NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4541 8.1927 115.4266 58.1989 65.6088 172.7830 3 Q 4.1325 8.6861 124.0082 53.8262 29.7172 174.4850 4 P 4.4408 0.0000 0.0000 62.5169 32.9296 175.6398 5 D 4.4037 8.4625 121.7179 53.2577 41.4539 174.5408 6 P 4.2398 0.0000 0.0000 62.8744 31.7110 176.8582 7 K 4.3043 8.9559 121.8195 54.3583 33.2889 174.7030 8 P 4.2692 0.0000 0.0000 64.6412 31.4553 176.2383 9 D 4.4459 8.8221 120.0168 55.1205 38.7749 174.4239 10 E 4.1102 8.4990 121.8704 59.0081 29.8089 177.6906 11 L 4.3562 7.6043 117.2489 54.6007 42.2838 176.6646 12 H 4.4264 9.5649 120.5840 56.1423 29.4725 175.0584 13 K 4.8565 8.5369 122.8612 54.5515 33.2976 177.8698 14 S 4.3441 9.1605 119.4709 61.2584 63.1344 176.8264 15 S 4.2360 8.3809 115.0840 60.5766 62.9450 175.0619 16 K 4.2532 8.1880 119.2291 56.3547 32.3133 175.5543 17 F 5.0399 8.0832 123.0080 57.2649 39.5599 175.1374 18 T 4.2063 8.4132 117.5553 61.1200 69.3232 175.1105 19 G 3.8303 5.3967 110.9427 44.3011 0.0000 172.3805 20 L 4.2924 8.3127 120.4812 53.7414 42.2961 177.3597 21 M 4.2181 8.6492 123.6389 57.7568 32.1188 177.2612 22 E 3.8672 7.9317 119.6743 59.8628 29.4056 178.1928 23 Y 4.0568 7.8392 115.5991 60.3649 38.1952 177.4778 24 M 3.8674 7.4503 119.1443 57.9737 32.3964 177.5420 25 K 4.0026 7.8546 119.8459 59.9967 32.1179 178.9580 26 V 4.3296 7.4975 111.8331 63.3093 31.5099 178.1141 27 L 4.2763 7.9726 118.1406 56.5715 41.2244 177.1686 28 Y 4.9298 8.0261 116.1232 57.7930 38.8112 175.8382 29 D 5.0521 7.9146 121.5722 53.5245 42.9994 176.4059 30 D 4.7316 8.9068 118.4912 57.7714 40.9823 176.9165 31 N 4.8001 7.5630 116.3402 52.9088 39.5219 173.6265 32 H 4.6392 7.7829 115.2184 55.7908 31.3022 172.8813 33 V 4.1747 8.1097 119.8023 62.0132 32.7838 174.8550 34 S 5.1898 8.2565 120.3676 57.1607 65.9564 172.9316 35 A 4.7534 8.9748 122.8833 50.8908 23.0027 174.9903 36 I 4.7071 7.9177 120.0127 59.6869 40.2460 175.3976 37 N 4.1596 8.9290 125.1780 55.0948 37.4076 173.1562 38 V 4.7630 8.2865 112.8354 59.4303 35.8577 175.3525 39 K 4.9224 8.2514 121.6867 53.9985 34.8343 176.2072 40 S 3.4416 8.4385 119.9737 58.6374 63.0619 173.9372 41 I 4.3516 7.6609 114.2364 60.7846 38.8197 173.8469 42 D 4.4506 7.4568 121.4130 54.5057 44.7811 173.3026 43 Q 4.5419 8.3461 119.5691 55.5069 31.3534 172.9217 44 F 4.6896 9.9495 129.3962 59.1551 40.6956 175.8752 45 L 4.4110 8.1683 119.2061 52.2049 44.0673 177.3029 46 Y 4.2150 8.2747 117.5476 59.2538 38.0832 176.8671 47 F 4.8517 6.7905 114.7032 56.1891 38.3193 174.0036 48 D 5.5357 7.3304 119.7517 51.8704 42.5129 174.9714 49 L 4.7726 8.9024 117.9096 53.0377 46.2478 175.6878 50 I 4.6578 8.2189 122.8608 59.6580 40.0528 174.2323 51 Y 4.8275 8.8051 123.8616 56.0475 41.3897 175.6873 52 S 5.0501 8.6401 119.0979 56.5793 61.7130 171.4684 53 I 4.4569 7.7613 125.4358 60.2462 38.8498 175.0929 54 K 4.3061 8.6290 129.0451 55.6591 33.4118 176.9368 55 D 4.1680 8.2601 127.4458 53.4046 39.2160 176.5672 56 T 3.8774 7.8484 114.5718 63.3314 69.7109 176.9503 57 K 4.0590 8.1345 122.8881 58.8200 32.3505 177.2433 58 L 4.5121 8.1816 115.2477 53.4060 43.5094 177.2059 59 G 3.7937 8.2212 106.2424 46.5308 0.0000 174.5847 60 N 4.5832 8.5969 119.4198 54.7046 39.2782 174.3735 61 Y 5.1010 6.9551 114.8138 56.1491 40.9910 174.8475 62 D 5.0064 9.1627 118.3438 54.3318 43.2579 176.0435 63 N 5.4242 8.2846 114.2347 51.4445 43.6694 173.4085 64 V 4.5738 8.7283 120.6725 61.1137 34.9934 174.0653 65 R 4.3029 8.3083 128.2959 54.7251 31.8072 174.7902 66 V 4.3308 8.8480 127.1831 61.2449 33.4137 173.7109 67 E 4.7716 8.4110 129.7481 54.6952 31.4186 174.9857 68 F 5.4163 9.1598 125.4485 55.4836 41.5812 175.9240 69 K 4.1055 9.0216 121.0894 58.8445 32.0370 176.4667 70 N 4.8819 7.7571 114.8022 50.8681 40.8774 174.9851 71 K 4.4765 8.8337 121.4047 59.8323 32.1919 178.4285 72 D 4.3358 8.1948 118.8314 57.2388 40.6596 178.4963 73 L 3.7022 8.4195 119.3326 57.6602 41.6686 179.4771 74 A 3.8814 7.5035 119.2706 55.2625 18.1158 179.4322 75 D 4.2777 8.1943 116.7905 57.3035 40.9229 178.6106 76 K 3.8220 7.8581 119.4689 59.1710 32.4789 177.7566 77 Y 4.4888 7.4134 115.2944 58.5169 38.0426 177.4036 78 K 3.8743 7.6759 120.7270 58.8350 32.3313 177.3142 79 