NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2824 7.8827 121.4454 61.1705 38.7725 173.7769 17 V 4.3982 8.4991 125.4955 61.6318 33.0801 174.2940 18 G 3.6386 9.0279 114.6595 46.4738 0.0000 173.1014 19 G 4.2409 7.7954 110.1336 43.8064 0.0000 172.4293 20 Y 4.9735 7.8416 116.6276 55.1453 42.2164 174.7620 21 T 4.3394 8.5830 116.9170 63.8901 68.5252 175.3732 22 C 4.3425 8.7103 125.3813 61.2152 35.7491 174.3233 23 G 4.1859 8.6067 105.7156 43.4665 0.0000 172.9883 24 A 4.1286 8.6499 124.8959 53.6582 18.6331 177.2562 25 N 4.2114 8.7583 120.6778 54.5094 36.3059 175.2401 26 T 4.2611 7.5289 107.1680 62.3790 70.1307 175.1138 27 V 4.0760 7.0051 122.0461 60.1888 31.3345 173.6788 28 P 4.4513 0.0000 0.0000 64.4414 32.0410 178.1606 29 Y 5.1616 6.8250 115.6576 56.5025 38.7706 174.6283 30 Q 4.6120 7.3242 123.4070 56.2931 29.7162 175.4242 31 V 4.8969 8.9873 118.6663 59.6241 36.1934 174.2157 32 S 5.0822 8.7690 117.1619 56.5901 65.0989 172.5840 33 L 4.7477 8.5457 127.6180 53.2259 43.4609 174.9461 34 N 6.0551 9.1510 122.8151 50.0826 41.9249 174.9960 *37 S 5.0229 7.8658 120.3195 58.6225 64.1411 174.4468 38 G 3.9698 9.4610 108.7622 46.3303 0.0000 172.9518 39 Y 4.5367 6.4683 115.2705 56.1488 40.0985 172.7257 40 H 4.7183 8.8422 121.5921 56.1369 30.3740 174.7496 41 F 5.0797 7.9354 119.7871 56.8716 39.6471 173.8453 42 C 4.7754 6.8611 115.0370 56.1296 44.7823 173.2118 43 G 4.3210 8.7466 109.3355 45.4919 0.0000 172.2524 44 G 4.4271 8.2217 105.4706 46.2755 0.0000 172.5059 45 S 5.4428 8.8990 115.2983 56.4839 66.9765 173.5507 46 L 4.8430 9.1218 127.0807 54.5860 42.5258 177.0652 47 I 4.3722 8.5263 119.7551 61.0454 38.9108 174.5718 48 N 4.4891 7.6531 117.3829 52.1036 39.2699 175.1891 49 S 4.1735 8.4847 112.6512 60.7370 62.9460 175.5644 50 Q 4.5100 8.1885 117.6453 55.1831 30.2957 174.5860 51 W 5.5318 8.0700 118.1310 54.7547 33.4824 174.4516 52 V 5.1144 9.1032 122.5777 61.0898 34.7174 174.4448 53 V 4.9742 8.7508 125.9151 60.5051 33.9106 174.8748 54 S 5.0779 8.9341 116.4017 57.8039 66.0526 172.1131 55 A 4.6467 8.5264 120.3736 50.7161 20.4398 178.5181 56 A 3.8530 8.2706 124.0889 55.2259 18.4972 179.3510 57 H 4.4922 8.3882 109.8283 57.5344 28.6418 175.3349 58 C 4.7212 7.7492 117.1731 57.0114 40.4503 173.2417 59 Y 4.2948 7.7185 122.2362 57.9803 38.7848 175.4275 60 K 3.8165 7.1318 123.5670 55.3974 36.0536 175.2023 61 S 4.3437 7.9753 117.1078 58.5323 64.7352 173.8372 62 G 3.5625 8.4492 108.3742 46.4424 0.0000 173.4230 63 I 4.6736 7.1437 118.6493 59.4772 40.7232 176.2880 64 Q 4.7963 8.4589 126.1489 54.2534 32.1779 173.8797 65 V 4.4718 8.8931 126.5406 61.5096 33.8573 174.5339 66 R 5.2017 8.9790 126.8851 54.6666 32.7664 175.0084 67 L 4.7765 9.1911 124.6382 52.6447 44.9651 177.0660 *69 G 4.1569 8.2145 105.5350 46.3404 0.0000 172.7858 70 E 4.6747 8.4768 118.7694 55.1905 30.5015 174.2427 71 D 4.7648 7.8446 117.5649 54.8994 43.7452 173.9869 72 N 5.1977 9.1880 117.3797 52.7661 39.5258 176.1028 73 I 4.0170 8.5433 119.4470 61.9063 37.8832 176.0783 74 N 4.8105 8.7307 118.0753 53.0491 39.3000 174.6526 75 V 4.2728 7.4029 117.6596 60.7859 34.2320 175.0774 76 V 4.0962 8.4428 127.1001 62.5587 30.6336 175.2196 77 E 4.2738 9.1768 127.3919 56.1812 29.8251 177.5495 78 G 4.0432 8.1914 107.1051 45.2177 0.0000 174.2694 79 N 4.8963 8.1510 115.4667 53.0717 39.9233 174.5191 80 E 5.2013 7.8340 118.1793 55.5699 31.1368 176.1069 81 Q 4.3179 8.4078 119.5914 54.3389 32.9485 173.8953 82 F 5.6435 8.7895 122.9512 55.9566 41.1616 175.0846 83 I 4.6949 8.8832 124.8838 59.4133 40.9046 175.7072 84 S 4.6394 8.6854 121.8042 58.2603 64.3263 173.1381 85 A 4.7157 8.2762 124.4521 51.7801 18.8148 177.6382 86 S 4.6199 8.8511 116.0861 59.6727 64.7869 174.5051 87 K 4.6728 7.4583 116.8873 55.8691 35.4494 174.8922 88 S 5.3136 8.7018 116.6629 57.0228 66.8997 173.8721 89 I 4.6053 9.0605 123.6520 59.7165 40.3993 174.7651 90 V 4.2419 8.4580 127.3755 61.9105 32.8830 175.1328 91 H 3.4835 8.5860 126.6827 55.8916 29.9580 