NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2223 7.8827 121.4443 61.2003 38.7566 173.7765 17 V 4.3655 8.8401 125.8820 61.7359 32.6955 174.3046 18 G 3.9137 8.3845 114.4697 46.5921 0.0000 173.0817 19 G 4.3346 7.8957 110.7642 43.8018 0.0000 172.6921 20 Y 4.9701 7.9683 116.5352 55.1149 42.1727 174.9436 21 T 4.2417 8.5695 117.1596 63.9786 68.4607 175.0428 22 C 4.1257 8.5392 125.5326 61.0565 35.0094 174.5970 23 G 4.1224 8.6234 106.1880 43.6677 0.0000 172.8764 24 A 4.2961 8.5654 124.5706 52.8699 18.4595 176.9753 25 N 4.2475 8.8463 119.6944 54.6571 36.1631 175.4640 26 T 4.1844 7.5950 107.8851 62.7322 69.9996 175.0440 27 V 4.0843 7.0423 121.9549 59.7124 31.2626 173.6134 28 P 4.4998 0.0000 0.0000 64.3078 31.6532 178.1091 29 Y 4.9414 6.7404 114.7915 56.3043 38.7604 174.4582 30 Q 4.5918 7.4559 123.6839 56.2502 29.3259 175.4395 31 V 4.8676 9.0062 119.1964 59.6343 35.9770 174.2308 32 S 5.0445 8.7651 117.0487 56.5863 64.9589 172.7223 33 L 4.4665 8.7793 127.8941 53.6420 42.8678 175.0641 34 N 5.9119 9.0823 123.3167 50.2128 41.8786 175.0859 *37 S 4.3085 8.4424 119.9925 58.5833 64.2379 174.4505 38 G 4.0097 9.4791 110.2162 46.8810 0.0000 173.4960 39 Y 4.6031 6.5414 115.2577 55.9914 40.2365 172.8904 40 H 4.6552 8.8478 121.6583 56.1704 30.2814 174.6717 41 F 5.1012 8.0894 120.7535 57.2397 40.0638 174.1987 42 C 4.7057 6.9095 114.9486 56.1117 44.8656 173.3520 43 G 4.2748 8.6822 109.1787 45.5893 0.0000 172.3121 44 G 4.4706 7.5127 104.8580 46.5783 0.0000 172.6578 45 S 5.4312 8.7041 115.7654 56.4286 66.7420 173.6167 46 L 4.8211 9.1754 127.6584 54.7409 42.2339 177.1155 47 I 4.4455 8.6584 119.7985 60.8738 39.0545 174.9082 48 N 4.6975 7.8840 116.9373 51.7021 39.5142 175.1190 49 S 4.1924 8.6687 113.4304 61.2407 62.8652 175.2208 50 Q 4.5452 8.1681 118.9411 55.0458 31.2624 173.9839 51 W 5.5215 8.5408 117.2154 55.2582 33.4103 174.3516 52 V 5.0727 9.3117 123.8054 61.0520 34.4302 174.3512 53 V 4.9584 8.8856 126.9612 60.5365 34.0821 174.9461 54 S 4.7328 8.9534 116.7469 57.6699 66.1515 172.0132 55 A 4.5493 8.5105 121.1427 50.9007 19.8957 178.6056 56 A 3.7779 8.2620 124.6917 55.2232 18.4433 179.0388 57 H 4.5917 8.3031 109.4500 57.2851 28.6138 175.2958 58 C 4.7716 7.9504 117.2937 56.9664 40.6493 173.3345 59 Y 4.2142 7.6765 121.9894 58.0494 38.7358 175.2141 60 K 3.6983 7.0872 125.0666 55.4561 34.9267 174.2623 61 S 4.3827 8.0617 117.6227 57.9916 64.9302 173.4651 62 G 3.5924 8.3465 107.1699 46.5730 0.0000 173.8070 63 I 4.4820 7.3266 119.0623 59.8055 39.6498 175.9192 64 Q 4.7855 9.0305 128.6489 54.1960 31.5363 174.2227 65 V 4.3579 8.8958 127.3123 62.1166 33.3871 174.6004 66 R 5.2071 8.9495 127.3459 54.7147 32.2722 175.2856 67 L 4.7886 9.1489 124.5439 52.5910 45.1210 177.4370 *69 G 4.4374 8.2404 106.8217 45.4831 0.0000 172.6850 70 E 4.4959 8.2362 118.4310 55.2057 30.6511 173.9627 71 D 4.8043 8.1139 117.8848 54.9704 43.6416 174.4764 72 N 4.8769 8.2606 119.6365 52.8951 39.4270 175.9221 73 I 3.9446 8.4532 119.9370 62.2525 37.8395 176.2328 74 N 4.7819 8.7214 118.0385 53.0372 39.4146 174.7645 75 V 4.3212 7.4013 117.2679 60.6548 34.2858 175.0097 76 V 4.0688 8.4590 126.7630 62.7372 31.0393 175.2491 77 E 4.3652 9.3607 127.4709 55.9764 30.1231 177.2618 78 G 4.0384 8.3724 106.8812 45.1229 0.0000 173.8293 79 N 4.9893 8.0599 115.4599 52.9101 40.4289 174.1022 80 E 5.3662 7.8836 118.0865 55.5835 31.1935 176.3910 81 Q 4.2172 8.3556 119.6955 54.6062 32.8159 173.8947 82 F 5.5743 8.6467 123.6870 56.1299 40.6495 175.6640 83 I 4.6917 8.9190 124.8397 59.4649 40.9507 175.5272 84 S 4.6254 8.7241 122.2491 58.2585 64.2984 173.1676 85 A 4.6489 8.3257 125.0093 51.8510 18.6434 177.6914 86 S 4.4962 8.9043 116.3153 59.6307 64.8562 174.5633 87 K 4.6720 7.5722 119.6228 55.1035 35.5493 174.6228 88 S 5.3233 8.7914 121.5660 56.8685 66.3149 173.6422 89 I 4.6122 9.3027 124.5121 59.5726 40.1955 174.7347 90 V 4.2800 8.4923 127.5184 61.9850 32.7832 175.0646 91 H 3.3317 8.5849 126.8645 55.9349 29.9617 