D 4.9246 7.9238 116.6491 53.9241 41.7064 175.6070 80 K 4.7541 7.7924 117.5576 54.6834 34.8841 176.1108 81 Y 4.3494 8.6237 121.2358 58.1751 38.9844 175.1698 82 V 5.1668 9.3284 117.1927 59.8197 36.7524 174.1054 83 D 5.3739 9.2186 121.1565 52.8437 43.8751 176.0492 84 V 4.8417 8.5476 120.4637 61.2048 35.2072 174.3047 85 F 4.8570 8.9474 129.5359 57.1526 42.8898 173.1380 86 G 4.2700 8.2469 111.3084 45.2372 0.0000 171.7463 87 A 4.7074 8.8672 123.8824 51.0141 19.0786 176.9771 88 N 5.1049 8.6754 119.9704 51.3600 40.9978 172.9724 89 Y 4.9655 8.4685 116.9010 55.6997 41.4934 175.6138 90 Y 4.3282 8.8494 115.5801 58.5840 40.6650 175.2732 91 Y 4.4393 8.6988 120.5322 58.7297 38.7907 174.9914 92 Q 3.2193 8.2105 126.3834 56.7209 26.5617 174.2983 93 C 4.6045 8.2775 118.2361 56.2248 43.7464 172.0166 94 Y 4.6974 8.2544 127.0740 56.3590 41.4335 173.2827 95 F 3.6165 6.0497 118.5118 55.5559 40.3114 174.3653 96 S 4.1235 5.8624 118.0588 58.1978 61.6548 173.3053 97 S 4.8412 7.9106 127.8790 58.5831 62.2432 177.4303 *109 K 4.1101 6.8254 120.8850 51.7855 33.9535 175.2113 110 R 4.3534 8.0089 112.0537 56.5660 28.2136 175.7605 111 K 5.2370 7.4253 113.6665 55.0303 35.7413 175.3717 112 T 4.3844 8.3067 115.5184 60.7281 71.5917 171.7049 113 C 5.2202 7.8675 120.7636 55.4773 46.0889 173.1854 114 M 4.7554 8.1738 117.9230 54.7563 34.8881 172.5628 115 Y 4.7938 8.3013 115.6021 56.6063 40.8323 177.9696 116 G 3.4333 9.1795 111.8608 48.6371 0.0000 174.8602 117 G 4.0679 8.9057 111.8285 46.1546 0.0000 171.6280 118 V 4.8825 8.2934 119.8123 60.9263 33.4330 175.1974 119 T 4.7034 8.5043 116.8617 59.4618 72.3455 172.9571 120 E 4.3215 8.9987 124.7854 57.1373 30.4114 176.2446 121 H 4.3341 9.6129 127.0337 59.2239 30.3693 175.1247 122 N 4.5992 8.0291 116.0397 54.5516 38.7448 175.6985 123 G 3.9525 9.0784 111.5778 45.3267 0.0000 173.1228 124 N 4.7763 7.9133 116.4444 53.1520 39.6290 173.5217 125 Q 4.6617 7.7645 116.5085 55.5841 29.7845 175.5110 126 L 4.4233 8.2932 123.3651 53.9170 42.8190 177.0047 127 D 4.4810 8.5360 120.9393 56.4457 41.1626 177.1200 128 K 4.6585 7.4893 115.7689 53.9668 35.8307 175.3438 129 Y 4.2699 8.5067 118.8575 58.8943 38.6317 175.7559 130 R 4.6876 9.2148 123.7915 54.9057 32.5699 175.0656 131 S 5.2214 8.6025 121.2551 57.6876 64.6607 173.5560 132 I 4.5716 8.5980 123.9525 59.7634 40.8208 174.7261 133 T 4.5523 8.3751 123.4835 62.3715 70.1047 173.5553 134 V 4.4087 8.3625 126.6619 61.0609 33.7018 174.3728 135 R 4.5770 8.5910 127.2999 54.3531 32.5327 174.9900 136 V 4.4105 8.4140 125.0202 61.2683 33.5692 174.3479 137 F 5.0894 9.0030 126.7108 55.6222 41.8941 174.1465 138 E 4.9738 9.1201 122.9947 55.0790 32.1062 176.1645 139 D 4.4437 10.1488 126.1038 55.3340 39.1874 174.9825 140 G 4.0817 8.7684 105.3224 45.1928 0.0000 173.7578 141 K 4.6165 8.0983 120.3379 54.3808 33.8299 175.8654 142 N 4.7616 8.3597 122.4145 52.8605 36.6436 173.9223 143 L 4.2791 7.7448 122.0210 55.0893 42.9881 176.7553 144 L 4.7703 7.3116 120.2755 53.5073 45.5393 174.8633 145 S 5.1950 8.5701 120.7360 57.0305 67.0064 172.8220 146 F 4.7960 8.3512 116.4263 56.2256 41.1606 172.3883 147 D 5.2124 8.6158 118.2128 52.7078 43.9210 176.0027 148 V 4.5208 8.4040 114.1133 59.8600 35.2045 174.6327 149 Q 5.2439 8.4718 119.4919 54.8601 32.5028 174.7749 150 T 4.8892 8.9153 115.1773 60.4206 71.7633 173.0795 151 N 5.1696 8.7393 121.6566 52.6051 38.3989 173.3917 152 K 4.8859 7.7412 118.1491 55.7728 34.0973 176.9082 153 K 4.1099 9.3556 125.2661 59.2593 32.7715 176.6929 154 K 5.0976 8.0749 118.3809 54.7644 33.4779 175.9537 155 V 4.6498 8.7481 125.1481 59.6325 34.6708 175.7073 156 T 4.3955 8.3779 112.2298 61.2877 69.7850 175.3476 157 A 3.7026 8.9006 125.8217 55.0522 18.2359 179.8967 158 Q 3.4230 8.1302 117.8280 59.3528 28.9456 178.1622 159 E 3.7376 8.0312 119.8914 59.4490 29.5237 178.8655 160 L 4.0784 7.7219 118.7490 57.7180 41.6351 179.1108 161 D 4.6501 8.9937 118.4971 57.6651 41.2747 177.5038 162 Y 4.6589 8.8126 120.4833 61.0860 38.7513 178.1487 163 L 4.0812 8.4595 119.8165 58.1129 41.7740 179.7445 164 T 4.1297 8.3675 115.7720 67.0137 68.5076 177.1484 165 R 3.9313 8.5505 120.3422 59.1487 29.9522 178.4669 166 H 4.2813 8.4347 120.0110 58.7882 