174.2582 92 P 4.2458 0.0000 0.0000 65.4739 31.0132 177.0614 93 S 4.7087 7.7699 112.5625 58.0184 63.3974 173.1895 94 Y 4.3196 7.9531 122.9875 57.6504 38.9902 174.4305 95 N 4.5511 8.1222 125.7355 51.3633 39.8180 175.0112 96 S 3.8650 7.6904 120.2480 59.6112 63.5323 175.2453 97 N 4.3969 8.2489 119.1919 55.1971 38.5290 175.9430 98 T 4.0681 7.6529 105.1436 60.4100 70.2120 174.5131 99 L 3.7357 7.8058 120.9967 55.6026 39.7039 173.9353 100 N 4.4911 7.6507 117.6306 54.5683 39.6714 174.4501 101 N 4.6231 8.6725 119.6566 54.2248 35.7538 175.7809 102 D 4.7011 7.8781 117.7566 52.8935 39.7485 174.9655 103 I 4.8143 7.1415 120.9320 59.5556 42.2438 172.7275 104 M 5.4259 9.1049 125.9473 54.4049 36.3328 173.1366 105 L 5.4327 9.2036 123.0679 53.0872 45.3017 175.5505 106 I 5.0165 9.1272 123.4159 59.4753 40.7400 174.2808 107 K 3.7967 8.7380 128.7224 54.4685 33.7501 175.3813 108 L 4.5934 8.1184 126.9333 54.0364 42.6280 178.2204 109 K 4.0781 8.9086 122.4592 58.9486 32.4936 177.6196 110 S 4.6313 7.4009 110.4823 56.1677 66.8142 173.3644 111 A 4.4566 8.3445 124.0089 51.7988 18.8859 177.4982 112 A 4.3340 8.9081 123.8557 51.8940 19.8449 177.3369 113 S 4.6167 8.9301 116.4319 57.0414 63.7167 174.6549 114 L 4.4883 8.5185 125.6014 54.4593 42.5635 176.3797 115 N 4.7823 8.7416 117.8780 52.6596 39.9262 174.7635 116 S 4.1450 8.8473 113.2378 62.3083 62.8885 175.9817 117 R 4.1110 8.4168 117.5839 57.3149 30.3290 176.5966 118 V 4.4643 7.8834 117.4568 60.9347 33.7323 173.7481 119 A 5.1873 8.5769 128.2298 50.4380 23.0490 174.8723 120 S 5.1388 8.6844 113.7979 57.3079 65.3457 173.0485 121 I 4.4694 8.2513 120.7289 59.1778 39.8109 175.4315 122 S 4.4241 8.3461 123.1047 58.0765 63.7285 173.8809 123 L 4.3499 8.0860 123.3679 53.1632 42.6425 175.1578 124 P 4.5355 0.0000 0.0000 62.9248 32.2337 176.2493 125 T 4.1461 8.2241 108.7632 62.4346 69.9763 174.5179 *127 S 4.5324 7.5581 114.7355 58.1738 64.0336 173.6444 128 C 4.4923 8.3571 117.4199 56.2227 40.9684 173.4320 129 A 4.5363 7.8983 124.0843 51.1464 20.1536 177.4805 130 S 4.2710 8.0507 115.4064 57.6184 64.2348 173.6810 *132 A 4.2609 8.1945 124.5468 53.4480 19.2970 176.6235 133 G 4.0412 8.9549 109.7561 45.5227 0.0000 174.6294 134 T 4.0027 7.7044 116.7958 63.8000 69.4825 173.6904 135 Q 4.8106 8.5480 124.5462 55.2800 30.3005 175.5660 136 C 5.2618 9.1955 119.9012 55.0714 46.3715 172.3228 137 L 5.1992 8.9766 122.2139 53.5001 44.2141 175.0140 138 I 5.2170 9.1279 127.1339 58.7633 40.2121 174.7991 139 S 4.9359 8.8135 119.2607 56.2603 66.6397 173.1328 140 G 3.8549 7.4279 109.1661 45.9966 0.0000 172.5621 141 W 4.9033 8.4938 117.4088 56.3143 29.4977 177.1931 142 G 4.1187 8.2952 108.6940 43.9784 0.0000 173.6418 143 N 3.5739 8.3145 118.1097 54.2916 38.9337 174.4442 144 T 5.1144 8.1355 112.4063 60.4137 69.4238 174.0316 145 K 4.6564 7.7860 120.7037 55.0040 34.8998 176.3197 146 S 4.3312 8.6581 118.0742 60.6539 63.2137 174.6852 147 S 4.4691 8.8195 116.2733 56.5560 63.0675 173.5437 148 G 4.2402 7.3288 111.4406 43.7178 0.0000 169.7673 149 T 4.7836 7.7204 115.9865 61.7746 71.9239 174.4293 150 S 4.4297 9.2346 120.8850 57.9319 65.8931 172.4164 151 Y 4.8475 8.7670 125.8685 55.6194 39.3870 174.3698 152 P 4.7201 0.0000 0.0000 62.5310 32.9539 175.2745 153 D 4.9406 8.6266 116.8322 54.5565 42.8374 176.6524 154 V 5.5297 7.7167 110.4086 58.2714 34.7839 175.3800 155 L 3.2862 8.2817 124.3337 55.0026 42.9963 175.9603 156 K 4.9280 8.1508 124.5778 54.7970 35.4151 174.5079 157 C 5.2819 8.5565 119.6348 55.2058 42.9569 172.9196 158 L 4.9741 8.5439 122.1816 53.8730 45.5989 174.3395 159 K 5.1961 8.9080 125.1515 55.0041 33.9539 175.5712 160 A 4.8670 9.2012 125.2102 50.3491 23.1614 173.7063 161 P 5.0741 0.0000 0.0000 61.7661 34.0964 175.0397 162 I 4.3518 8.3272 121.9664 61.3144 38.1943 175.6272 163 L 4.9251 8.5608 126.5581 52.8861 43.8328 176.8628 164 S 4.3290 8.4252 115.0942 58.2779 63.8478 175.2610 165 D 4.4723 8.7106 122.2589 57.4046 40.5385 179.2130 166 S 4.1762 8.0695 