NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 E 4.3295 8.4449 120.2257 55.6580 30.9575 175.0059 3 D 4.3579 8.5063 120.3982 54.4169 41.2421 174.5950 4 I 4.7269 8.4568 123.2859 59.5866 40.3874 174.8534 5 K 4.4645 9.0088 126.5649 55.0861 35.7242 174.7165 6 I 4.9652 8.5111 128.4976 59.5116 39.0582 174.8865 7 K 4.7781 8.6432 126.6906 54.5350 35.8223 175.2126 8 E 4.4280 8.9640 123.8187 56.2151 30.5090 175.7129 9 I 4.4326 8.5483 119.9623 58.4796 41.3277 178.4908 10 F 3.7060 8.3667 122.6407 58.6473 38.1370 178.5290 11 E 4.5029 8.6255 132.5081 56.2729 31.0662 173.4552 12 N 4.2290 9.4305 125.4724 54.6995 38.1759 173.4462 13 I 4.7470 6.8379 114.4332 59.0800 41.4011 174.2243 14 Y 5.1463 9.0968 122.4749 56.1866 41.7818 174.1461 15 E 4.7357 9.5991 125.5321 55.3222 30.0169 174.8825 16 V 4.4647 9.0783 127.5879 61.3752 33.8316 173.8711 17 D 4.9883 9.0505 129.7500 52.6532 42.3278 176.3787 18 L 4.2333 8.6861 125.4449 55.0077 42.1288 178.0184 19 G 3.8879 8.2268 107.4873 45.9034 0.0000 173.7818 20 D 4.7449 8.1968 115.6589 52.4161 39.7213 177.2003 21 G 3.9831 8.2778 108.3296 45.6510 0.0000 173.8983 22 L 4.3714 7.4914 119.5387 53.7089 42.5520 176.6333 23 K 4.3208 8.4693 122.7214 56.2272 33.1129 176.5919 24 R 4.9392 8.1659 120.1836 54.6307 34.9116 174.1118 25 I 5.3412 8.2988 114.0393 59.7491 41.8491 173.3863 26 A 5.4841 9.4058 123.9890 51.5704 23.2734 175.0407 27 T 5.1646 8.6816 108.1851 59.7532 72.5511 173.5368 28 K 4.2046 8.8063 124.5985 55.3354 32.5066 176.3314 29 S 4.5228 8.8069 123.8817 58.2518 62.4595 174.2176 30 I 4.1478 8.4585 119.2240 61.0395 38.0399 176.5032 31 V 4.2513 7.2955 121.2555 60.5879 31.5025 173.9520 32 K 4.2255 8.0031 123.1754 57.1626 32.7362 177.5051 33 G 3.8888 9.5603 110.5692 45.3101 0.0000 173.0627 34 K 4.4722 7.3636 119.4236 54.0598 34.9618 175.4956 35 K 4.5389 8.4279 125.1573 54.5980 33.7331 176.4268 36 V 3.8330 9.2261 125.4680 65.6085 31.6442 176.9578 37 Y 4.8740 7.0904 116.0292 56.8036 38.1404 173.8815 38 D 4.2684 8.2510 114.8235 56.1904 39.8284 173.0538 39 E 4.0117 7.4030 113.5509 55.1874 30.8366 176.1327 40 K 4.3080 8.2266 119.1563 56.4709 33.5667 176.0387 41 I 5.0282 8.2264 123.0323 59.6643 40.9309 175.3661 42 I 4.3056 8.6950 127.0064 59.5379 38.8687 174.4165 43 K 4.7155 8.5652 129.1664 55.3829 32.8822 176.3440 44 I 4.3249 8.6887 130.3283 60.1050 38.7247 177.8973 45 G 3.9615 8.3719 119.2288 46.9334 0.0000 174.4765 46 D 4.6301 8.9581 125.0024 54.5893 42.0863 176.4265 47 E 3.9975 7.7477 119.8277 55.8976 30.1935 175.3731 48 E 4.9534 8.1889 121.2585 54.8296 33.0690 174.3113 49 Y 4.7842 8.7596 123.5498 56.7878 39.9337 175.1452 50 R 4.7644 8.9411 125.1412 54.8440 31.6411 176.1698 51 I 4.1657 8.6508 126.7657 61.5260 37.6421 176.3843 52 W 4.6965 9.1582 135.0000 55.9339 30.4025 174.7196 53 N 4.5077 9.2135 126.3796 52.5194 38.4647 174.2230 54 P 4.0935 0.0000 0.0000 65.1683 31.4742 177.2558 55 N 4.7234 8.5673 115.8235 54.7323 38.6771 175.6844 56 K 4.4681 7.8343 115.4424 55.9085 34.1178 176.5601 57 S 4.5672 7.6207 113.0769 55.5827 65.3954 174.2301 58 K 3.9628 8.8105 129.1500 59.3134 31.8768 179.0478 59 L 3.9564 7.9541 120.2282 57.9593 42.0666 178.6529 60 A 2.6478 7.0268 119.5127 54.4475 18.0085 179.4075 61 A 3.1841 7.6522 119.0491 54.9635 18.3897 179.7329 62 A 3.8353 7.8405 119.1782 55.2752 18.4368 179.9946 63 I 3.6259 7.4294 118.2531 64.6240 36.9639 178.7244 64 I 3.7129 7.5657 119.6909 64.0805 36.9368 177.7180 65 K 4.4827 7.8552 116.6994 56.4058 31.9122 177.3651 66 G 4.1363 7.7632 108.1643 45.1591 0.0000 174.0225 67 L 3.9889 7.8626 121.6782 55.2141 42.3117 