NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *3 N 4.6668 8.5245 117.7917 52.0278 39.2691 174.2047 *4 K 4.5215 8.2884 124.1355 51.2139 34.6635 171.2568 5 T 4.3535 8.3644 115.3182 64.4423 70.0126 174.5166 6 V 3.7869 8.9811 127.9769 62.6536 32.9041 175.0184 7 V 4.2225 9.2819 129.3759 62.1205 32.6212 174.6363 8 V 4.5183 8.6784 129.5184 62.0430 33.1772 174.3315 9 T 4.9015 8.8854 123.3372 61.0163 69.5203 173.2930 10 T 4.8411 8.4475 121.8391 61.0058 71.6742 171.5123 11 I 4.7072 7.8137 121.0550 58.8731 41.3486 175.4510 12 L 4.2638 8.4785 127.8163 54.4971 40.7324 176.3860 13 E 4.5508 8.6041 125.6055 54.5220 31.9842 174.8062 14 S 4.2666 8.6917 123.3963 57.9840 63.7523 172.2431 15 P 4.2165 0.0000 0.0000 62.6553 31.7227 177.4716 16 Y 3.8686 7.6692 118.7304 61.2354 37.9679 176.2148 17 V 4.7684 7.4444 119.6749 61.7066 34.8733 173.2378 18 M 4.9276 9.3106 127.2268 53.4930 36.6387 174.3096 19 M 4.4546 8.7801 122.6880 55.1514 33.1229 176.1030 20 K 4.0855 8.8674 126.5894 56.0499 33.6129 176.6768 21 K 4.0232 8.6551 124.3811 58.1670 32.4048 176.0695 22 N 4.4227 8.7643 121.6504 54.3230 36.0816 174.3259 23 H 4.7241 7.9086 112.5254 55.3848 29.8428 176.2496 24 E 3.8823 8.2909 120.7776 59.6792 29.2954 178.3770 25 M 4.4150 7.7706 114.3936 55.3945 32.6213 176.4519 26 L 4.3288 7.5825 121.8889 54.6291 43.4498 176.2787 *27 E 4.6608 8.0089 113.4497 55.7528 33.4772 172.7740 28 G 3.9413 8.5217 107.6271 45.1814 0.0000 173.7433 29 N 4.6042 8.5981 114.6636 56.1898 38.6706 176.6680 30 E 4.2904 8.1001 113.9448 57.6768 30.1168 178.0227 31 R 3.9023 7.7453 119.1757 58.7900 30.2651 176.3083 32 Y 5.1919 7.2504 113.9513 56.4616 39.8965 174.4559 33 E 4.6743 9.6914 119.4780 54.6025 33.1485 174.4225 34 G 3.0978 7.8865 105.1275 42.4684 0.0000 173.9255 35 Y 3.6718 7.2599 120.8979 60.9658 38.5427 178.1966 36 C 4.4102 8.2409 117.0953 62.2351 28.3034 176.3172 37 V 3.5640 7.3567 119.9574 65.9133 31.2743 177.6807 38 D 4.3521 8.1002 118.7228 57.2266 40.6319 178.3936 39 L 3.7013 8.0808 121.0208 57.9778 41.9542 178.8785 40 A 3.6960 8.1284 120.7110 55.0587 18.2844 179.4664 41 A 4.2059 7.6989 120.1208 54.7076 18.3465 179.8297 42 E 3.8541 8.0258 116.9672 59.6146 29.5099 179.5062 43 I 3.5664 7.8473 119.8961 64.3466 37.1145 178.3567 44 A 2.5800 7.7570 123.9467 55.0199 18.2190 180.5301 *45 K 3.9603 7.7939 122.1864 60.2994 31.6001 181.2063 46 H 4.4248 8.0881 116.7462 58.3603 28.7542 176.8964 47 C 4.4717 8.0760 116.0495 58.7979 28.7547 173.4477 48 G 3.8938 7.6051 107.5274 46.5544 0.0000 173.5954 49 F 5.1906 7.7337 112.2579 54.7235 41.4620 174.8320 50 K 4.8618 8.8885 119.5840 56.0646 34.1161 175.0780 51 Y 5.4362 8.0169 119.5160 55.7478 42.3222 173.3422 52 K 4.6067 9.1656 121.0680 54.3978 34.9977 175.1296 53 L 4.5795 9.6260 129.0130 55.0748 42.4274 176.7197 54 T 4.6430 8.5659 117.2554 60.4299 71.3071 172.3358 55 I 4.7026 8.3242 129.0652 59.7557 38.6252 175.5800 56 V 3.6169 8.6936 127.1437 62.1384 31.2280 177.2490 57 G 3.7870 9.0147 115.8345 48.3349 0.0000 173.4972 58 D 4.5806 8.1120 115.9252 52.2119 39.8886 176.5892 59 G 3.8906 8.1256 107.2090 46.4325 0.0000 173.6733 60 K 4.7213 7.8176 118.0835 54.2684 35.5098 177.3233 61 Y 3.6847 8.6473 118.2709 61.7926 38.0931 174.2750 62 G 4.2073 6.2482 107.4134 43.8076 0.0000 172.2316 63 A 4.9168 9.2932 128.1124 50.3355 23.3357 174.4654 64 R 3.9124 7.3855 120.1958 54.5131 31.1440 175.6304 65 D 4.3413 8.6809 127.0745 54.2041 41.7752 176.8134 66 A 3.8306 8.8828 131.7813 56.1627 18.4660 178.9649 *67 D 4.5073 7.8759 113.5354 56.5055 40.2411 179.6030 68 T 3.9855 8.5583 110.7584 62.3130 69.1742 175.9661 69 K 3.8978 8.1582 119.7214 56.5232 30.5025 175.3783 70 I 4.4307 7.1545 120.7755 60.3274 38.4445 175.1857 71 W 4.9101 9.2682 126.9384 56.5725 30.6630 175.6713 72 N 4.9399 9.2549 122.2428 51.9458 40.4846 174.4238 73 G 4.1956 9.1586 106.8125 46.0564 0.0000 173.8407 74 M 4.0117 8.1387 117.1609 58.3761 31.7333 178.8172 75 V 3.4751 7.7999 118.0583 65.9608 31.6295 178.2943 76 G 3.9006 8.1180 106.1910 47.4774 0.0000 175.2428 77 E 4.0589 8.4199 121.0018 59.0364 29.5195 179.6130 78 L 4.0337 7.8455 119.1241 57.7092 41.5130 179.5408 79 V 3.2140 7.4898 117.5476 65.7964 31.3868 