29.7586 176.6320 167 Y 3.7866 7.8670 120.8714 60.7373 38.5399 178.0257 168 L 3.9176 7.8865 119.7953 57.4698 41.3543 179.7764 169 V 3.5650 8.1800 118.7527 65.9116 31.3143 178.1918 170 K 3.8331 7.5992 116.7622 59.1368 31.9918 178.2575 171 N 4.6415 7.7493 113.7708 53.0766 39.5875 175.7923 172 K 4.5168 7.5440 116.6809 54.7522 33.8051 175.9228 173 K 3.9263 7.7452 116.8257 56.6742 30.3232 176.3567 174 L 4.1238 8.2442 120.9692 57.8220 41.9629 176.5135 175 Y 4.9932 7.5020 113.1613 56.1617 40.7514 174.2917 176 E 4.8987 8.6152 121.9482 54.0866 33.7192 175.7455 177 F 4.7166 9.0300 120.0088 60.7134 39.1470 176.2747 178 N 4.6677 7.8877 114.5037 52.5993 39.8727 172.5260 179 N 4.7144 7.6318 112.3112 52.4765 42.4920 173.0431 180 S 5.1736 8.2766 113.0124 55.9316 65.3545 172.2659 181 P 4.2015 0.0000 0.0000 64.2679 31.3376 175.9161 182 Y 4.8662 7.5887 116.2903 56.4577 39.5449 175.7296 183 E 4.4121 9.9835 125.5150 58.2852 30.8813 176.2094 184 T 5.1453 8.0106 107.9650 60.1715 73.0307 172.7153 185 G 4.5898 8.3444 106.4550 45.5835 0.0000 171.8492 186 Y 5.6098 8.8144 121.1961 55.1478 42.1612 173.5710 187 I 4.6961 8.9708 121.4030 59.0911 40.7814 173.9308 188 K 5.0149 9.0117 130.5195 54.5970 35.2185 174.3287 189 F 4.9108 8.6017 125.8771 55.6377 41.6468 174.6338 190 I 4.6642 8.8746 124.2767 59.7575 40.3058 174.0707 191 E 4.8750 9.4869 129.8842 54.3874 30.4276 178.0769 192 N 4.0547 8.8696 126.2060 54.1955 38.2317 176.8551 193 E 4.1603 9.2727 127.6562 58.2931 30.1045 175.4040 194 N 5.4297 8.5917 118.8788 50.9645 40.5085 173.3725 195 S 5.7940 8.6690 118.9430 56.3339 66.9833 172.6119 196 F 5.4330 8.1529 115.1271 56.2444 40.9101 172.3380 197 W 5.6264 8.9009 116.0461 55.5217 31.4981 173.5600 198 Y 5.3086 9.3328 118.3062 56.2874 41.1878 174.5199 199 D 5.2668 9.2508 122.9789 54.8404 41.7225 175.8494 200 M 4.7352 9.6307 125.3673 56.2675 32.7103 176.1545 201 M 4.6782 8.6715 119.3201 52.4322 34.3060 174.2233 202 P 4.2463 0.0000 0.0000 62.0761 32.0661 176.2304 203 A 3.6717 8.4419 123.3863 51.3705 18.8862 175.8270 204 P 4.5604 0.0000 0.0000 63.4787 32.1545 175.4088 205 G 3.8985 7.7613 105.7708 44.2933 0.0000 173.9926 206 D 4.6290 8.5615 116.7373 51.8597 39.7699 175.7467 207 K 4.7460 7.8095 117.8071 54.7213 35.6923 175.3407 208 F 4.6988 8.6127 122.9035 56.1847 41.0243 174.9868 209 D 4.3406 7.9933 128.5463 52.9469 41.3668 176.4108 210 Q 3.4671 8.0340 127.1644 58.8029 28.8007 178.4298 211 S 3.6154 7.5831 113.5629 61.2569 62.0776 176.0658 212 K 3.7935 7.9199 120.7999 59.3075 32.2307 177.9659 213 Y 4.0208 7.7454 119.9102 60.7161 38.8264 177.9807 214 L 3.8965 8.2762 119.9109 57.5914 41.5997 179.0267 215 M 2.5500 7.0522 118.4480 57.5591 31.6951 177.8202 216 M 3.7165 6.8626 115.8015 57.9783 31.4245 177.2107 217 Y 4.5270 7.5504 117.0376 58.5403 38.2120 176.4545 218 N 4.7251 8.2434 119.0289 54.4911 37.6368 176.0606 219 D 4.5809 8.0694 117.5638 53.4338 40.0133 175.5549 220 N 4.2751 8.2690 117.3858 54.2930 38.1657 173.6010 221 K 4.1909 8.3305 117.3885 56.4072 33.2017 175.2133 222 M 5.4133 8.5500 123.2603 53.7518 34.8568 174.5023 223 V 4.6480 8.6804 111.4342 59.5099 37.1675 174.3635 224 D 5.0179 9.5456 123.7375 53.9422 41.3319 177.3430 225 S 4.2242 9.2160 122.4940 61.2260 62.9711 175.9591 226 K 4.1058 8.7160 121.4708 58.3966 32.0652 176.9077 227 D 4.8668 7.7725 116.1190 54.0380 42.5065 176.8679 228 V 4.3786 7.6163 118.7369 61.3708 32.5911 175.5020 229 K 4.7552 9.0247 120.6834 55.4765 36.7634 174.7557 230 I 4.7577 8.3393 120.8559 59.4476 40.7608 174.5230 231 E 4.9248 8.9549 125.5382 54.3861 33.1275 174.8755 232 V 4.4461 8.4086 124.1730 61.1354 34.3995 173.6686 233 Y 4.7266 8.4550 126.0196 56.2602 40.0375 174.7025 234 L 5.3533 8.9283 125.0535 52.9127 45.4158 175.7905 235 T 5.2267 8.7784 111.9804 60.3097 71.8807 174.1379 236 T 4.5563 9.0509 115.0913 60.6412 71.0697 174.5410 237 K 4.4338 8.3233 118.9526 56.4258 32.1757 177.2907 238 K 4.1715 7.7926 124.5747 56.7705 31.9199 176.8401 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 2 S 8.19 4.45 0.00 4.07 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 3 Q 8.69 4.13 0.00 2.09 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.82 0.00 0.00 