176.9752 68 K 4.5637 9.3745 125.0790 56.6127 33.7524 176.5694 69 V 4.2399 7.7289 116.9234 60.3572 33.5869 173.3986 *71 P 4.0165 0.0000 0.0000 62.1154 32.7714 176.7245 72 I 3.8070 7.6356 119.9463 61.2612 36.9615 175.1505 73 K 4.6674 8.8586 125.9395 54.1593 35.0082 177.4877 74 R 4.4891 9.5096 117.9872 58.8538 29.8719 178.4063 75 D 5.1884 7.7785 113.3995 52.2820 39.9625 176.3496 76 S 4.5782 7.7805 116.7875 58.9895 64.3519 173.2445 77 K 4.8857 9.3676 123.0540 54.8157 34.1513 175.1100 78 I 5.1358 9.0042 125.8157 59.0459 41.6816 173.8512 79 L 4.9260 8.9717 130.8555 53.9656 43.5940 174.3163 80 Y 4.9663 9.4524 129.3930 56.2557 40.4582 174.0545 81 L 4.9708 9.0066 127.3915 53.0137 44.7536 175.2402 82 G 4.4536 8.4222 108.3630 43.7954 0.0000 173.7224 83 A 4.4696 8.3926 125.0609 51.9113 18.9841 177.0830 84 S 4.5628 8.3104 114.4027 57.5225 65.1454 174.0491 85 A 4.3946 8.3438 127.9426 51.7892 19.2549 177.7524 86 G 3.9371 8.3254 104.8827 45.8026 0.0000 175.8454 87 T 3.4830 7.4754 116.0976 67.6884 69.2341 176.1786 88 T 4.0627 7.8460 116.9450 66.5483 68.9158 174.9083 89 P 3.8927 0.0000 0.0000 65.3970 31.1506 178.7593 90 S 3.9756 8.0096 113.1373 61.7746 62.8882 176.3892 91 H 3.7890 7.5446 118.5070 58.1631 28.1579 177.9644 92 V 3.4590 7.7553 120.0351 65.7815 31.0796 178.0057 93 A 3.8820 7.6294 119.8964 54.9244 18.4023 179.1040 94 D 4.3475 7.6222 117.2434 57.4864 41.0103 178.9072 95 I 3.7412 7.6029 119.9927 63.8808 38.3661 177.0955 96 A 4.8362 8.0638 123.9524 51.2643 17.4607 178.3797 97 D 4.3834 7.7979 121.2721 55.1273 40.2203 178.0306 98 K 4.4931 8.4524 118.7523 55.9010 32.8606 175.5228 99 G 5.2665 7.5900 107.6406 44.3253 0.0000 172.5866 100 I 4.8430 8.1274 119.4951 59.5748 42.2421 174.7355 101 V 4.6492 8.6259 125.0936 61.3634 34.3485 174.0157 102 Y 4.7720 8.9799 127.4618 57.1364 39.2546 174.7922 103 A 5.0184 8.9469 128.0881 50.4983 19.3480 175.5483 104 I 4.5390 8.6152 124.3051 61.0005 38.7740 175.3559 105 E 4.8362 8.7860 126.1269 55.0476 33.1728 176.2755 106 Y 4.0803 9.2607 124.2850 59.3133 39.6334 175.4876 107 A 4.2858 7.9043 123.2455 50.4816 19.5075 176.1352 108 P 4.2562 0.0000 0.0000 65.7014 31.6733 178.2574 109 R 4.0899 7.9196 116.6850 59.0637 30.3403 177.6724 110 I 3.9459 7.6258 118.3599 61.8598 37.2241 177.9330 *112 R 4.1930 8.1514 122.2812 56.5323 31.8317 177.3357 113 E 3.9790 7.9068 117.2654 59.2802 29.3290 179.0428 114 L 3.9306 8.1707 120.6532 58.1702 41.8976 179.0857 115 L 3.9632 7.7463 117.5693 57.6977 41.6519 178.6980 116 D 4.4614 7.6718 117.7128 57.0735 40.8890 178.3026 117 A 4.2004 7.9278 120.5092 54.4459 18.7911 178.5078 118 C 4.5667 8.1039 114.0940 60.6913 29.2264 176.0811 119 A 3.6879 8.0585 120.3794 56.3142 18.6058 178.6280 120 E 4.2895 7.8255 114.2535 56.2617 30.4684 178.3258 121 R 4.2322 7.5333 120.4177 54.9548 28.4825 176.8609 122 E 4.1345 8.2608 120.6470 57.7930 30.0704 177.5564 123 N 4.4913 7.9610 115.7977 53.1355 38.0512 173.9549 124 I 4.5690 7.2863 120.7087 60.2051 38.5100 175.3037 125 I 4.3941 8.7796 129.9760 58.6176 38.7608 173.3978 126 P 4.7582 0.0000 0.0000 62.7583 32.4710 176.2163 127 I 4.4072 8.6551 123.4063 59.3388 40.9875 174.3623 128 L 4.2733 8.6960 130.6486 55.4400 42.2102 175.8179 129 G 4.1747 8.7935 113.1991 46.1659 0.0000 170.3889 130 D 5.3018 8.6442 118.7512 52.0606 42.3864 176.6869 131 A 4.5959 8.7491 129.4940 54.2565 18.5450 177.2604 132 N 4.6225 8.6846 113.1931 54.6035 39.8608 175.2365 133 K 4.5491 8.1626 117.0169 53.9727 32.5505 175.1137 134 P 3.0279 0.0000 0.0000 65.0168 31.2531 178.5989 135 Q 2.5200 6.8775 116.9394 58.4570 28.0807 178.2056 