114.9162 61.5177 62.9089 176.6206 167 S 4.4458 7.9155 119.3205 60.3471 62.9458 175.7336 168 C 4.3258 8.0800 122.1000 59.7360 43.2928 175.8376 169 K 4.0179 8.3146 119.2048 59.2736 31.7969 179.2950 170 S 4.2664 8.2767 114.6099 61.1391 62.7299 176.4611 171 A 3.9042 7.6048 124.0232 53.5581 19.6512 177.2369 172 Y 4.8230 7.5869 114.2323 55.0441 38.1080 172.4967 173 P 4.5255 0.0000 0.0000 63.8493 32.2615 177.0723 174 G 3.9940 9.0153 109.8703 46.2317 0.0000 173.7682 175 Q 4.5727 8.2088 117.0829 55.3511 30.6505 175.6128 176 I 4.4538 7.8574 119.2504 59.9527 38.6041 175.0709 177 T 4.6599 8.1795 114.6678 59.4586 71.2104 174.8408 178 S 4.3853 8.5504 114.6075 60.1726 63.2300 174.2865 179 N 4.9462 8.2162 118.7283 53.4326 38.4553 173.8781 180 M 5.6108 7.8495 116.9559 53.9334 36.3270 174.4159 181 F 5.0721 8.6310 114.4014 56.0837 42.0243 172.3717 182 C 5.5984 9.0607 116.3979 55.5676 42.2016 172.7437 183 A 4.9813 9.3964 122.4191 50.8794 22.4545 175.8341 184A G 4.0338 6.9014 106.9324 44.7201 0.0000 172.7055 184 Y 4.6697 8.3423 119.8205 55.9880 40.8980 176.4228 185 L 4.1399 8.6671 125.6941 57.4085 42.0319 179.1643 186 E 4.0676 8.1846 115.5692 57.5042 29.9631 177.1882 187 G 3.7545 7.7659 106.4593 44.5240 0.0000 170.8016 188A G 4.2751 8.8394 106.6937 44.6898 0.0000 174.2590 188 K 4.8777 7.1140 117.1564 54.4639 35.1091 175.2730 189 D 4.6120 8.6100 122.9758 54.0215 45.7110 174.8157 190 S 4.9909 8.7627 116.6654 57.8687 65.4219 172.9413 191 C 4.7839 9.3217 119.4237 55.1724 46.9837 172.4791 192 Q 4.4799 8.5328 118.9679 57.8700 28.3177 176.9799 193 G 4.2417 9.2372 108.5960 45.9803 0.0000 174.1983 194 D 4.7013 8.4030 118.4054 55.1795 41.7913 176.6736 195 S 4.4318 8.0621 115.1221 60.4445 63.2680 175.5810 196 G 4.1188 8.9560 112.8708 46.3984 0.0000 173.6871 197 G 4.1828 7.8643 107.6195 44.9293 0.0000 171.2633 198 P 5.1562 0.0000 0.0000 62.4136 33.5376 175.7775 199 V 4.6031 8.4757 120.5032 61.4864 34.5531 174.0509 200 V 4.8964 8.7905 128.8011 61.2610 34.1385 173.6588 201 C 5.1339 8.7880 124.5344 55.7856 43.9990 174.5706 202 S 3.7107 9.8161 119.4186 59.7149 60.1440 173.3459 203 G 3.9282 8.3900 104.6406 45.6038 0.0000 173.8153 204 K 4.7099 7.5867 117.9187 53.0464 35.3412 175.4757 *209 L 4.2873 8.2530 122.3160 55.4878 42.2378 175.9264 210 Q 4.5557 8.8117 125.7373 56.5027 30.9568 175.7364 211 G 5.3812 7.9793 104.6434 45.9310 0.0000 171.4893 212 I 5.1904 8.2207 119.4303 58.9114 41.2852 175.2902 213 V 3.6633 9.0273 127.4756 63.9136 31.7866 174.2573 214 S 4.8341 8.5082 121.0640 58.7891 64.2641 174.5921 215 W 4.9535 7.4663 114.8195 57.1357 31.6580 171.8982 216 G 3.5698 7.9195 104.3192 47.0936 0.0000 172.2066 217 S 4.6893 8.2746 115.1274 56.4829 63.6254 173.0240 *219 G 4.4502 8.0706 118.3064 45.6755 0.0000 170.9054 220 C 4.9640 8.1730 115.7251 56.5587 45.5095 173.7942 221A A 3.9180 9.0285 125.5807 53.2458 16.5676 177.0943 221 Q 4.6045 7.2711 115.9617 55.9872 30.0382 175.9404 222 K 4.1858 8.4346 121.7255 57.9967 32.7313 175.9984 223 N 4.2591 9.2502 121.2463 54.0777 37.0757 175.3640 224 K 4.3757 7.5250 116.3124 53.7577 32.1896 173.7138 225 P 4.6014 0.0000 0.0000 62.2329 33.1284 177.3778 226 G 3.7504 8.4672 106.5495 45.8924 0.0000 172.7759 227 V 4.4172 7.6488 121.2814 60.6797 34.1309 174.0945 228 Y 4.9578 8.1726 124.5020 55.9926 41.9183 175.0578 229 T 4.4098 8.6042 119.7130 63.6225 70.0688 174.3996 230 K 5.1115 9.3533 128.1148 55.1386 31.1876 177.0692 231 V 3.9709 8.7638 125.5841 65.9308 31.4091 174.8007 232 C 4.4070 8.3428 112.3836 58.0767 41.4857 174.7086 233 N 4.2874 8.0199 117.2589 54.2115 38.6120 174.9903 234 Y 4.8310 7.9634 117.7710 57.5292 39.2233 177.5814 235 V 3.6929 8.0351 121.6002 66.2709 31.4832 178.0764 236 S 4.1151 8.0932 114.3641 61.3038 62.6781 176.2533 237 W 4.1550 8.3019 130.5514 60.4632 30.4149 177.8273 238 I 3.0094 8.2148 119.8987 64.2121 36.5708 178.4456 239 K 3.7266 8.0855 119.3342 59.6330 31.6532 179.4950 240 Q 3.8854 7.8811 117.1741 59.1355 28.9393 