174.2220 92 P 4.2889 0.0000 0.0000 65.2876 31.1459 177.0388 93 S 4.7186 7.6956 113.4025 58.0010 63.0430 173.1671 94 Y 4.3019 7.9642 122.8040 57.6804 38.9307 174.2321 95 N 4.5276 8.4109 126.3676 51.3523 39.5578 175.1089 96 S 3.8713 7.6648 120.4052 59.7088 63.5038 175.2089 97 N 4.4079 8.2302 118.8936 55.2644 38.6642 176.1187 98 T 3.9565 7.7161 105.4189 60.8500 69.8505 175.2006 99 L 3.7657 7.9477 120.9324 55.2523 39.8430 173.8252 100 N 4.5122 7.6575 118.5226 54.5898 39.3659 174.7238 101 N 5.0010 8.7993 120.4308 54.5686 35.8197 175.3180 102 D 4.6358 8.0797 117.6228 53.2591 39.2543 174.3824 103 I 4.7721 7.0903 120.9018 59.4019 42.2699 172.7996 104 M 5.4238 9.2291 126.7894 54.2204 36.3853 173.1884 105 L 5.3937 9.4338 124.8284 53.1426 44.9214 175.3815 106 I 5.0174 9.3228 123.9776 59.4332 40.5386 174.2695 107 K 3.8548 8.7791 128.7861 54.4945 33.6852 175.5840 108 L 4.5564 8.1291 127.5232 54.0939 42.1146 177.4352 109 K 4.2235 8.7969 122.1917 58.9600 32.4687 177.5901 110 S 4.5964 7.6937 111.4728 55.9271 66.1441 173.1616 111 A 4.4341 8.3573 123.2338 51.7953 18.7787 177.4623 112 A 4.2603 8.9841 124.1516 51.9616 19.6239 177.7081 113 S 4.4825 9.1441 117.4639 57.3572 63.4177 174.3723 114 L 4.4897 8.4756 126.2656 54.1525 41.2118 176.2957 115 N 4.9653 8.8981 120.6592 51.6455 40.1502 174.6007 116 S 4.2836 8.7660 111.2218 61.2997 62.5660 175.6658 117 R 4.2453 7.6701 115.5227 56.4458 30.6323 175.8261 118 V 4.6128 8.4524 117.2716 60.8642 32.8118 173.5392 119 A 5.2173 8.3800 128.0662 49.9531 22.9045 174.9509 120 S 4.9603 8.7201 113.7561 57.7739 64.7900 173.1596 121 I 4.3729 8.6094 121.9697 59.4276 40.0176 175.0553 122 S 4.5155 8.3668 124.2681 58.1702 64.1723 173.8150 123 L 4.3514 8.3460 123.1575 53.5324 42.3602 175.3932 124 P 4.4879 0.0000 0.0000 63.0582 32.0915 176.3086 125 T 4.2076 8.2115 108.4466 62.1222 69.9507 174.3927 *127 S 4.4456 7.5492 115.1979 58.2332 64.0656 173.6555 128 C 4.4431 8.4060 118.2553 56.0115 40.8503 173.8642 129 A 4.1373 8.1748 127.1756 52.1391 18.7351 177.4281 130 S 4.2922 8.1973 117.3997 57.3651 64.4906 173.2476 *132 A 4.1458 8.1499 123.7325 53.5392 19.1848 176.8837 133 G 4.0253 8.9913 109.9728 45.4583 0.0000 174.4970 134 T 4.0592 7.4578 117.3876 63.5857 69.4935 173.9132 135 Q 4.5401 8.5830 125.2223 55.7203 29.8300 175.9225 136 C 5.2582 9.1783 120.2769 55.0545 46.3484 172.4914 137 L 5.1520 8.9898 123.3196 53.6398 43.6942 175.1250 138 I 5.1916 9.2372 127.4057 58.8959 40.1076 174.8680 139 S 4.8945 8.3676 118.8748 56.6047 66.4585 173.0874 140 G 3.7764 7.4917 108.7931 46.2151 0.0000 172.8798 141 W 4.7380 8.6461 116.9647 56.2935 29.3033 177.0991 142 G 4.0330 8.4424 109.1218 44.2657 0.0000 173.4600 143 N 3.5010 8.1736 118.2138 54.3407 38.8898 174.4721 144 T 5.0749 7.9377 112.7507 60.5211 69.5347 174.3140 145 K 4.6441 7.7722 121.4148 54.8291 34.6800 176.2227 146 S 4.3462 8.5664 116.4165 59.7565 63.7847 174.3274 147 S 4.3073 8.0808 115.7169 60.1729 65.0153 171.8174 148 G 3.7807 8.9320 111.1661 44.2827 0.0000 171.5392 149 T 4.8261 7.9155 113.8735 62.1032 72.6492 174.4431 150 S 4.4022 9.2035 118.1894 58.1766 65.5155 173.1082 151 Y 4.8149 8.8667 126.1100 56.0701 38.8437 174.2321 152 P 4.6770 0.0000 0.0000 62.5030 32.7981 175.8117 153 D 4.6888 8.6853 118.6463 55.4530 41.6844 176.6873 154 V 5.3215 7.4651 110.8531 58.2561 34.4869 175.5896 155 L 3.1987 8.6538 124.8425 55.1768 43.0929 175.7661 156 K 4.8361 8.1359 124.7929 54.8305 35.0608 174.5971 157 C 5.3087 8.6363 120.0178 55.1623 40.8618 172.9460 158 L 5.0003 8.6996 122.7396 53.8031 45.5331 174.2640 159 K 5.0838 9.0274 127.6177 55.3996 33.4461 175.3834 160 A 4.8563 9.3278 128.4305 49.9554 23.1045 173.5728 161 P 5.0127 0.0000 0.0000 62.0363 33.8445 175.1994 162 I 4.4292 8.3829 122.6600 61.3559 38.0928 175.7798 163 L 4.8305 8.7562 127.5157 53.2950 43.3179 176.9795 164 S 4.3718 8.0621 115.2227 58.1351 63.9453 175.2735 165 D 4.4489 8.7445 121.8017 57.4399 40.4402 179.2648 166 S 4.1321 8.0297 114.5951 