136 E 3.9465 7.3456 119.8029 58.1776 29.6910 177.1486 137 Y 4.6973 6.6237 115.1655 56.4912 38.2549 177.4421 138 A 4.5343 7.4379 124.6877 55.3351 18.4865 178.9024 139 N 4.8510 8.1333 111.3353 53.5614 39.0796 175.0191 140 I 4.2135 7.6570 117.9938 62.6681 39.3516 176.1455 141 V 2.6280 7.3850 120.9130 61.6469 30.9532 175.6691 142 E 4.3985 8.1434 126.9501 55.1999 30.4035 176.6097 143 K 4.3061 8.6455 119.4746 57.7329 32.5149 177.1954 144 V 4.5263 9.1276 118.0719 60.1470 34.2520 176.4277 145 D 4.7137 9.2530 122.3778 56.3183 42.3631 177.0022 146 V 5.1522 7.7906 116.5146 61.2617 35.5308 173.9443 147 I 4.9892 8.7648 127.2778 59.6909 39.7691 174.1713 148 Y 4.5672 9.0729 128.7178 55.6419 41.0993 173.7674 149 E 4.7818 7.9323 126.8492 54.1259 32.9305 174.5822 150 D 5.0259 8.7619 125.5205 52.6756 41.4306 173.4374 151 V 4.3965 7.5855 111.1025 59.2249 34.7096 176.8577 152 A 4.4042 8.4372 129.7812 50.9328 17.1903 175.8405 153 Q 4.6538 7.5904 119.3765 52.8446 33.3906 174.8428 154 P 4.2655 0.0000 0.0000 65.1044 31.7287 177.1901 155 N 4.8733 7.9811 114.2285 52.5445 37.6958 176.3983 156 Q 4.0504 8.0570 120.5111 59.9404 28.2657 178.7080 157 A 3.9460 7.8849 122.1776 54.9456 18.5783 179.3346 158 E 4.0317 8.1658 115.6006 59.5233 29.5788 179.2601 159 I 3.7524 7.8435 121.0250 64.1184 37.0962 178.0636 160 L 4.0217 7.8839 120.9704 58.1875 41.9423 179.1273 161 I 3.7579 7.9254 119.8482 64.1954 36.9910 178.3257 162 K 4.0231 8.5088 120.9122 59.7767 32.0733 178.6988 163 N 4.5679 8.5118 116.4645 55.9549 38.4482 177.4395 164 A 3.5887 7.9180 122.6674 54.7016 18.0224 179.7303 165 K 3.9664 7.4501 115.8696 59.4122 32.1991 179.4141 166 W 3.7359 7.5889 117.4730 59.1723 29.2246 177.1705 167 F 5.0652 8.2844 115.9284 57.4730 41.6962 175.2742 168 L 4.6959 7.7254 121.6735 54.2323 42.3537 177.1499 169 K 4.3344 8.8694 126.1988 56.1163 33.5151 176.5173 170 K 4.4151 8.6152 124.6113 57.8441 32.5843 177.3185 171 G 3.9032 9.2348 116.0618 44.9753 0.0000 173.4696 172 G 4.1605 8.0484 107.3295 46.2686 0.0000 171.9420 173 Y 5.5323 9.3603 116.4814 56.2736 42.1640 175.6979 174 G 4.5012 9.2559 109.4017 44.2366 0.0000 171.2586 *176 I 4.1862 8.1369 118.5145 60.6574 38.7961 174.8183 177 A 4.5592 8.4180 132.1152 51.1248 19.6083 176.2595 178 I 4.7364 8.7514 124.2113 59.2611 39.8334 175.1579 179 K 4.3617 8.6128 128.8536 54.8997 32.6973 176.4791 180 A 3.6940 8.8081 132.2909 55.4361 18.2467 179.7696 181 R 4.4998 8.0513 111.6430 57.9774 30.2223 177.8353 182 S 4.3710 7.8064 111.5615 59.4471 63.6650 174.9278 183 I 4.1841 7.5743 121.3810 62.6057 38.3239 175.7576 184 D 4.6067 7.5309 118.0608 53.2398 43.8901 175.4104 185 V 4.2692 8.3669 118.0554 61.7659 32.5394 176.1124 186 T 4.3620 7.9652 115.2183 64.9170 70.2334 175.1803 187 K 4.0744 8.3948 119.1233 56.1221 32.8100 176.6922 188 D 4.4663 8.3732 119.8869 53.5316 42.6822 175.2113 189 P 3.8975 0.0000 0.0000 65.7327 31.2174 178.6359 190 K 4.1309 8.0100 117.7570 59.6620 32.0994 178.7303 191 E 4.0755 7.9921 118.3752 59.0979 29.4942 179.1150 192 I 3.6281 7.7354 120.0823 64.4249 37.0775 178.4904 193 F 4.5787 8.2132 118.9871 60.3811 38.7551 177.6489 194 K 4.0237 8.0776 119.2919 59.7497 32.0839 178.7988 195 E 4.2949 8.1742 120.1390 58.9303 29.2939 179.4234 196 Q 3.9223 8.3003 118.3020 58.6888 28.7373 178.5094 197 K 3.5073 8.1159 120.8276 59.4947 31.7108 178.6691 198 E 3.9698 8.1048 118.6677 59.4096 29.3601 179.3758 199 I 3.7389 7.7837 119.8018 64.3868 37.1692 178.5139 200 L 4.1408 8.0128 119.8040 57.9387 41.4401 179.4900 201 E 4.9050 8.7063 119.7266 59.0405 29.1909 179.3158 202 A 4.1776 8.3344 