176.1715 80 Y 4.4940 7.9009 114.6360 57.5379 37.7043 176.1321 81 G 3.9198 7.8331 106.8787 46.2166 0.0000 175.5120 82 K 4.1352 8.3574 120.2467 57.9558 32.3586 177.0119 83 A 4.7152 7.4456 119.4298 50.6856 22.1091 175.1474 84 D 4.6328 8.5941 119.4325 55.8534 42.1963 176.9906 85 I 4.4865 7.3211 115.8413 59.7650 41.8307 172.7542 86 A 5.5891 8.8623 130.1579 49.6267 21.3793 175.4102 87 I 4.4602 8.3354 123.3247 59.2692 38.3099 174.5082 88 A 4.4761 8.0591 127.9429 50.1863 22.6285 175.4092 89 P 3.3393 0.0000 0.0000 61.5748 29.5113 175.8712 90 L 4.6416 7.1978 122.4259 54.3542 44.2087 176.1307 91 T 4.6109 8.5072 123.9119 63.4282 69.2891 174.3878 92 I 2.5143 7.9047 128.2374 60.8490 37.3665 175.6906 93 T 4.6635 8.1236 116.3228 58.6876 72.3274 174.7360 94 L 3.9423 8.5761 123.5615 58.6744 42.3627 179.6568 95 V 3.8305 7.9087 111.7278 64.4492 31.4157 178.7184 96 R 3.6836 7.9598 117.7063 59.1554 29.8802 178.7568 97 E 4.5463 8.3467 118.5696 58.7690 29.4532 179.0026 98 E 4.1300 8.0075 117.6037 58.4635 29.5567 177.9874 99 V 4.0998 6.8496 108.5444 61.1659 33.4853 175.2811 100 I 4.5279 7.6919 112.3790 58.9967 41.5261 173.9289 101 D 4.9039 8.5459 122.4150 52.9616 42.6520 175.8532 102 F 5.4775 8.6051 120.6884 55.6246 42.1853 175.4025 103 S 4.7092 9.0365 117.8247 57.3882 64.4701 173.7386 104 K 4.3784 8.9152 119.9718 55.4498 32.5107 175.8936 105 P 4.5802 0.0000 0.0000 63.1632 31.6101 176.3615 106 F 4.8260 8.3931 115.7280 57.4756 39.0315 175.4179 107 M 4.6309 7.0402 120.5089 54.6926 35.3488 173.3174 108 S 4.9614 8.1830 121.6630 57.4555 65.4424 173.1676 109 L 4.1595 8.3852 121.7750 56.3158 44.1524 172.9419 110 G 4.5762 7.7410 103.1924 46.0355 0.0000 173.2251 111 I 4.3381 8.7320 122.9097 61.3608 37.9279 175.5810 112 S 4.8809 9.2344 119.8571 57.1894 67.5605 172.1732 113 I 4.6597 8.2242 119.7385 59.7158 39.6130 174.4775 114 M 5.2038 9.1410 127.6388 53.7781 34.2659 174.6122 115 I 5.0073 8.7717 119.2258 58.5676 41.8156 174.6662 116 K 4.5496 8.5204 124.3998 55.9986 33.5117 176.1705 117 K 4.0610 8.8325 127.0829 57.9857 31.8627 175.9493 118 G 4.1536 9.4569 114.1696 46.4740 0.0000 174.7171 119 T 3.8636 7.8585 116.6530 63.3330 68.9403 174.6064 120 P 4.4407 0.0000 0.0000 62.1357 30.2937 176.6297 121 I 4.5781 7.6361 119.7449 60.3413 40.6838 176.2779 *122 E 4.6362 8.8223 119.3265 55.4557 32.1242 173.2264 123 S 4.5977 7.4077 110.6837 57.3482 66.7145 175.3408 124 A 3.9657 8.4231 122.8661 55.1095 17.8959 179.1046 125 E 3.8658 8.1979 116.5291 59.5763 29.9368 178.3760 126 D 4.4637 7.8528 118.4333 57.3739 40.8009 178.5668 127 L 4.1141 7.7598 120.7151 57.2077 41.3746 179.9413 128 S 4.2697 8.1285 112.3911 60.4816 63.0000 175.4939 129 K 4.4469 7.6022 120.3676 55.4264 32.5318 175.2698 130 Q 4.7516 7.5729 117.5891 54.6226 30.5990 175.7850 131 T 4.4454 8.0717 110.9631 63.2995 70.9402 176.4236 132 E 4.1178 8.4072 118.5273 58.3761 29.7643 176.7699 133 I 4.6184 6.9873 117.9244 59.4361 38.4061 176.1062 134 A 4.7704 9.3790 129.7787 51.5190 20.1239 175.4425 135 Y 5.1241 7.5332 114.9077 57.3924 40.7226 174.4485 136 G 4.6949 8.3367 106.8687 46.3343 0.0000 170.5134 137 T 5.4751 8.6765 109.1067 59.8210 72.9892 172.7366 138 L 4.6280 8.6786 123.2980 55.5003 42.1106 176.6019 139 D 4.4729 9.2435 125.3887 55.8185 41.7868 176.2328 140 S 4.7991 7.8894 112.3603 57.1899 62.8143 171.5273 141 G 4.3108 7.5021 110.0351 43.8031 0.0000 172.3364 142 S 4.1725 8.5809 112.8317 61.5125 62.9106 176.4335 143 T 3.8604 7.8277 119.2149 66.3939 68.2639 176.2839 144 K 4.2292 8.1467 121.0765 59.7492 32.2262 178.4807 145 E 3.7695 7.9748 118.8453 59.1207 29.0795 179.0535 146 F 3.8099 8.1079 120.0010 61.3573 39.5943 176.9823 147 F 4.1730 8.0603 117.1638 60.3024 38.5404 177.6694 148 R 2.0000 7.2685 119.9541 58.7593 29.7638 178.5292 *149 R 4.4568 7.2443 116.9548 57.1784 30.1437 177.9341 150 S 4.2972 6.9889 116.4644 59.4663 62.9316 174.7277 *151 K 4.4845 8.2029 125.9902 54.5718 33.4102 176.8459 152 I 3.7947 7.5110 119.5936 61.6464 38.3197 176.0023 153 A 3.9642 8.6564 127.2714 55.7427 18.1888 180.0512 154 V 3.5665 7.4432 115.4914 66.2397 31.6320 178.1689 155 F 5.0467 7.6481 117.1137 60.7290 38.8697 177.0866 156 D 4.5820 8.8029 118.3910 