61.6325 63.1116 176.6618 167 S 4.1046 7.8515 118.6000 60.7934 62.6750 175.6465 168 C 4.2822 8.2633 122.0830 59.6788 43.2925 175.7895 169 K 3.9980 8.3637 118.9631 59.6165 31.6607 179.3224 170 S 4.2756 8.2219 114.6991 61.2329 62.7748 176.1345 171 A 4.1194 7.7872 123.0287 53.4624 19.5848 177.2012 172 Y 4.7585 7.8549 114.7901 54.7800 38.2026 171.8807 173 P 4.4136 0.0000 0.0000 63.9347 32.1327 176.6328 174 G 4.0581 9.0556 110.4953 46.5408 0.0000 173.9180 175 Q 4.5359 8.0420 118.2124 55.3569 31.1427 176.0101 176 I 4.2073 7.9953 119.2089 60.7042 37.9858 175.4734 177 T 4.5916 8.2703 115.5199 59.5238 70.9408 175.3101 178 S 4.3493 8.5587 115.2301 60.3490 63.1619 174.4282 179 N 4.9664 8.1500 118.4802 53.3250 38.5093 173.8201 180 M 5.6376 7.9749 116.9931 53.8897 36.4010 174.6272 181 F 5.1110 8.7284 114.6214 55.9219 42.0188 172.6164 182 C 5.3889 9.0590 117.4588 56.0951 40.3885 172.4818 183 A 5.0421 9.1671 122.9818 50.6243 22.3379 175.4334 184 G 4.0197 6.9040 109.1028 44.8376 0.0000 172.5253 184A Y 4.6792 8.2807 119.7937 55.9882 41.3953 176.4510 185 L 4.2121 8.6524 124.5330 57.4789 42.0607 179.1319 186 E 3.8764 8.2320 117.2666 57.3163 29.7063 177.5413 187 G 3.7798 7.8358 106.4261 44.8000 0.0000 172.4717 188 G 4.0841 9.3467 105.9940 44.8354 0.0000 173.5461 188A K 4.8058 7.3445 117.3298 54.7844 35.7692 175.2781 189 D 4.6207 8.5775 123.2628 53.8219 45.7055 175.3901 190 S 4.7947 8.8513 117.3098 58.5413 64.9740 172.9647 191 C 4.7295 9.2910 118.3802 55.6762 44.4370 172.1791 192 Q 4.4121 8.6377 118.4423 57.9323 28.4758 177.7715 193 G 4.3545 9.3355 111.1730 45.5863 0.0000 173.7070 194 D 4.7381 8.3510 118.4103 54.6396 41.8363 176.5818 195 S 4.3648 8.0563 115.5517 60.4006 63.3934 175.7256 196 G 4.3234 8.6740 112.1653 46.3770 0.0000 173.7616 197 G 4.2779 8.0959 107.6838 45.5567 0.0000 171.3215 198 P 5.2034 0.0000 0.0000 62.2993 33.5996 175.6456 199 V 4.5986 8.4195 120.3974 61.4644 34.3114 173.8980 200 V 4.7699 8.6840 128.8739 61.4230 33.7188 173.9352 201 C 5.0778 8.5674 124.2637 55.7623 44.4903 174.5384 202 S 3.3271 9.6190 119.2212 59.7721 59.9569 173.1198 203 G 3.9138 8.4754 104.6346 45.8656 0.0000 174.0165 204 K 4.6950 7.5568 117.7186 52.9533 35.4251 175.3882 *209 L 4.2742 8.2303 121.5902 55.4808 42.3106 175.9354 210 Q 4.5531 9.0130 125.9641 56.5299 31.2585 175.7606 211 G 5.3111 8.0018 104.3538 45.7162 0.0000 171.4571 212 I 5.2043 8.1874 119.2231 58.9376 41.4271 175.1318 213 V 3.7145 8.8522 127.2799 64.1847 31.8020 174.2931 214 S 4.9884 8.4600 121.0344 58.4523 64.2738 174.0195 215 W 4.9177 7.4666 114.0038 55.7623 31.9721 172.3348 216 G 3.7869 8.3355 105.7041 46.1228 0.0000 174.1745 217 S 4.5789 8.8633 116.5388 57.0287 61.4332 173.5415 *219 G 4.2295 7.8124 116.0891 45.2262 0.0000 170.0245 220 C 4.8721 8.2059 115.8402 56.3340 44.8197 173.7979 221 A 4.2371 8.9770 125.7114 53.1060 16.7477 176.8277 221A Q 4.4630 7.3771 117.1402 56.3319 29.6871 176.0185 222 K 4.2204 8.4182 122.6657 57.9981 32.5893 176.6767 223 N 4.3702 9.4197 122.3349 53.7083 37.0310 175.1164 224 K 4.2295 7.5887 117.9574 53.5499 32.0382 173.5499 225 P 4.6234 0.0000 0.0000 61.9566 33.2346 176.9689 226 G 3.5615 8.4717 106.9802 45.9585 0.0000 172.8104 227 V 4.3206 7.7550 123.3528 60.7682 33.5530 174.1497 228 Y 4.8872 8.2234 124.9093 55.9507 41.8891 175.0787 229 T 4.4148 8.5064 119.6996 63.5356 70.0967 174.3921 230 K 5.0242 9.4768 128.5095 55.6159 31.3913 177.1769 231 V 3.9716 8.8711 126.7522 65.9301 31.3934 174.9583 232 C 4.3886 8.3216 112.5845 58.3503 41.4618 175.0188 233 N 4.1688 7.9878 117.2542 54.8329 38.4891 175.6736 234 Y 4.7690 8.0264 117.3789 57.5469 38.5776 177.2382 235 V 3.6848 7.9483 121.0315 66.4160 31.4169 177.9845 236 S 4.1116 8.0694 114.0925 61.3006 62.7662 176.2342 237 W 4.1914 8.3160 130.5367 60.4959 30.5626 177.7798 238 I 3.0182 8.2435 119.9902 64.1324 36.5954 178.4692 239 K 3.7484 8.0250 119.1915 59.5456 31.6892 179.3417 240 Q 3.8876 7.7806 116.7448 59.2226 28.9352 178.8262 