120.3329 54.7632 18.4980 179.4286 203 G 3.9065 7.9222 103.2056 45.7410 0.0000 173.5586 204 G 3.3934 6.9228 108.5940 45.5705 0.0000 173.0364 205 F 5.3292 8.4560 119.9144 55.5896 41.9106 174.8692 206 K 4.7962 8.7475 123.6417 54.5316 34.0657 175.3105 207 I 4.4093 8.5864 129.4696 61.9446 37.0195 176.4325 208 V 4.4223 8.9368 120.6168 61.5471 33.2339 175.4660 209 D 4.7389 7.9154 118.8688 53.3272 44.8198 173.7934 210 E 4.5159 8.4096 124.3660 55.1671 32.4696 174.1503 211 V 4.2121 7.9340 126.8289 60.8826 34.6785 173.8759 212 D 4.5124 8.6645 128.3400 53.7267 41.1171 175.0298 213 I 4.3738 8.3616 121.7596 62.9979 38.1216 179.0723 214 E 3.7139 8.0495 122.3622 59.6786 30.3002 176.6705 215 P 4.1965 0.0000 0.0000 65.5722 31.4788 178.1413 216 F 4.3682 7.3071 114.8863 59.9739 39.0806 175.8571 217 E 4.6066 8.0934 119.3548 54.5998 33.1324 174.8431 218 K 4.2196 8.7504 123.7850 56.9449 33.3755 176.6249 219 D 4.6692 8.8906 123.1364 56.2879 38.2897 172.8488 220 H 5.5599 8.0963 114.3390 54.3650 32.7198 173.8166 221 V 4.6278 8.0876 123.0737 60.5819 34.8539 173.6194 *223 F 4.7973 8.6531 116.3829 57.5245 40.3603 174.8766 224 V 4.7091 8.7405 121.7079 61.2368 34.6256 174.5268 225 G 4.6838 9.1840 113.6207 44.8345 0.0000 171.1887 226 I 4.4360 8.7126 123.1262 59.5149 39.1587 175.0727 227 W 4.2976 9.2087 135.0000 57.4472 30.6668 176.4288 228 E 3.6061 8.6234 128.2983 58.4787 29.7413 178.0601 229 G 2.9659 5.7509 104.6322 44.5030 0.0000 172.7432 230 K 3.9934 7.8226 119.8259 56.7280 32.0172 176.8857 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 E 8.44 4.33 0.00 1.97 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.28 0.00 3 D 8.51 4.36 0.00 2.63 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 4 I 8.46 4.73 1.85 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 1.22 0.72 0.92 0.00 0.00 5 K 9.01 4.46 0.00 1.75 1.57 0.00 1.56 0.00 0.00 1.63 0.00 0.00 2.83 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.31 1.39 7.81 6 I 8.51 4.97 1.60 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.63 0.46 0.00 0.00 7 K 8.64 4.78 0.00 1.82 1.87 0.00 1.28 0.00 0.00 1.55 0.00 0.00 2.74 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.28 1.32 7.81 8 E 8.96 4.43 0.00 2.15 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 2.16 2.05 0.00 9 I 8.55 4.43 1.33 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 1.26 0.82 0.75 0.00 0.00 10 F 8.37 3.71 0.00 3.19 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 0.00 0.00 0.00 11 E 8.63 4.50 0.00 1.90 1.82 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 2.19 2.29 0.00 12 N 9.43 4.23 0.00 2.90 2.90 0.00 0.00 7.04 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 13 I 6.84 4.75 2.20 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 1.40 0.76 1.20 0.00 0.00 14 Y 9.10 5.15 0.00 3.07 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 15 E 9.60 4.74 0.00 1.98 1.90 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 2.26 2.24 0.00 16 V 9.08 4.46 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 0.86 0.00 0.00 0.94 0.00 0.00 17 D 9.05 4.99 0.00 2.78 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 L 8.69 4.23 0.00 1.68 1.69 0.93 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 19 G 8.23 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 20 D 8.20 4.74 0.00 2.77 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 21 G 8.28 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 22 L 7.49 4.37 0.00 1.65 1.63 0.94 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 23 K 8.47 4.32 0.00 1.77 1.75 