0.00 0.00 0.00 2.44 2.33 0.00 4 P 0.00 4.44 0.00 2.18 2.02 0.00 3.79 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 2.07 2.15 0.00 5 D 8.46 4.40 0.00 2.53 2.28 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 6 P 0.00 4.24 0.00 1.21 1.13 0.00 2.51 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.44 0.00 7 K 8.96 4.30 0.00 1.75 1.70 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.64 1.56 7.81 8 P 0.00 4.27 0.00 2.02 1.99 0.00 3.80 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 2.01 2.08 0.00 9 D 8.82 4.45 0.00 2.81 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 E 8.50 4.11 0.00 1.95 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 2.46 2.36 0.00 11 L 7.60 4.36 0.00 1.68 1.64 0.82 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 12 H 9.56 4.43 0.00 3.20 3.43 0.00 5.65 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.54 4.86 0.00 1.88 2.14 0.00 1.72 0.00 0.00 2.02 0.00 0.00 2.98 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.51 1.47 7.81 14 S 9.16 4.34 0.00 4.11 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 15 S 8.38 4.24 0.00 4.05 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 16 K 8.19 4.25 0.00 2.05 1.93 0.00 1.69 0.00 0.00 1.63 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.41 7.81 17 F 8.08 5.04 0.00 2.96 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 18 T 8.41 4.21 4.08 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 1.13 0.00 0.00 19 G 5.40 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 20 L 8.31 4.29 0.00 1.91 1.74 0.78 0.15 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 21 M 8.65 4.22 0.00 2.33 2.21 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.97 0.00 22 E 7.93 3.87 0.00 1.97 1.58 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 2.26 2.21 0.00 23 Y 7.84 4.06 0.00 3.41 3.39 0.00 0.00 0.00 0.00 0.00 0.00 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 M 7.45 3.87 0.00 1.38 0.60 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.29 0.00 25 K 7.85 4.00 0.00 1.95 2.01 0.00 1.88 0.00 0.00 1.91 0.00 0.00 3.09 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.73 1.71 7.81 26 V 7.50 4.33 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 1.26 0.00 0.00 1.09 0.00 0.00 27 L 7.97 4.28 0.00 1.47 1.40 1.21 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 28 Y 8.03 4.93 0.00 3.30 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 29 D 7.91 5.05 0.00 2.99 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 D 8.91 4.73 0.00 2.79 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 31 N 7.56 4.80 0.00 2.87 2.85 0.00 0.00 6.85 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 32 H 7.78 4.64 0.00 2.48 2.48 0.00 5.12 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 V 8.11 4.17 1.80 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 0.76 0.00 0.00 0.57 0.00 0.00 34 S 8.26 5.19 0.00 3.88 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 35 A 8.97 4.75 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 I 7.92 4.71 1.91 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 1.30 0.77 1.03 0.00 0.00 37 N 8.93 4.16 0.00 2.45 2.75 0.00 0.00 7.03 7.20 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 38 V 8.29 4.76 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 0.72 0.00 0.00 0.95 0.00 0.00 39 K 8.25 4.92 0.00 0.79 1.19 0.00 1.57 0.00 0.00 1.10 0.00 0.00 2.88 0.00 0.00 2.49 0.00 0.00 0.00 0.00 1.05 1.21 7.81 40 S 8.44 3.44 0.00 3.51 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 41 I 7.66 4.35 1.82 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 1.09 0.63 0.91 0.00 0.00 42 D 7.46 4.45 0.00 2.63 2.43 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 43 Q 8.35 4.54 0.00 1.98 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.68 0.00 0.00 0.00 0.00 0.00 2.19 2.63 0.00 44 F 9.95 4.69 0.00 2.72 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 45 L 8.17 4.41 0.00 0.53 0.87 0.74 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 46 Y 8.27 4.22 0.00 3.07 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 47 F 6.79 4.85 0.00 3.37 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 