57.2942 40.9222 178.2310 157 K 4.1227 8.4624 120.2805 59.7831 32.1350 178.8097 158 M 4.4612 8.5521 119.2284 58.1565 31.8908 178.5371 159 W 4.4465 9.1161 129.1264 60.7903 30.6770 178.1294 160 T 3.7488 8.0944 115.0126 66.6812 68.3277 175.7140 161 Y 4.0908 7.8448 121.3451 60.9971 38.7974 177.6828 162 M 3.2438 7.9268 119.9261 57.9713 31.7762 178.9652 163 R 3.6000 7.1409 115.4784 57.9759 29.3110 177.4944 164 S 4.4803 6.7613 109.9180 57.3603 63.5096 173.7691 165 A 3.8640 7.1220 124.5637 52.2229 18.4728 177.4751 166 E 4.5703 8.2736 121.4566 53.5715 32.5487 174.4392 167 P 4.4479 0.0000 0.0000 61.4853 32.4533 175.6768 168 S 3.9721 8.4304 112.2583 59.4614 62.4399 174.4149 169 V 3.9815 7.7822 118.8831 62.0221 32.4180 175.8164 170 F 5.4456 7.4572 119.5366 56.9745 40.2096 175.4221 171 V 4.7144 8.6011 113.3360 59.7516 35.0777 177.3396 172 R 4.0538 9.0230 122.0039 58.9391 30.5595 177.7122 173 T 4.9031 7.4826 106.1707 59.2907 73.2930 174.7355 174 T 4.1141 8.6925 117.7922 66.8739 68.4105 176.6482 175 A 4.0539 8.0919 122.2301 55.2046 18.4088 179.1581 176 E 3.9367 8.0032 118.0696 59.1681 29.6831 179.3454 177 G 2.6274 7.6455 105.5571 47.3272 0.0000 175.9268 178 V 3.6022 7.9527 121.1078 65.7285 31.6153 178.0107 179 A 3.9910 8.2804 120.8170 55.0163 17.9004 179.6474 180 R 3.7188 7.6642 116.7162 59.4001 30.5459 178.6073 181 V 4.1371 7.9565 118.0777 66.3834 31.3996 178.2741 182 R 4.0276 8.0931 116.3383 58.4678 29.9632 178.1710 183 K 4.4400 7.8025 115.3868 56.5433 32.9147 177.7768 184 S 4.4078 7.9620 115.4788 58.1524 62.7505 174.7918 185 K 4.0048 8.9679 119.3977 57.2711 29.3601 176.1941 186 G 3.9944 8.5991 105.1274 45.5231 0.0000 174.6401 187 K 4.4154 8.2359 118.3521 56.4763 32.3774 175.3822 188 Y 5.3470 7.7602 120.0691 56.0780 41.7620 173.7461 189 A 4.8262 8.7174 128.4005 50.1749 22.4914 174.0146 190 Y 5.0288 8.6045 122.0539 55.8289 41.4361 174.4214 191 L 5.0083 8.2808 127.2947 53.4415 42.8902 175.7784 192 L 4.4382 8.2417 123.2374 54.1308 44.7301 174.9352 193 E 4.4213 8.7163 119.0865 56.0260 30.3134 178.2513 194 S 4.2320 9.3172 120.9833 61.1934 62.5414 177.1790 195 T 4.0168 7.9851 112.5543 65.2420 68.5132 176.1527 196 M 4.3754 8.3403 121.5921 57.5970 32.1369 178.0632 197 N 4.4009 8.5647 117.3760 57.0414 39.0203 176.8814 198 E 4.1928 8.7636 118.7379 59.3756 29.7989 178.6675 199 Y 4.0966 8.2004 119.6797 60.8582 38.8849 177.9204 200 I 3.5063 7.8135 120.5889 64.3457 36.9820 178.0013 201 E 4.0171 8.2295 119.0953 58.5989 29.5571 177.1693 202 Q 4.6667 7.7939 116.8979 55.5323 30.2408 175.1700 203 R 4.8893 7.7629 118.3914 53.7992 33.3205 175.8185 204 K 4.3630 8.8581 122.5032 55.6964 32.8941 174.8866 205 P 4.5456 0.0000 0.0000 62.9146 31.6100 176.8830 206 C 4.3080 7.9387 113.9381 59.4746 35.5048 173.2031 207 D 5.0175 7.9542 115.0936 53.2007 40.8007 176.1860 208 T 5.2019 7.8783 108.4745 60.8084 71.9235 173.1243 209 M 5.0733 8.9770 120.6989 53.9703 37.0899 173.7911 210 K 4.9224 8.5946 123.7604 55.4497 33.4051 176.1555 211 V 4.3427 8.3148 120.6740 60.7264 34.6024 176.9678 212 G 3.7297 8.9150 112.9212 44.8340 0.0000 172.3630 213 G 3.9823 8.0806 107.9232 43.7251 0.0000 173.0121 214 N 4.6551 8.2607 116.6406 52.9202 38.9391 176.1000 215 L 4.1914 8.6097 122.6740 56.6910 42.2772 175.8577 216 D 4.5881 7.0460 116.9082 52.8357 42.6261 174.0287 217 S 5.0590 8.1765 113.7537 57.0570 66.5418 174.0556 218 K 4.2731 8.7968 122.7395 56.7272 36.2595 173.8730 219 G 4.1515 8.0057 105.4498 45.3251 0.0000 171.0520 220 Y 5.2452 8.1382 117.8676 56.4994 39.6966 175.5244 221 G 4.6887 8.6462 109.3511 44.5346 0.0000 171.8664 222 I 4.6699 8.8728 121.9601 60.4986 38.5950 174.9772 223 A 5.1752 8.6694 128.7136 50.4218 21.6008 175.5542 224 T 4.8252 8.4882 110.1413 58.8854 73.0066 171.6909 225 P 4.4099 0.0000 0.0000 61.9928 32.7596 176.0133 226 K 3.9796 8.4096 124.0674 58.2888 32.3407 176.8215 227 G 3.8454 8.5819 113.4996 45.9434 0.0000 173.5550 228 S 4.2542 7.6887 114.2345 57.7554 62.9295 175.5713 229 S 4.2707 8.4343 121.3725 61.4022 63.0369 176.5165 230 L 4.2665 8.0900 120.3804 57.3359 41.2352 178.8720 231 G 3.8548 7.5807 104.1751 48.3027 0.0000 174.8938 232 N 4.2643 8.1413 118.2577 56.0907 39.0919 177.0241 233 