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.47 7.81 24 R 8.17 4.94 0.00 1.88 1.78 0.00 3.09 0.00 0.00 3.25 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 25 I 8.30 5.34 2.04 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.92 0.93 0.00 0.00 26 A 9.41 5.48 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 27 T 8.68 5.16 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 28 K 8.81 4.20 0.00 1.64 1.77 0.00 1.72 0.00 0.00 1.82 0.00 0.00 2.35 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.13 0.74 7.81 29 S 8.81 4.52 0.00 3.78 3.71 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 30 I 8.46 4.15 1.80 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.68 0.84 0.00 0.00 31 V 7.30 4.25 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 0.94 0.00 0.00 0.86 0.00 0.00 32 K 8.00 4.23 0.00 1.73 1.66 0.00 1.96 0.00 0.00 1.60 0.00 0.00 2.77 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.34 1.35 7.81 33 G 9.56 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 34 K 7.36 4.47 0.00 1.62 1.73 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.76 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.29 1.34 7.81 35 K 8.43 4.54 0.00 1.70 1.60 0.00 1.74 0.00 0.00 1.64 0.00 0.00 2.80 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.39 1.33 7.81 36 V 9.23 3.83 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.90 0.00 0.00 37 Y 7.09 4.87 0.00 3.09 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 38 D 8.25 4.27 0.00 2.78 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 39 E 7.40 4.01 0.00 1.83 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.47 0.00 40 K 8.23 4.31 0.00 1.71 1.76 0.00 1.61 0.00 0.00 1.80 0.00 0.00 2.80 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.52 1.42 7.81 41 I 8.23 5.03 1.85 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.55 0.90 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0.00 3.33 0.00 0.00 3.05 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.52 0.00 51 I 8.65 4.17 1.99 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 1.34 0.78 0.99 0.00 0.00 52 W 9.16 4.70 0.00 3.29 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 53 N 9.21 4.51 0.00 2.97 3.00 0.00 0.00 6.79 8.95 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 54 P 0.00 4.09 0.00 0.49 1.41 0.00 3.76 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.67 0.00 55 N 8.57 4.72 0.00 2.98 3.03 0.00 0.00 6.81 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 56 K 7.83 4.47 0.00 1.78 1.65 0.00 1.60 0.00 0.00 1.75 0.00 0.00 3.11 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.50 1.40 7.81 57 S 7.62 4.57 0.00 3.99 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 K 8.81 3.96 0.00 1.97 1.89 0.00 1.88 0.00 0.00 1.81 0.00 0.00 3.06 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.54 1.55 7.81 59 L 7.95 3.96 0.00 1.83 1.76 0.98 1.22 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 60 A 7.03 2.65 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 A 7.65 3.18 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 62 A 7.84 3.84 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 I 7.43 3.63 1.68 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.42 1.02 0.00 0.00 64 I 7.57 3.71 1.72 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.42 0.99 0.00 0.00 65 K 7.86 4.48 0.00 1.79 1.85 0.00 1.84 0.00 0.00 1.87 0.00 0.00 3.06 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.86 1.84 7.81 66 G 7.76 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 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 