178.6487 241 T 3.7417 7.6000 117.2022 66.4519 68.0252 176.9757 242 I 2.5015 7.2792 114.9654 63.2494 37.1595 177.8769 243 A 4.0664 7.4109 120.8847 53.7833 18.2792 178.5860 244 S 4.6705 7.2778 111.3122 58.2847 63.3813 173.9902 245 N 4.6979 7.8569 124.9902 53.5833 39.4699 174.1117 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 4.28 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 1.42 0.52 0.90 0.00 0.00 17 V 8.50 4.40 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 0.88 0.00 0.00 18 G 9.03 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 0.00 0.00 0.00 19 G 7.80 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 0.00 0.00 0.00 0.00 20 Y 7.84 4.97 0.00 2.99 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 21 T 8.58 4.34 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 22 C 8.71 4.34 0.00 2.76 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 G 8.61 4.19 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 0.00 0.00 0.00 24 A 8.65 4.13 nan 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.76 4.21 0.00 2.85 2.89 0.00 0.00 7.29 7.58 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 26 T 7.53 4.26 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 1.33 0.00 0.00 27 V 7.01 4.08 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 0.28 0.00 0.00 0.76 0.00 0.00 28 P 0.00 4.45 0.00 2.36 2.37 0.00 3.60 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.00 0.00 29 Y 6.82 5.16 0.00 3.25 3.38 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 30 Q 7.32 4.61 0.00 1.81 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.50 0.00 0.00 0.00 0.00 0.00 1.88 2.49 0.00 31 V 8.99 4.90 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 0.99 0.00 0.00 1.03 0.00 0.00 32 S 8.77 5.08 0.00 3.04 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 0.00 33 L 8.55 4.75 0.00 0.49 1.04 0.80 0.14 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 34 N 9.15 6.06 0.00 2.44 2.50 0.00 0.00 6.55 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *37 S 7.87 5.02 0.00 3.67 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 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 39 Y 6.47 4.54 0.00 3.07 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 40 H 8.84 4.72 0.00 2.87 3.17 0.00 5.86 0.00 0.00 0.00 0.00 6.89 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 5.08 0.00 3.08 3.18 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 42 C 6.86 4.78 0.00 2.20 2.82 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 43 G 8.75 4.32 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 0.00 44 G 8.22 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 S 8.90 5.44 0.00 3.82 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 L 9.12 4.84 0.00 1.87 1.67 1.09 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.53 4.37 1.90 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 1.55 0.92 0.95 0.00 0.00 48 N 7.65 4.49 0.00 2.93 2.98 0.00 0.00 6.27 8.46 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 49 S 8.48 4.17 0.00 4.14 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 Q 8.19 4.51 0.00 2.14 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.01 6.84 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 51 W 8.07 5.53 0.00 3.15 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 52 V 9.10 5.11 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 1.18 0.00 0.00 0.98 0.00 0.00 53 V 8.75 4.97 2.16 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 0.71 0.00 0.00 1.06 0.00 0.00 54 S 8.93 5.08 0.00 3.89 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.53 4.65 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 56 A 8.27 3.85 0.26 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 57 H 8.39 4.49 0.00 3.37 3.58 0.00 5.55 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.75 4.72 0.00 3.23 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 59 Y 7.72 4.29 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 60 K 7.13 3.82 0.00 1.32 1.21 0.00 0.61 0.00 0.00 1.01 0.00 0.00 2.60 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.93 0.86 7.81 61 S 7.98 4.34 0.00 3.78 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 62 G 8.45 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 0.00 0.00 0.00 63 I 7.14 4.67 1.88 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.00 0.95 0.00 0.00 64 Q 8.46 4.80 0.00 2.