A 4.0318 7.9693 121.4631 55.0784 18.4476 179.5890 234 V 3.5647 8.0877 116.9619 66.0226 31.7372 177.7029 235 N 4.3129 8.2230 116.7688 56.9105 38.8534 176.8625 236 L 4.0286 7.9950 120.0781 57.6888 41.5748 179.4174 237 A 3.9589 8.3755 121.1622 54.9898 18.3018 179.8287 238 V 3.5506 8.0961 117.0263 66.1855 31.6721 178.2618 239 L 4.0261 7.8595 118.3972 57.5520 41.4531 179.4676 240 K 3.8922 8.1716 119.5124 59.5870 32.0802 178.8302 241 L 3.9647 8.1281 119.5997 57.8025 41.5412 179.1291 242 N 4.3640 8.2763 116.9630 56.8403 38.7309 176.9101 243 E 4.0813 7.9795 118.6847 59.0944 29.6371 178.5452 244 Q 4.2559 8.0290 116.0628 56.1162 29.3761 177.1210 245 G 3.9786 8.0548 109.0652 45.7911 0.0000 175.3972 246 L 3.9602 7.7744 122.3692 58.2365 42.1624 178.8711 247 L 4.1166 7.9911 118.3651 58.0144 41.5804 179.1670 248 D 4.4761 8.1325 118.4965 56.9287 40.8140 178.4491 249 K 3.9903 8.0651 119.9545 59.7185 32.3794 178.9521 250 L 4.2350 8.2763 119.3044 57.5731 41.4612 179.4823 251 K 4.2220 8.4265 119.6449 59.8214 32.1146 178.7438 252 N 4.7537 8.5317 116.8435 56.1346 38.2324 177.3375 253 K 3.9515 8.5062 121.2851 58.9547 32.0895 178.2312 254 W 4.5129 8.2310 116.2614 56.9468 29.5974 177.3893 255 W 4.3977 8.1958 117.3507 58.4886 29.7187 177.0851 256 Y 4.7204 7.4679 115.0514 59.9596 38.0087 177.7684 257 D 4.4725 8.4653 119.3154 56.8951 41.1493 177.8240 258 K 4.1015 7.6119 118.0030 58.1768 32.4344 177.5434 259 G 3.9078 7.0909 106.3095 45.8293 0.0000 173.1369 260 E 4.3447 9.2826 125.2427 57.2599 30.5364 176.0726 *261 C 4.5121 7.9925 121.1109 55.1781 41.7688 178.4704 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 *3 N 8.52 4.67 0.00 2.76 2.69 0.00 0.00 6.43 6.56 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 *4 K 8.29 4.52 0.00 1.82 1.60 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.88 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.26 1.09 7.81 5 T 8.36 4.35 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 6 V 8.98 3.79 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.38 0.00 0.00 7 V 9.28 4.22 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 0.98 0.00 0.00 0.92 0.00 0.00 8 V 8.68 4.52 2.25 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 0.80 0.00 0.00 0.98 0.00 0.00 9 T 8.89 4.90 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 10 T 8.45 4.84 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 1.05 0.00 0.00 11 I 7.81 4.71 1.49 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.86 0.56 0.00 0.00 12 L 8.48 4.26 0.00 1.68 1.67 1.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 13 E 8.60 4.55 0.00 2.01 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.63 0.00 14 S 8.69 4.27 0.00 3.92 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 15 P 0.00 4.22 0.00 1.59 0.69 0.00 2.20 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 16 Y 7.67 3.87 0.00 3.16 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 17 V 7.44 4.77 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 0.77 0.00 0.00 0.85 0.00 0.00 18 M 9.31 4.93 0.00 1.92 1.85 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 2.33 2.39 0.00 19 M 8.78 4.45 0.00 2.04 2.05 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.62 0.00 20 K 8.87 4.09 0.00 1.41 1.40 0.00 1.69 0.00 0.00 1.37 0.00 0.00 2.79 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.45 7.81 21 K 8.66 4.02 0.00 1.73 1.76 0.00 1.94 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.50 7.81 22 N 8.76 4.42 0.00 2.94 2.89 0.00 0.00 7.14 8.16 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 23 H 7.91 4.72 0.00 3.33 3.19 0.00 5.83 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 24 E 8.29 3.88 0.00 2.05 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 2.41 0.00 25 M 7.77 4.42 0.00 1.98 2.07 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.54 0.00 26 L 7.58 4.33 0.00 1.79 1.59 0.70 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 *27 E 8.01 4.66 0.00 1.92 1.64 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 2.11 1.85 0.00 28 G 8.52 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 N 8.60 4.60 0.00 2.73 2.94 0.00 0.00 6.62 