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 K 9.37 4.89 0.00 1.79 1.86 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.38 1.40 7.81 78 I 9.00 5.14 2.05 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 1.23 1.90 1.00 0.00 0.00 79 L 8.97 4.93 0.00 1.88 1.64 0.75 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 80 Y 9.45 4.97 0.00 3.09 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 81 L 9.01 4.97 0.00 1.52 1.53 0.98 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 82 G 8.42 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 A 8.39 4.47 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 84 S 8.31 4.56 0.00 3.96 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 93 A 7.63 3.88 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 94 D 7.62 4.35 0.00 2.72 2.75 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 95 I 7.60 3.74 1.96 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 1.59 1.13 0.95 0.00 0.00 96 A 8.06 4.84 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 D 7.80 4.38 0.00 2.76 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 98 K 8.45 4.49 0.00 1.83 1.83 0.00 1.61 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.36 1.50 7.81 99 G 7.59 5.27 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 0.00 100 I 8.13 4.84 1.60 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 1.08 0.51 0.15 0.00 0.00 101 V 8.63 4.65 1.95 0.00 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7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.64 0.00 110 I 7.63 3.95 2.04 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.70 1.01 0.00 0.00 *112 R 8.15 4.19 0.00 2.05 2.10 0.00 3.17 0.00 0.00 3.33 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.64 0.00 113 E 7.91 3.98 0.00 2.16 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.58 0.00 114 L 8.17 3.93 0.00 1.78 1.62 0.78 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 115 L 7.75 3.96 0.00 1.76 1.69 0.88 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 116 D 7.67 4.46 0.00 2.76 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 0.00 117 A 7.93 4.20 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 0.00 118 C 8.10 4.57 0.00 3.00 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 127 I 8.66 4.41 1.65 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 1.08 1.10 0.71 0.00 0.00 128 L 8.70 4.27 0.00 1.59 1.55 0.91 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 129 G 8.79 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 0.00 0.00 0.00 130 D 8.64 5.30 0.00 2.91 2.65 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 0.00 0.00 0.00 131 A 8.75 4.60 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 0.00 132 N 8.68 4.62 0.00 2.66 2.92 0.00 0.00 6.93 6.66 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 0.00 133 K 8.16 4.55 0.00 1.75 1.56 0.00 1.74 0.00 0.00 1.69 0.00 0.00 3.13 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.31 1.34 7.81 134 P 0.00 3.03 0.00 1.61 2.40 0.00 3.50 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.88 0.00 135 Q 6.88 2.52 0.00 1.70 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.94 0.00 0.00 0.00 0.00 0.00 2.13 2.24 0.00 136 E 7.35 3.95 0.00 2.01 2.05 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 2.27 2.19 0.00 137 Y 6.62 4.70 0.00 2.97 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 0.00 138 A 7.44 4.53 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 0.00 139 N 8.13 4.85 0.00 2.75 2.89 0.00 0.00 6.73 7.45 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 