241 T 3.7251 7.4220 116.5075 66.7197 68.5042 176.7024 242 I 2.6826 6.9855 121.1755 63.9650 36.7575 178.2785 243 A 4.2307 7.7020 120.1582 53.9199 18.1515 178.1851 244 S 4.7283 7.5532 111.5212 58.0563 64.0724 174.0019 245 N 4.6866 7.9860 122.8153 53.6710 39.4586 174.2027 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 4.22 1.79 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 1.36 0.56 0.88 0.00 0.00 17 V 8.84 4.37 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 0.93 0.00 0.00 0.88 0.00 0.00 18 G 8.38 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 G 7.90 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 0.00 0.00 0.00 0.00 20 Y 7.97 4.97 0.00 3.04 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 21 T 8.57 4.24 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 22 C 8.54 4.13 0.00 2.71 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 23 G 8.62 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 24 A 8.57 4.30 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 25 N 8.85 4.25 0.00 2.88 2.90 0.00 0.00 7.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 T 7.60 4.18 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 27 V 7.04 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 0.74 0.00 0.00 28 P 0.00 4.50 0.00 2.38 2.43 0.00 3.80 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 1.98 0.00 29 Y 6.74 4.94 0.00 3.28 3.42 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 30 Q 7.46 4.59 0.00 1.79 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.73 0.00 0.00 0.00 0.00 0.00 1.88 2.45 0.00 31 V 9.01 4.87 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 0.86 0.00 0.00 1.02 0.00 0.00 32 S 8.77 5.04 0.00 3.15 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 33 L 8.78 4.47 0.00 0.49 0.88 0.77 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 34 N 9.08 5.91 0.00 2.47 2.50 0.00 0.00 6.77 8.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *37 S 8.44 4.31 0.00 3.64 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 38 G 9.48 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 Y 6.54 4.60 0.00 3.07 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 40 H 8.85 4.66 0.00 2.87 3.19 0.00 5.86 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 8.09 5.10 0.00 3.13 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 C 6.91 4.71 0.00 2.19 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 43 G 8.68 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 44 G 7.51 4.47 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 0.00 0.00 0.00 0.00 0.00 0.00 45 S 8.70 5.43 0.00 3.81 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 46 L 9.18 4.82 0.00 1.87 1.68 1.05 1.27 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 8.66 4.45 1.89 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.28 0.95 0.00 0.00 48 N 7.88 4.70 0.00 2.94 2.97 0.00 0.00 5.99 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.67 4.19 0.00 4.04 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 50 Q 8.17 4.55 0.00 2.07 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.90 0.00 0.00 0.00 0.00 0.00 1.98 2.21 0.00 51 W 8.54 5.52 0.00 3.44 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 52 V 9.31 5.07 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 0.93 0.00 0.00 0.99 0.00 0.00 53 V 8.89 4.96 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 0.90 0.00 0.00 1.02 0.00 0.00 54 S 8.95 4.73 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 8.51 4.55 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 56 A 8.26 3.78 0.34 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 57 H 8.30 4.59 0.00 3.37 3.59 0.00 5.55 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.95 4.77 0.00 3.21 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 59 Y 7.68 4.21 0.00 3.00 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 60 K 7.09 3.70 0.00 1.26 1.17 0.00 0.75 0.00 0.00 1.23 