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 30 E 8.10 4.29 0.00 2.08 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 0.00 2.28 2.39 0.00 31 R 7.75 3.90 0.00 1.34 1.20 0.00 2.85 0.00 0.00 3.28 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.46 0.00 32 Y 7.25 5.19 0.00 2.97 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 33 E 9.69 4.67 0.00 2.29 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 0.00 2.37 2.21 0.00 34 G 7.89 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 0.00 0.00 0.00 35 Y 7.26 3.67 0.00 2.97 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 36 C 8.24 4.41 0.00 3.26 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 37 V 7.36 3.56 2.21 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 1.14 0.00 0.00 0.93 0.00 0.00 38 D 8.10 4.35 0.00 2.89 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 39 L 8.08 3.70 0.00 1.27 1.57 0.69 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 40 A 8.13 3.70 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 A 7.70 4.21 1.45 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 42 E 8.03 3.85 0.00 2.10 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 2.30 2.46 0.00 43 I 7.85 3.57 1.71 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.84 0.95 0.00 0.00 44 A 7.76 2.58 0.97 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 *45 K 7.79 3.96 0.00 1.80 1.83 0.00 1.81 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.37 1.35 7.81 46 H 8.09 4.42 0.00 3.05 3.36 0.00 5.61 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 C 8.08 4.47 0.00 2.84 3.20 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 48 G 7.61 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 0.00 0.00 0.00 49 F 7.73 5.19 0.00 2.91 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 50 K 8.89 4.86 0.00 1.82 1.79 0.00 1.68 0.00 0.00 1.88 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.50 1.49 7.81 51 Y 8.02 5.44 0.00 3.20 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 52 K 9.17 4.61 0.00 1.81 1.70 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.85 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.35 1.38 7.81 53 L 9.63 4.58 0.00 1.73 1.49 1.06 0.85 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 54 T 8.57 4.64 4.31 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 1.21 0.00 0.00 55 I 8.32 4.70 1.85 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 1.29 0.95 0.85 0.00 0.00 56 V 8.69 3.62 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 0.64 0.00 0.00 0.97 0.00 0.00 57 G 9.01 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 58 D 8.11 4.58 0.00 2.81 2.79 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 59 G 8.13 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 0.00 0.00 0.00 60 K 7.82 4.72 0.00 1.97 1.78 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.41 1.64 7.81 61 Y 8.65 3.68 0.00 3.16 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 62 G 6.25 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 A 9.29 4.92 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 R 7.39 3.91 0.00 0.67 1.01 0.00 3.12 0.00 0.00 2.62 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.69 0.00 65 D 8.68 4.34 0.00 2.70 2.45 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 66 A 8.88 3.83 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 *67 D 7.88 4.51 0.00 2.71 2.56 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 68 T 8.56 3.99 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 1.19 0.00 0.00 69 K 8.16 3.90 0.00 1.92 1.99 0.00 1.66 0.00 0.00 1.62 0.00 0.00 3.07 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.32 1.53 7.81 70 I 7.15 4.43 1.87 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.84 0.91 0.00 0.00 71 W 9.27 4.91 0.00 3.44 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 72 N 9.25 4.94 0.00 3.12 3.02 0.00 0.00 6.60 6.49 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 73 G 9.16 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 0.00 0.00 0.00 0.00 74 M 8.14 4.01 0.00 2.05 2.21 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.45 0.00 75 V 7.80 3.48 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 