48 D 7.33 5.54 0.00 2.60 2.29 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 49 L 8.90 4.77 0.00 1.69 1.23 1.16 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 50 I 8.22 4.66 1.68 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 0.44 0.47 0.80 0.00 0.00 51 Y 8.81 4.83 0.00 2.81 2.74 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 52 S 8.64 5.05 0.00 3.91 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 53 I 7.76 4.46 1.96 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 1.26 0.71 1.00 0.00 0.00 54 K 8.63 4.31 0.00 1.74 1.68 0.00 1.70 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.35 1.39 7.81 55 D 8.26 4.17 0.00 1.58 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 T 7.85 3.88 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 1.18 0.00 0.00 57 K 8.13 4.06 0.00 1.71 1.82 0.00 1.72 0.00 0.00 1.86 0.00 0.00 2.99 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.41 1.45 7.81 58 L 8.18 4.51 0.00 1.78 1.61 1.01 1.00 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 59 G 8.22 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 60 N 8.60 4.58 0.00 3.02 2.95 0.00 0.00 6.57 7.02 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 61 Y 6.96 5.10 0.00 3.14 3.12 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 62 D 9.16 5.01 0.00 2.60 2.74 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 63 N 8.28 5.42 0.00 2.78 2.79 0.00 0.00 6.55 7.68 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 64 V 8.73 4.57 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 0.73 0.00 0.00 0.65 0.00 0.00 65 R 8.31 4.30 0.00 0.67 1.13 0.00 2.55 0.00 0.00 2.87 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.06 0.00 66 V 8.85 4.33 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 0.35 0.00 0.00 0.78 0.00 0.00 67 E 8.41 4.77 0.00 1.94 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 2.59 2.76 0.00 68 F 9.16 5.42 0.00 3.17 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 K 9.02 4.11 0.00 1.97 1.91 0.00 1.83 0.00 0.00 1.77 0.00 0.00 3.03 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.34 7.81 70 N 7.76 4.88 0.00 3.07 2.91 0.00 0.00 5.91 7.17 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 71 K 8.83 4.48 0.00 2.28 1.98 0.00 1.57 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.77 1.95 7.81 72 D 8.19 4.34 0.00 2.95 2.66 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 73 L 8.42 3.70 0.00 1.69 0.91 1.16 0.70 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 74 A 7.50 3.88 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 75 D 8.19 4.28 0.00 2.80 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 76 K 7.86 3.82 0.00 1.50 1.43 0.00 1.47 0.00 0.00 0.99 0.00 0.00 2.62 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.38 1.07 7.81 77 Y 7.41 4.49 0.00 3.02 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 78 K 7.68 3.87 0.00 1.89 1.82 0.00 1.71 0.00 0.00 1.66 0.00 0.00 3.11 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.43 7.81 79 D 7.92 4.92 0.00 2.64 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 K 7.79 4.75 0.00 1.92 1.85 0.00 1.73 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.42 1.39 7.81 81 Y 8.62 4.35 0.00 3.10 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 V 9.33 5.17 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 0.91 0.00 0.00 1.00 0.00 0.00 83 D 9.22 5.37 0.00 2.55 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 V 8.55 4.84 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 0.73 0.00 0.00 0.33 0.00 0.00 85 F 8.95 4.86 0.00 3.15 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 86 G 8.25 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 0.00 0.00 0.00 0.00 87 A 8.87 4.71 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 88 N 8.68 5.10 0.00 2.34 2.59 0.00 0.00 5.73 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 89 Y 8.47 4.97 0.00 3.03 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 90 Y 8.85 4.33 0.00 3.17 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 91 Y 8.70 4.44 0.00 3.09 3.10 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.59 0.00 111 K 7.43 