0.00 0.00 2.61 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.89 1.01 7.81 61 S 8.06 4.38 0.00 3.94 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 G 8.35 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 I 7.33 4.48 1.88 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 1.39 0.66 0.96 0.00 0.00 64 Q 9.03 4.79 0.00 1.98 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.91 0.00 0.00 0.00 0.00 0.00 2.16 2.22 0.00 65 V 8.90 4.36 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.91 0.00 0.00 66 R 8.95 5.21 0.00 1.64 1.98 0.00 2.73 0.00 0.00 2.74 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.30 0.00 67 L 9.15 4.79 0.00 1.59 1.62 0.96 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 *69 G 8.24 4.44 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 0.00 70 E 8.24 4.50 0.00 2.18 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 2.16 0.00 71 D 8.11 4.80 0.00 2.78 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 N 8.26 4.88 0.00 2.84 2.83 0.00 0.00 7.20 7.44 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 73 I 8.45 3.94 1.46 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.50 -0.38 0.00 0.00 74 N 8.72 4.78 0.00 2.81 2.87 0.00 0.00 6.63 7.43 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 75 V 7.40 4.32 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.98 0.00 0.00 76 V 8.46 4.07 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 1.01 0.00 0.00 77 E 9.36 4.37 0.00 1.97 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.46 0.00 78 G 8.37 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 8.06 4.99 0.00 2.62 2.78 0.00 0.00 7.12 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 E 7.88 5.37 0.00 1.38 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 2.56 2.44 0.00 81 Q 8.36 4.22 0.00 1.95 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.89 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 82 F 8.65 5.57 0.00 2.86 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 8.92 4.69 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.70 0.89 0.00 0.00 84 S 8.72 4.63 0.00 3.75 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 A 8.33 4.65 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 86 S 8.90 4.50 0.00 3.76 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 87 K 7.57 4.67 0.00 1.80 1.54 0.00 1.77 0.00 0.00 1.95 0.00 0.00 2.87 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.53 7.81 88 S 8.79 5.32 0.00 3.99 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 89 I 9.30 4.61 2.08 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.99 1.17 0.00 0.00 90 V 8.49 4.28 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 0.66 0.00 0.00 0.81 0.00 0.00 91 H 8.58 3.33 0.00 2.84 3.04 0.00 5.65 0.00 0.00 0.00 0.00 6.63 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 4.29 0.00 2.15 2.17 0.00 2.44 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 1.51 1.83 0.00 93 S 7.70 4.72 0.00 4.06 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 94 Y 7.96 4.30 0.00 3.01 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 95 N 8.41 4.53 0.00 2.57 2.47 0.00 0.00 6.56 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 96 S 7.66 3.87 0.00 3.96 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 N 8.23 4.41 0.00 2.73 2.78 0.00 0.00 6.90 7.05 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 98 T 7.72 3.96 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 1.10 0.00 0.00 99 L 7.95 3.77 0.00 1.37 1.85 0.41 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.66 4.51 0.00 2.69 2.65 0.00 0.00 7.26 6.70 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 0.00 101 N 8.80 5.00 0.00 3.09 2.73 0.00 0.00 7.24 8.