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.93 0.00 0.00 0.00 0.00 0.00 2.21 2.28 0.00 65 V 8.89 4.47 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 0.95 0.00 0.00 0.91 0.00 0.00 66 R 8.98 5.20 0.00 1.70 1.81 0.00 2.68 0.00 0.00 2.46 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 1.24 0.00 67 L 9.19 4.78 0.00 1.60 1.61 0.95 0.64 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 *69 G 8.21 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 E 8.48 4.67 0.00 2.17 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.13 0.00 71 D 7.84 4.76 0.00 2.76 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 9.19 5.20 0.00 2.82 2.78 0.00 0.00 7.22 8.59 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 73 I 8.54 4.02 1.43 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.53 -0.49 0.00 0.00 74 N 8.73 4.81 0.00 2.82 2.87 0.00 0.00 6.57 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 75 V 7.40 4.27 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 0.73 0.00 0.00 1.00 0.00 0.00 76 V 8.44 4.10 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 0.79 0.00 0.00 1.03 0.00 0.00 77 E 9.18 4.27 0.00 2.01 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.51 0.00 78 G 8.19 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 79 N 8.15 4.90 0.00 2.84 2.81 0.00 0.00 7.16 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 E 7.83 5.20 0.00 1.34 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 0.00 2.71 2.30 0.00 81 Q 8.41 4.32 0.00 1.95 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.85 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 82 F 8.79 5.64 0.00 2.81 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 8.88 4.69 1.88 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 1.24 0.69 0.95 0.00 0.00 84 S 8.69 4.64 0.00 3.76 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 8.28 4.72 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 86 S 8.85 4.62 0.00 3.76 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 87 K 7.46 4.67 0.00 1.86 1.90 0.00 1.47 0.00 0.00 1.95 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.27 1.50 7.81 88 S 8.70 5.31 0.00 3.94 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 89 I 9.06 4.61 2.07 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 1.25 0.95 1.15 0.00 0.00 90 V 8.46 4.24 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 0.61 0.00 0.00 0.77 0.00 0.00 91 H 8.59 3.48 0.00 2.85 3.06 0.00 5.66 0.00 0.00 0.00 0.00 6.65 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 4.25 0.00 2.14 2.17 0.00 2.57 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 1.52 1.85 0.00 93 S 7.77 4.71 0.00 3.93 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 7.95 4.32 0.00 2.98 2.81 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 95 N 8.12 4.55 0.00 2.58 2.44 0.00 0.00 6.55 7.58 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 96 S 7.69 3.86 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 97 N 8.25 4.40 0.00 2.78 2.79 0.00 0.00 6.75 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 98 T 7.65 4.07 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 1.10 0.00 0.00 99 L 7.81 3.74 0.00 1.44 1.88 0.88 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.65 4.49 0.00 2.73 2.64 0.00 0.00 7.28 6.64 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 0.00 101 N 8.67 4.62 0.00 3.08 2.64 0.00 0.00 7.25 8.27 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 0.00 102 D 7.88 