0.29 0.00 0.00 0.98 0.00 0.00 76 G 8.12 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 77 E 8.42 4.06 0.00 2.16 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 2.37 2.60 0.00 78 L 7.85 4.03 0.00 1.89 1.49 0.88 0.65 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 79 V 7.49 3.21 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.40 0.00 0.00 80 Y 7.90 4.49 0.00 3.06 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 81 G 7.83 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 0.00 0.00 0.00 82 K 8.36 4.14 0.00 1.90 1.90 0.00 1.71 0.00 0.00 1.73 0.00 0.00 2.90 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.56 1.58 7.81 83 A 7.45 4.72 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 D 8.59 4.63 0.00 2.52 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 I 7.32 4.49 1.71 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 1.23 1.15 0.80 0.00 0.00 86 A 8.86 5.59 1.16 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 87 I 8.34 4.46 1.77 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 1.21 0.66 0.74 0.00 0.00 88 A 8.06 4.48 1.11 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 0.00 0.00 89 P 0.00 3.34 0.00 0.99 0.49 0.00 3.51 0.00 0.00 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.97 0.00 90 L 7.20 4.64 0.00 1.92 1.78 1.19 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 91 T 8.51 4.61 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 1.15 0.00 0.00 92 I 7.90 2.51 1.48 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.04 -0.18 0.57 0.00 0.00 93 T 8.12 4.66 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 94 L 8.58 3.94 0.00 1.79 1.72 0.94 0.92 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 95 V 7.91 3.83 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 1.15 0.00 0.00 96 R 7.96 3.68 0.00 2.29 2.08 0.00 3.52 0.00 0.00 3.40 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.87 0.00 97 E 8.35 4.55 0.00 2.14 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 0.00 2.80 2.54 0.00 98 E 8.01 4.13 0.00 2.16 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 0.00 2.37 2.55 0.00 99 V 6.85 4.10 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 -0.14 0.00 0.00 100 I 7.69 4.53 1.60 0.00 0.00 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.50 0.50 0.00 0.00 101 D 8.55 4.90 0.00 2.60 2.55 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 0.00 102 F 8.61 5.48 0.00 3.10 2.87 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 0.00 103 S 9.04 4.71 0.00 3.95 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 0.00 104 K 8.92 4.38 0.00 1.71 1.81 0.00 1.73 0.00 0.00 1.77 0.00 0.00 2.97 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.72 1.56 7.81 105 P 0.00 4.58 0.00 2.04 1.90 0.00 3.73 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.87 0.00 106 F 8.39 4.83 0.00 3.22 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 0.00 107 M 7.04 4.63 0.00 1.82 1.94 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.30 0.00 108 S 8.18 4.96 0.00 3.64 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 0.00 109 L 8.39 4.16 0.00 1.35 1.42 -0.12 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 110 G 7.74 4.58 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 0.00 0.00 0.00 111 I 8.73 4.34 1.26 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.10 0.77 0.00 0.00 112 S 9.23 4.88 0.00 3.76 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 0.00 113 I 8.22 4.66 2.02 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 1.18 0.68 0.86 0.00 0.00 114 M 9.14 5.20 0.00 2.32 2.15 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 2.59 2.56 0.00 115 I 8.77 5.01 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 1.18 1.04 0.90 0.00 0.00 116 K 8.52 4.55 0.00 1.96 1.75 0.00 1.65 0.00 0.00 2.02 0.00 0.00 2.97 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.53 1.56 7.81 117 K 8.83 4.06 0.00 1.65 1.76 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.49 1.43 7.81 118 G 9.46 4.15 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 0.00 119 T 7.86 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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 