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 D 8.08 4.64 0.00 3.09 2.68 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 0.00 103 I 7.09 4.77 1.43 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 1.36 1.27 0.07 0.00 0.00 104 M 9.23 5.42 0.00 2.11 1.83 0.00 0.00 0.00 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.66 0.00 105 L 9.43 5.39 0.00 1.70 1.81 0.00 0.76 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 0.00 106 I 9.32 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 0.88 0.95 0.00 0.00 107 K 8.78 3.85 0.00 0.79 1.05 0.00 1.32 0.00 0.00 1.33 0.00 0.00 2.62 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.67 0.21 7.81 108 L 8.13 4.56 0.00 1.51 1.53 0.96 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.80 4.22 0.00 1.58 1.83 0.00 1.61 0.00 0.00 1.72 0.00 0.00 2.94 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.42 1.45 7.81 110 S 7.69 4.60 0.00 3.88 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 0.00 111 A 8.36 4.43 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 A 8.98 4.26 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 0.00 113 S 9.14 4.48 0.00 3.72 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 L 8.48 4.49 0.00 1.66 1.63 0.96 1.08 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 8.90 4.97 0.00 2.79 2.90 0.00 0.00 6.21 8.48 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 0.00 116 S 8.77 4.28 0.00 3.86 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 0.00 117 R 7.67 4.25 0.00 1.89 1.95 0.00 3.28 0.00 0.00 3.10 7.35 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.55 4.45 0.00 4.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 C 8.41 4.44 0.00 2.93 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 A 8.17 4.14 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 8.20 4.29 0.00 3.84 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 *132 A 8.15 4.15 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 G 8.99 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 0.00 134 T 7.46 4.06 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 1.15 0.00 0.00 135 Q 8.58 4.54 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 2.34 2.34 0.00 136 C 9.18 5.26 0.00 2.84 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 0.00 137 L 8.99 5.15 0.00 1.76 1.58 nan 1.17 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 0.00 138 I 9.24 5.19 1.89 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 1.48 1.03 0.00 0.00 139 S 8.37 4.89 0.00 3.50 3.58 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 0.00 140 G 7.49 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 0.00 0.00 0.00 141 W 8.65 4.74 0.00 3.23 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 0.00 142 G 8.44 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 0.00 143 N 8.17 3.50 0.00 2.08 2.55 0.00 0.00 7.11 7.31 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 0.00 144 T 7.94 5.07 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 145 K 7.77 4.64 0.00 1.88 1.84 0.00 1.74 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.28 1.31 7.81 146 S 8.57 4.35 0.00 4.08 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 0.00 147 S 8.08 4.31 0.00 3.82 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 G 8.93 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 0.00 0.00 0.00 149 T 7.92 4.83 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 1.50 0.00 0.00 150 S 9.20 4.40 0.00 3.86 3.67 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 0.00 151 Y 8.87 4.81 0.00 2.93 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 0.00 152 P 0.00 4.68 0.00 2.43 2.08 0.00 4.07 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 2.14 2.01 0.00 153 D 8.69 4.69 0.00 2.79 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 0.00 154 V 7.47 5.32 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 1.09 0.00 0.00 0.97 0.00 0.00 155 L 8.65 3.20 0.00 1.30 1.25 -0.65 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.14 4.84 0.00 1.71 1.50 0.00 1.60 0.00 0.00 1.54 0.00 0.00 2.81 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.46 7.81 157 C 8.64 5.31 0.00 1.41 