34 0.00 2.12 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 0.00 0.00 0.00 0.00 191 G 9.15 4.72 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 0.00 0.00 0.00 192 F 9.22 5.64 0.00 3.13 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 0.00 193 V 8.59 4.50 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.31 0.00 0.00 194 L 8.59 5.07 0.00 1.60 1.52 1.05 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 195 K 8.31 4.49 0.00 1.78 1.62 0.00 1.71 0.00 0.00 1.72 0.00 0.00 2.78 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.68 1.39 7.81 196 E 8.77 3.98 0.00 2.05 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.32 0.00 197 N 8.87 4.25 0.00 2.91 2.89 0.00 0.00 6.96 7.57 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 0.00 198 S 7.70 4.26 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 0.00 199 P 0.00 4.56 0.00 2.24 2.17 0.00 3.79 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 1.96 1.97 0.00 200 L 7.93 4.47 0.00 1.82 1.89 0.73 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 201 Q 8.01 4.04 0.00 2.23 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.79 0.00 0.00 0.00 0.00 0.00 2.45 2.50 0.00 202 K 8.13 3.97 0.00 1.92 1.86 0.00 1.81 0.00 0.00 1.85 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.55 1.58 7.81 203 T 8.01 3.95 4.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 204 I 8.25 3.90 2.13 0.00 0.00 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 2.08 1.36 1.28 0.00 0.00 205 N 8.62 4.41 0.00 2.87 2.95 0.00 0.00 6.69 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 206 V 7.86 3.61 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.99 0.00 0.00 207 E 8.19 3.95 0.00 2.18 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.31 0.00 208 M 8.54 4.19 0.00 2.11 2.27 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.63 0.00 209 L 8.39 4.20 0.00 1.98 1.88 1.03 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 210 N 8.46 4.40 0.00 2.94 2.88 0.00 0.00 6.98 7.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 211 L 8.13 4.01 0.00 1.95 1.76 1.05 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 212 L 8.23 3.93 0.00 1.99 1.91 0.94 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 213 Y 8.37 4.09 0.00 3.06 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 0.00 214 S 8.15 4.50 0.00 4.04 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 0.00 215 R 7.86 3.94 0.00 1.95 2.05 0.00 3.27 0.00 0.00 3.09 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.42 0.00 216 V 7.62 3.43 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 0.31 0.00 0.00 0.83 0.00 0.00 217 I 7.56 3.69 1.99 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.53 1.38 0.00 0.00 218 A 8.08 4.17 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 219 E 7.88 3.96 0.00 2.00 1.97 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 2.24 2.22 0.00 220 F 7.96 4.88 0.00 3.45 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 0.00 221 T 8.62 4.11 4.59 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 1.42 0.00 0.00 222 E 8.80 4.21 0.00 1.97 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.20 0.00 223 R 8.09 4.07 0.00 1.92 1.88 0.00 3.22 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.54 0.00 224 W 7.75 5.08 0.00 3.16 3.25 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 0.00 225 L 7.98 4.73 0.00 1.71 1.82 1.25 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 226 G 8.38 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 * Residues marked with a * may have inaccurate shift predictions.