4.70 0.00 3.09 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 4.81 1.52 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 1.41 1.16 0.11 0.00 0.00 104 M 9.10 5.43 0.00 2.14 1.83 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 2.68 2.66 0.00 105 L 9.20 5.43 0.00 1.72 1.80 -0.00 0.85 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 0.00 106 I 9.13 5.02 1.93 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.84 0.89 0.00 0.00 107 K 8.74 3.80 0.00 0.79 1.09 0.00 1.35 0.00 0.00 1.36 0.00 0.00 2.64 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.71 0.21 7.81 108 L 8.12 4.59 0.00 1.54 1.55 0.98 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.91 4.08 0.00 1.67 1.83 0.00 1.61 0.00 0.00 1.67 0.00 0.00 2.90 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.42 1.56 7.81 110 S 7.40 4.63 0.00 3.83 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 A 8.34 4.46 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 A 8.91 4.33 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 0.00 113 S 8.93 4.62 0.00 3.74 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 0.00 114 L 8.52 4.49 0.00 1.65 1.62 0.96 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.74 4.78 0.00 2.89 2.92 0.00 0.00 6.97 8.30 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 0.00 116 S 8.85 4.15 0.00 3.89 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 R 8.42 4.11 0.00 1.94 1.99 0.00 3.16 0.00 0.00 3.21 7.36 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.56 4.53 0.00 4.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 C 8.36 4.49 0.00 2.93 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 A 7.90 4.54 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 8.05 4.27 0.00 3.93 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 *132 A 8.19 4.26 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 0.00 133 G 8.95 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 0.00 134 T 7.70 4.00 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 135 Q 8.55 4.81 0.00 1.93 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.80 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 136 C 9.20 5.26 0.00 2.74 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 L 8.98 5.20 0.00 1.75 1.56 1.04 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.13 5.22 1.88 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 1.43 0.99 0.00 0.00 139 S 8.81 4.94 0.00 3.51 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 0.00 140 G 7.43 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 0.00 0.00 0.00 141 W 8.49 4.90 0.00 3.22 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 0.00 142 G 8.30 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 0.00 143 N 8.31 3.57 0.00 2.19 2.58 0.00 0.00 7.32 8.50 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 0.00 144 T 8.14 5.11 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 1.24 0.00 0.00 145 K 7.79 4.66 0.00 1.77 1.71 0.00 1.74 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.28 1.33 7.81 146 S 8.66 4.33 0.00 3.86 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 S 8.82 4.47 0.00 3.81 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 0.00 148 G 7.33 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 0.00 0.00 0.00 0.00 149 T 7.72 4.78 4.32 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 1.50 0.00 0.00 150 S 9.23 4.43 0.00 3.84 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 0.00 151 Y 8.77 4.85 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 0.00 152 P 0.00 4.72 0.00 2.40 2.09 0.00 4.07 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 2.13 2.01 0.00 153 D 8.63 4.94 0.00 2.68 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 7.72 5.53 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 8.28 3.29 0.00 1.38 1.25 -0.71 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.15 4.93 0.00 1.69 1.49 0.00 1.60 0.00 0.00 1.56 0.00 