0.00 128 S 8.13 4.27 0.00 4.08 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 0.00 129 K 7.60 4.45 0.00 1.74 1.87 0.00 1.63 0.00 0.00 1.75 0.00 0.00 3.06 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.41 1.66 7.81 130 Q 7.57 4.75 0.00 2.07 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.57 0.00 0.00 0.00 0.00 0.00 2.28 2.41 0.00 131 T 8.07 4.45 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 132 E 8.41 4.12 0.00 2.08 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 0.00 2.28 2.34 0.00 133 I 6.99 4.62 1.89 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 1.19 0.63 1.00 0.00 0.00 134 A 9.38 4.77 1.50 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 0.00 0.00 0.00 0.00 0.00 0.00 135 Y 7.53 5.12 0.00 2.84 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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4.00 0.00 1.92 1.90 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.36 1.43 7.81 186 G 8.60 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 0.00 187 K 8.24 4.42 0.00 1.94 1.90 0.00 1.68 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.56 1.54 7.81 188 Y 7.76 5.35 0.00 2.92 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 0.00 189 A 8.72 4.83 1.16 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 0.00 190 Y 8.60 5.03 0.00 3.08 2.87 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 0.00 191 L 8.28 5.01 0.00 1.62 1.63 0.80 0.83 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 0.00 192 L 8.24 4.44 0.00 1.63 1.15 1.20 0.83 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 0.00 193 E 8.72 4.42 0.00 2.14 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 2.30 2.24 0.00 194 S 9.32 4.23 0.00 4.21 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 0.00 195 T 7.99 4.02 4.81 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 1.12 0.00 0.00 196 M 8.34 4.38 0.00 2.32 2.36 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.08 3.00 0.00 197 N 8.56 4.40 0.00 2.97 3.04 0.00 0.00 7.20 7.16 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 0.00 198 E 8.76 4.19 0.00 2.30 2.33 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 2.49 2.56 0.00 199 Y 8.20 4.10 0.00 2.36 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 0.00 200 I 7.81 3.51 2.08 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.84 0.95 0.00 0.00 201 E 8.23 4.02 0.00 2.16 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 2.38 2.56 0.00 202 Q 7.79 4.67 0.00 1.97 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.52 0.00 0.00 0.00 0.00 0.00 2.61 2.67 0.00 203 R 7.76 4.89 0.00 1.60 1.61 0.00 2.87 0.00 0.00 2.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.98 0.00 204 K 8.86 4.36 0.00 1.70 1.74 0.00 1.69 0.00 0.00 1.75 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.38 7.81 205 P 0.00 4.55 0.00 2.18 2.13 0.00 3.91 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 2.30 1.98 0.00 206 C 7.94 4.31 0.00 3.09 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 207 D 7.95 5.02 0.00 2.70 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 0.00 208 T 7.88 5.20 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 0.00 209 M 8.98 5.07 0.00 1.95 1.95 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.71 0.00 210 K 8.59 4.92 0.00 1.93 1.88 0.00 1.77 0.00 0.00 1.76 0.00 0.00 2.71 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.43 7.81 211 V 8.31 4.34 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 0.73 0.00 0.00 0.98 0.00 0.00 212 G 8.91 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 0.00 0.00 0.00 213 G 8.08 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 214 N 8.26 4.66 0.00 2.65 2.76 0.00 0.00 6.89 7.85 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 0.00 215 L 8.61 4.19 0.00 1.01 1.10 0.97 0.76 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 0.00 216 D 7.05 4.59 0.00 2.58 2.57 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 0.00 217 S 8.18 5.06 0.00 3.64 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 K 8.80 4.27 0.00 1.57 1.76 0.00 1.14 0.00 0.00 1.59 0.00 0.00 2.74 