5.24 0.00 1.30 1.34 0.00 0.82 0.00 0.00 0.61 0.00 0.00 2.48 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.67 1.26 7.81 112 T 8.31 4.38 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 -0.06 0.00 0.00 113 C 7.87 5.22 0.00 1.26 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 0.00 0.00 0.00 0.00 114 M 8.17 4.76 0.00 1.80 1.99 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.32 0.00 115 Y 8.30 4.79 0.00 2.94 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 0.00 116 G 9.18 3.43 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 0.00 117 G 8.91 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.29 4.88 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 0.31 0.00 0.00 0.89 0.00 0.00 119 T 8.50 4.70 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 0.00 120 E 9.00 4.32 0.00 2.22 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.47 0.00 121 H 9.61 4.33 0.00 3.35 3.46 0.00 5.84 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 N 8.03 4.60 0.00 2.80 2.78 0.00 0.00 7.06 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 0.00 123 G 9.08 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 0.00 124 N 7.91 4.78 0.00 2.83 2.89 0.00 0.00 7.04 6.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 Q 7.76 4.66 0.00 2.02 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.84 6.74 0.00 0.00 0.00 0.00 0.00 2.28 2.17 0.00 126 L 8.29 4.42 0.00 1.55 1.61 0.91 1.26 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 0.00 127 D 8.54 4.48 0.00 2.65 2.71 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 0.00 0.00 0.00 0.00 128 K 7.49 4.66 0.00 1.69 1.70 0.00 1.84 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.33 1.39 7.81 129 Y 8.51 4.27 0.00 2.94 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 0.00 130 R 9.21 4.69 0.00 1.86 1.80 0.00 3.09 0.00 0.00 3.27 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 131 S 8.60 5.22 0.00 3.79 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 0.00 132 I 8.60 4.57 1.84 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 1.23 0.82 0.93 0.00 0.00 133 T 8.38 4.55 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 1.04 0.00 0.00 134 V 8.36 4.41 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 0.27 0.00 0.00 135 R 8.59 4.58 0.00 1.64 1.39 0.00 3.08 0.00 0.00 3.07 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.37 0.00 136 V 8.41 4.41 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 1.00 0.00 0.00 137 F 9.00 5.09 0.00 2.57 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 0.00 138 E 9.12 4.97 0.00 1.92 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 2.19 2.24 0.00 139 D 10.15 4.44 0.00 2.81 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 G 8.77 4.08 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 0.00 141 K 8.10 4.62 0.00 1.93 1.73 0.00 1.69 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.41 1.39 7.81 142 N 8.36 4.76 0.00 1.66 2.44 0.00 0.00 7.34 7.78 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 0.00 143 L 7.74 4.28 0.00 1.62 1.66 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 144 L 7.31 4.77 0.00 1.70 1.40 1.03 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 145 S 8.57 5.19 0.00 3.63 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 F 8.35 4.80 0.00 2.55 2.72 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 0.00 147 D 8.62 5.21 0.00 2.56 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 V 8.40 4.52 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 0.91 0.00 0.00 149 Q 8.47 5.24 0.00 1.84 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.77 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 150 T 8.92 4.89 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 1.23 0.00 0.00 151 N 8.74 5.17 0.00 2.55 2.24 0.00 0.00 5.86 7.87 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 0.00 152 K 7.74 4.89 0.00 1.66 2.04 0.00 1.80 0.00 0.00 1.70 0.00 0.00 3.10 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.37 1.38 7.81 153 K 9.36 4.11 0.00 1.68 1.85 0.00 1.84 0.00 0.00 1.64 0.00 0.00 2.83 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.41 7.81 154 K 8.07 5.10 