0.00 2.82 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.46 7.81 157 C 8.56 5.28 0.00 1.48 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 0.00 158 L 8.54 4.97 0.00 1.70 1.44 1.03 0.76 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 0.00 159 K 8.91 5.20 0.00 1.81 1.81 0.00 1.87 0.00 0.00 1.77 0.00 0.00 2.74 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.64 7.81 160 A 9.20 4.87 1.19 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 0.00 0.00 161 P 0.00 5.07 0.00 2.03 2.10 0.00 3.16 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.78 0.00 162 I 8.33 4.35 1.88 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 1.03 0.49 0.79 0.00 0.00 163 L 8.56 4.93 0.00 1.65 1.59 0.92 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.43 4.33 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 8.71 4.47 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 8.07 4.18 0.00 4.05 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 7.92 4.45 0.00 4.02 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 C 8.08 4.33 0.00 3.23 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 0.00 169 K 8.31 4.02 0.00 1.85 1.91 0.00 1.80 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 1.60 7.81 170 S 8.28 4.27 0.00 4.05 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 7.60 3.90 1.01 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 0.00 0.00 172 Y 7.59 4.82 0.00 3.22 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 0.00 173 P 0.00 4.53 0.00 2.08 2.04 0.00 3.86 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.23 0.00 174 G 9.02 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 Q 8.21 4.57 0.00 2.47 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.35 6.56 0.00 0.00 0.00 0.00 0.00 2.29 2.59 0.00 176 I 7.86 4.45 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 1.87 0.95 0.99 0.00 0.00 177 T 8.18 4.66 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 1.28 0.00 0.00 178 S 8.55 4.39 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 8.22 4.95 0.00 3.10 3.11 0.00 0.00 6.64 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 0.00 180 M 7.85 5.61 0.00 1.80 1.98 0.00 0.00 0.00 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.61 0.00 181 F 8.63 5.07 0.00 3.09 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 0.00 182 C 9.06 5.60 0.00 2.96 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 A 9.40 4.98 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184A G 6.90 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 0.00 0.00 0.00 184 Y 8.34 4.67 0.00 3.07 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 0.00 185 L 8.67 4.14 0.00 1.73 1.73 0.92 0.87 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 0.00 186 E 8.18 4.07 0.00 2.10 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 0.00 2.38 2.29 0.00 187 G 7.77 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 188A G 8.84 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 K 7.11 4.88 0.00 1.44 1.76 0.00 0.93 0.00 0.00 1.35 0.00 0.00 2.16 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.43 1.24 7.81 189 D 8.61 4.61 0.00 2.80 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 8.76 4.99 0.00 4.00 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 0.00 191 C 9.32 4.78 0.00 2.92 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 0.00 192 Q 8.53 4.48 0.00 2.41 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.12 5.43 0.00 0.00 0.00 0.00 0.00 2.50 2.46 0.00 193 G 9.24 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 0.00 0.00 0.00 0.00 194 D 8.40 4.70 0.00 2.99 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 0.00 195 S 8.06 4.43 0.00 3.99 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 0.00 196 G 8.96 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 0.00 197 G 7.86 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 P 0.00 5.16 0.00 2.32 2.35 0.00 3.70 