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 0.00 158 L 8.70 5.00 0.00 1.72 1.48 1.09 1.02 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 9.03 5.08 0.00 1.94 1.82 0.00 1.86 0.00 0.00 1.74 0.00 0.00 2.76 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.59 1.50 7.81 160 A 9.33 4.86 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 P 0.00 5.01 0.00 2.03 2.09 0.00 3.06 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 1.86 1.77 0.00 162 I 8.38 4.43 1.89 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.55 0.83 0.00 0.00 163 L 8.76 4.83 0.00 1.53 1.60 0.93 0.80 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 0.00 164 S 8.06 4.37 0.00 3.83 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 8.74 4.45 0.00 2.73 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 S 8.03 4.13 0.00 4.06 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 0.00 167 S 7.85 4.10 0.00 4.03 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 C 8.26 4.28 0.00 3.24 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 8.36 4.00 0.00 1.76 1.92 0.00 1.80 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.55 1.73 7.81 170 S 8.22 4.28 0.00 3.97 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 A 7.79 4.12 1.12 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 0.00 172 Y 7.85 4.76 0.00 3.17 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 P 0.00 4.41 0.00 2.09 2.06 0.00 3.88 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 2.12 0.00 174 G 9.06 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 Q 8.04 4.54 0.00 2.29 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.09 6.75 0.00 0.00 0.00 0.00 0.00 2.26 2.52 0.00 176 I 8.00 4.21 1.98 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 1.84 0.90 1.00 0.00 0.00 177 T 8.27 4.59 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 178 S 8.56 4.35 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 8.15 4.97 0.00 2.89 3.09 0.00 0.00 6.62 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 0.00 180 M 7.97 5.64 0.00 1.89 2.10 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 2.66 2.61 0.00 181 F 8.73 5.11 0.00 3.09 3.13 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 0.00 182 C 9.06 5.39 0.00 2.99 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 A 9.17 5.04 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 0.00 184 G 6.90 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184A Y 8.28 4.68 0.00 3.06 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 0.00 185 L 8.65 4.21 0.00 1.74 1.73 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.23 3.88 0.00 1.98 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.41 0.00 187 G 7.84 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 0.00 0.00 0.00 188 G 9.35 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 188A K 7.34 4.81 0.00 1.64 1.73 0.00 0.81 0.00 0.00 1.43 0.00 0.00 2.52 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.22 1.16 7.81 189 D 8.58 4.62 0.00 2.81 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 8.85 4.79 0.00 4.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 C 9.29 4.73 0.00 2.90 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 8.64 4.41 0.00 2.31 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.19 0.00 0.00 0.00 0.00 0.00 2.54 2.44 0.00 193 G 9.34 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 0.00 0.00 0.00 0.00 194 D 8.35 4.74 0.00 3.00 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 4.36 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 G 8.67 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 0.00 197 G 8.10 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 0.00 198 P 0.00 5.20 0.00 2.33 2.37 0.00 3.69 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.20 0.00 199 V 8.42 4.60 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.56 0.00 0.00 200 V 8.68 4.77 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 0.81 