0.00 1.65 1.76 0.00 1.73 0.00 0.00 1.78 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.39 7.81 155 V 8.75 4.65 2.06 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 0.84 0.00 0.00 0.85 0.00 0.00 156 T 8.38 4.40 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 1.17 0.00 0.00 157 A 8.90 3.70 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 0.00 158 Q 8.13 3.42 0.00 1.69 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.82 0.00 0.00 0.00 0.00 0.00 2.15 1.16 0.00 159 E 8.03 3.74 0.00 1.74 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 1.80 1.47 0.00 160 L 7.72 4.08 0.00 2.13 1.99 1.05 1.28 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 0.00 161 D 8.99 4.65 0.00 3.56 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 0.00 162 Y 8.81 4.66 0.00 3.45 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 L 8.46 4.08 0.00 1.98 1.82 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 164 T 8.37 4.13 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 165 R 8.55 3.93 0.00 1.61 1.74 0.00 2.21 0.00 0.00 2.92 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.88 0.00 166 H 8.43 4.28 0.00 2.74 3.37 0.00 5.63 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 0.00 167 Y 7.87 3.79 0.00 2.94 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 0.00 168 L 7.89 3.92 0.00 1.79 1.58 0.89 0.85 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 0.00 169 V 8.18 3.56 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 1.09 0.00 0.00 1.13 0.00 0.00 170 K 7.60 3.83 0.00 1.60 1.64 0.00 1.66 0.00 0.00 1.61 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.46 7.81 171 N 7.75 4.64 0.00 2.15 2.51 0.00 0.00 6.87 7.17 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 0.00 172 K 7.54 4.52 0.00 1.82 1.89 0.00 1.86 0.00 0.00 1.71 0.00 0.00 3.24 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.30 1.51 7.81 173 K 7.75 3.93 0.00 1.84 1.86 0.00 1.70 0.00 0.00 1.60 0.00 0.00 2.83 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.36 1.32 7.81 174 L 8.24 4.12 0.00 1.32 1.35 0.59 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 175 Y 7.50 4.99 0.00 3.04 2.74 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 0.00 176 E 8.62 4.90 0.00 2.15 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 2.26 2.39 0.00 177 F 9.03 4.72 0.00 3.10 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 N 7.89 4.67 0.00 2.74 2.81 0.00 0.00 6.80 7.79 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 0.00 179 N 7.63 4.71 0.00 2.94 2.67 0.00 0.00 6.41 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 0.00 180 S 8.28 5.17 0.00 3.94 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 0.00 181 P 0.00 4.20 0.00 0.92 1.70 0.00 3.63 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 1.94 1.94 0.00 182 Y 7.59 4.87 0.00 2.89 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 E 9.98 4.41 0.00 2.10 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 2.35 2.21 0.00 184 T 8.01 5.15 4.33 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 1.34 0.00 0.00 185 G 8.34 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 0.00 0.00 0.00 0.00 186 Y 8.81 5.61 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 0.00 187 I 8.97 4.70 1.88 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.34 1.33 1.34 0.00 0.00 188 K 9.01 5.01 0.00 1.93 1.68 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.89 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.32 1.54 7.81 189 F 8.60 4.91 0.00 1.63 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 I 8.87 4.66 1.87 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 1.13 0.62 0.94 0.00 0.00 191 E 9.49 4.87 0.00 2.06 1.91 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 2.24 2.30 0.00 192 N 8.87 4.05 0.00 2.90 2.01 0.00 0.00 7.24 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 0.00 193 E 9.27 4.16 0.00 1.97 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 2.33 2.38 0.00 194 N 8.59 5.43 0.00 2.87 2.94 0.00 0.00 6.93 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 0.00 195 S 8.67 5.79 0.00 4.00 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 0.00 196 F 8.15 