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.24 0.00 199 V 8.48 4.60 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.73 0.00 0.00 200 V 8.79 4.90 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.63 0.00 0.00 201 C 8.79 5.13 0.00 2.79 2.84 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 0.00 202 S 9.82 3.71 0.00 3.92 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 8.39 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 K 7.59 4.71 0.00 1.72 1.64 0.00 1.90 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.48 1.40 7.81 *209 L 8.25 4.29 0.00 1.51 1.64 1.02 0.75 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 8.81 4.56 0.00 1.98 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.33 0.00 0.00 0.00 0.00 0.00 2.42 2.34 0.00 211 G 7.98 5.38 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 0.00 212 I 8.22 5.19 1.93 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 1.30 0.83 0.97 0.00 0.00 213 V 9.03 3.66 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 0.92 0.00 0.00 1.19 0.00 0.00 214 S 8.51 4.83 0.00 3.90 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 0.00 215 W 7.47 4.95 0.00 3.30 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 G 7.92 3.57 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 0.00 217 S 8.27 4.69 0.00 4.26 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *219 G 8.07 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 0.00 220 C 8.17 4.96 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 9.03 3.92 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 Q 7.27 4.60 0.00 2.13 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 7.14 0.00 0.00 0.00 0.00 0.00 2.38 2.47 0.00 222 K 8.43 4.19 0.00 1.72 1.71 0.00 1.93 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.48 7.81 223 N 9.25 4.26 0.00 2.80 2.79 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 0.00 224 K 7.53 4.38 0.00 1.68 1.79 0.00 1.70 0.00 0.00 1.37 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.49 7.81 225 P 0.00 4.60 0.00 2.13 2.11 0.00 3.68 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 2.09 1.99 0.00 226 G 8.47 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 0.00 227 V 7.65 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 0.26 0.00 0.00 -0.75 0.00 0.00 228 Y 8.17 4.96 0.00 1.43 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 T 8.60 4.41 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 230 K 9.35 5.11 0.00 2.14 1.97 0.00 1.86 0.00 0.00 1.86 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.52 1.64 7.81 231 V 8.76 3.97 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 1.12 0.00 0.00 232 C 8.34 4.41 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 8.02 4.29 0.00 2.36 2.36 0.00 0.00 6.89 7.70 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 0.00 234 Y 7.96 4.83 0.00 3.15 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 V 8.04 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 1.12 0.00 0.00 1.11 0.00 0.00 236 S 8.09 4.12 0.00 3.97 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 237 W 8.30 4.15 0.00 3.48 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 8.21 3.01 2.00 0.00 0.00 1.00 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 1.04 0.73 0.00 0.00 239 K 8.09 3.73 0.00 1.72 1.78 0.00 1.64 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.61 7.81 240 Q 7.88 3.89 0.00 1.98 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.96 0.00 0.00 0.00 0.00 0.00 2.36 2.49 0.00 241 T 7.60 3.74 3.48 0.00 0.00 0.00 0.00 0.00 0.00 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 0.00 242 I 7.28 2.50 0.56 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.48 -0.37 0.00 0.00 243 A 7.41 4.07 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 0.00 244 S 7.28 4.67 0.00 3.79 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 7.86 4.70 0.00 3.01 3.00 0.00 0.00 6.93 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.