0.00 0.00 0.71 0.00 0.00 201 C 8.57 5.08 0.00 2.78 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 0.00 202 S 9.62 3.33 0.00 3.96 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 0.00 203 G 8.48 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 K 7.56 4.70 0.00 1.71 1.64 0.00 1.86 0.00 0.00 1.62 0.00 0.00 2.86 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.51 1.39 7.81 *209 L 8.23 4.27 0.00 1.50 1.62 0.96 0.74 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 9.01 4.55 0.00 1.94 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.38 0.00 0.00 0.00 0.00 0.00 2.23 2.32 0.00 211 G 8.00 5.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 I 8.19 5.20 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 1.12 0.97 0.00 0.00 213 V 8.85 3.71 2.31 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 0.92 0.00 0.00 1.25 0.00 0.00 214 S 8.46 4.99 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 0.00 215 W 7.47 4.92 0.00 3.40 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 0.00 216 G 8.34 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 0.00 217 S 8.86 4.58 0.00 4.36 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 *219 G 7.81 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 C 8.21 4.87 0.00 2.95 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 0.00 221 A 8.98 4.24 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 221A Q 7.38 4.46 0.00 1.99 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.93 0.00 0.00 0.00 0.00 0.00 2.52 2.57 0.00 222 K 8.42 4.22 0.00 1.72 1.72 0.00 1.88 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.42 1.62 7.81 223 N 9.42 4.37 0.00 2.84 2.87 0.00 0.00 6.82 8.26 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 0.00 224 K 7.59 4.23 0.00 1.84 1.78 0.00 1.51 0.00 0.00 1.21 0.00 0.00 2.82 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.47 7.81 225 P 0.00 4.62 0.00 2.13 2.11 0.00 3.64 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.00 0.00 226 G 8.47 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 0.00 227 V 7.75 4.32 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 0.43 0.00 0.00 -0.95 0.00 0.00 228 Y 8.22 4.89 0.00 1.43 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 0.00 229 T 8.51 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 1.26 0.00 0.00 230 K 9.48 5.02 0.00 2.09 1.91 0.00 1.80 0.00 0.00 1.76 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.54 1.65 7.81 231 V 8.87 3.97 2.42 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 1.19 0.00 0.00 1.16 0.00 0.00 232 C 8.32 4.39 0.00 3.16 3.22 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 0.00 233 N 7.99 4.17 0.00 2.41 2.38 0.00 0.00 6.87 6.74 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 0.00 234 Y 8.03 4.77 0.00 3.24 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 V 7.95 3.68 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 1.07 0.00 0.00 236 S 8.07 4.11 0.00 3.98 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 0.00 237 W 8.32 4.19 0.00 3.50 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 0.00 238 I 8.24 3.02 1.99 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 1.52 1.22 0.71 0.00 0.00 239 K 8.02 3.75 0.00 1.85 1.77 0.00 1.65 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.62 7.81 240 Q 7.78 3.89 0.00 2.04 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.94 0.00 0.00 0.00 0.00 0.00 2.36 2.60 0.00 241 T 7.42 3.73 3.46 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 0.76 0.00 0.00 242 I 6.99 2.68 1.52 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.28 0.53 0.00 0.00 243 A 7.70 4.23 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 0.00 244 S 7.55 4.73 0.00 3.82 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 0.00 245 N 7.99 4.69 0.00 3.11 2.94 0.00 0.00 6.72 7.44 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 * Residues marked with a * may have inaccurate shift predictions.