5.43 0.00 3.08 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 197 W 8.90 5.63 0.00 3.67 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 0.00 198 Y 9.33 5.31 0.00 3.21 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 0.00 199 D 9.25 5.27 0.00 3.09 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 0.00 200 M 9.63 4.74 0.00 2.07 2.28 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.98 2.69 0.00 201 M 8.67 4.68 0.00 2.05 2.23 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.82 2.74 0.00 202 P 0.00 4.25 0.00 1.20 0.82 0.00 3.61 0.00 0.00 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.74 0.00 203 A 8.44 3.67 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 0.00 204 P 0.00 4.56 0.00 2.25 2.14 0.00 3.72 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.03 0.00 205 G 7.76 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 206 D 8.56 4.63 0.00 2.78 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 K 7.81 4.75 0.00 1.73 1.67 0.00 1.58 0.00 0.00 1.55 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.30 1.29 7.81 208 F 8.61 4.70 0.00 2.84 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 0.00 209 D 7.99 4.34 0.00 2.60 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 210 Q 8.03 3.47 0.00 2.11 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.65 0.00 0.00 0.00 0.00 0.00 2.81 2.45 0.00 211 S 7.58 3.62 0.00 2.72 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 K 7.92 3.79 0.00 1.69 1.80 0.00 1.81 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.37 1.34 7.81 213 Y 7.75 4.02 0.00 3.00 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 0.00 214 L 8.28 3.90 0.00 2.14 2.13 1.26 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 215 M 7.05 2.55 0.00 1.71 1.55 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.20 0.00 216 M 6.86 3.72 0.00 1.66 1.65 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.48 0.00 217 Y 7.55 4.53 0.00 3.11 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 0.00 218 N 8.24 4.73 0.00 3.03 3.14 0.00 0.00 6.68 8.68 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 0.00 219 D 8.07 4.58 0.00 2.82 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 0.00 220 N 8.27 4.28 0.00 3.22 3.08 0.00 0.00 7.07 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 K 8.33 4.19 0.00 2.10 1.61 0.00 1.29 0.00 0.00 0.86 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.01 1.18 7.81 222 M 8.55 5.41 0.00 2.03 2.07 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.56 0.00 223 V 8.68 4.65 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 0.95 0.00 0.00 1.02 0.00 0.00 224 D 9.55 5.02 0.00 2.73 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 0.00 225 S 9.22 4.22 0.00 3.89 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 0.00 226 K 8.72 4.11 0.00 1.74 2.01 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.46 1.42 7.81 227 D 7.77 4.87 0.00 2.75 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 0.00 228 V 7.62 4.38 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 1.11 0.00 0.00 229 K 9.02 4.76 0.00 1.72 1.85 0.00 1.22 0.00 0.00 1.63 0.00 0.00 2.81 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.36 7.81 230 I 8.34 4.76 1.59 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 1.00 0.75 0.50 0.00 0.00 231 E 8.95 4.92 0.00 1.81 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.17 0.00 232 V 8.41 4.45 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 0.77 0.00 0.00 0.76 0.00 0.00 233 Y 8.46 4.73 0.00 1.90 2.60 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 0.00 234 L 8.93 5.35 0.00 1.35 1.02 -0.07 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 235 T 8.78 5.23 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 1.28 0.00 0.00 236 T 9.05 4.56 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 1.34 0.00 0.00 237 K 8.32 4.43 0.00 1.74 1.86 0.00 1.77 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.35 7.81 238 K 7.79 4.17 0.00 1.80 1.73 0.00 1.74 0.00 0.00 1.74 0.00 0.00 3.06 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.47 1.38 7.81 * Residues marked with a * may have inaccurate shift predictions.