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.22 1.13 7.81 219 G 8.01 4.15 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 0.00 220 Y 8.14 5.25 0.00 1.64 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 0.00 0.00 0.00 221 G 8.65 4.69 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 0.00 0.00 0.00 222 I 8.87 4.67 1.99 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.87 0.95 0.00 0.00 223 A 8.67 5.18 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 T 8.49 4.83 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 225 P 0.00 4.41 0.00 1.99 1.88 0.00 3.50 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.96 0.00 226 K 8.41 3.98 0.00 1.74 1.65 0.00 1.78 0.00 0.00 1.75 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.37 1.55 7.81 227 G 8.58 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 0.00 228 S 7.69 4.25 0.00 3.86 3.69 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 0.00 229 S 8.43 4.27 0.00 3.86 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 0.00 230 L 8.09 4.27 0.00 1.64 1.66 0.59 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 231 G 7.58 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 0.00 232 N 8.14 4.26 0.00 2.85 2.84 0.00 0.00 6.87 8.33 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 0.00 233 A 7.97 4.03 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 234 V 8.09 3.56 2.25 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 1.12 0.00 0.00 1.04 0.00 0.00 235 N 8.22 4.31 0.00 3.00 3.00 0.00 0.00 7.26 6.31 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 0.00 236 L 8.00 4.03 0.00 1.89 1.71 0.93 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 237 A 8.38 3.96 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 V 8.10 3.55 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 1.18 0.00 0.00 1.04 0.00 0.00 239 L 7.86 4.03 0.00 1.95 1.71 0.94 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 240 K 8.17 3.89 0.00 1.92 1.85 0.00 1.64 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.38 1.47 7.81 241 L 8.13 3.96 0.00 1.84 1.69 0.84 0.53 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 0.00 242 N 8.28 4.36 0.00 2.91 2.96 0.00 0.00 7.22 7.39 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 0.00 243 E 7.98 4.08 0.00 2.13 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 2.47 0.00 244 Q 8.03 4.26 0.00 2.05 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.71 0.00 0.00 0.00 0.00 0.00 2.65 2.45 0.00 245 G 8.05 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 246 L 7.77 3.96 0.00 1.73 1.82 0.97 0.58 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 0.00 247 L 7.99 4.12 0.00 1.85 1.94 1.13 1.16 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 0.00 248 D 8.13 4.48 0.00 2.89 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 0.00 249 K 8.07 3.99 0.00 2.09 2.08 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.48 1.52 7.81 250 L 8.28 4.24 0.00 1.83 1.78 0.55 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 251 K 8.43 4.22 0.00 2.06 2.12 0.00 0.61 0.00 0.00 0.85 0.00 0.00 2.67 0.00 0.00 2.35 0.00 0.00 0.00 0.00 1.37 1.50 7.81 252 N 8.53 4.75 0.00 2.94 3.04 0.00 0.00 6.70 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 0.00 253 K 8.51 3.95 0.00 1.80 1.98 0.00 1.50 0.00 0.00 1.61 0.00 0.00 2.28 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.30 1.02 7.81 254 W 8.23 4.51 0.00 3.68 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 0.00 255 W 8.20 4.40 0.00 2.95 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 256 Y 7.47 4.72 0.00 3.14 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 0.00 257 D 8.47 4.47 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 0.00 258 K 7.61 4.10 0.00 1.83 1.91 0.00 1.69 0.00 0.00 1.57 0.00 0.00 2.56 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.61 1.71 7.81 259 G 7.09 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 0.00 260 E 9.28 4.34 0.00 1.95 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 2.23 2.32 0.00 *261 C 7.99 4.51 0.00 2.87 2.90 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 * Residues marked with a * may have inaccurate shift predictions.