0.00 140 I 7.66 4.21 1.94 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 1.32 0.64 0.93 0.00 0.00 141 V 7.39 2.63 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 -0.23 0.00 0.00 0.32 0.00 0.00 142 E 8.14 4.40 0.00 2.15 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 2.38 2.48 0.00 143 K 8.65 4.31 0.00 1.74 1.89 0.00 1.98 0.00 0.00 1.89 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.56 1.52 7.81 144 V 9.13 4.53 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 0.90 0.00 0.00 1.12 0.00 0.00 145 D 9.25 4.71 0.00 2.68 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 0.00 146 V 7.79 5.15 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 1.05 0.00 0.00 147 I 8.76 4.99 1.96 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.91 0.96 0.00 0.00 148 Y 9.07 4.57 0.00 3.05 2.64 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 0.00 149 E 7.93 4.78 0.00 1.91 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.17 0.00 150 D 8.76 5.03 0.00 2.69 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 V 7.59 4.40 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.98 0.00 0.00 152 A 8.44 4.40 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 0.00 153 Q 7.59 4.65 0.00 2.04 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.00 6.84 0.00 0.00 0.00 0.00 0.00 2.32 2.35 0.00 154 P 0.00 4.27 0.00 2.02 2.10 0.00 3.64 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.25 0.00 155 N 7.98 4.87 0.00 2.98 3.00 0.00 0.00 6.02 7.24 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 0.00 156 Q 8.06 4.05 0.00 2.49 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.85 0.00 0.00 0.00 0.00 0.00 2.44 2.37 0.00 157 A 7.88 3.95 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 E 8.17 4.03 0.00 2.23 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 0.00 2.51 2.43 0.00 159 I 7.84 3.75 2.05 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 1.43 0.76 0.99 0.00 0.00 160 L 7.88 4.02 0.00 1.96 1.85 0.93 0.52 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 0.00 161 I 7.93 3.76 2.11 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.10 1.07 0.00 0.00 162 K 8.51 4.02 0.00 2.02 1.98 0.00 1.65 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.58 1.60 7.81 163 N 8.51 4.57 0.00 2.98 3.08 0.00 0.00 6.95 7.32 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 0.00 164 A 7.92 3.59 0.08 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 0.00 165 K 7.45 3.97 0.00 1.84 1.72 0.00 1.73 0.00 0.00 1.69 0.00 0.00 3.13 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.68 1.78 7.81 166 W 7.59 3.74 0.00 2.44 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 0.00 167 F 8.28 5.07 0.00 2.99 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 0.00 168 L 7.73 4.70 0.00 1.46 1.07 1.17 0.43 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 0.00 169 K 8.87 4.33 0.00 1.89 1.82 0.00 1.95 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.55 1.72 7.81 170 K 8.62 4.42 0.00 1.73 1.73 0.00 1.72 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.39 7.81 171 G 9.23 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 0.00 172 G 8.05 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 Y 9.36 5.53 0.00 3.00 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 0.00 174 G 9.26 4.50 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 0.00 *176 I 8.14 4.19 1.70 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.86 0.85 0.00 0.00 177 A 8.42 4.56 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 I 8.75 4.74 2.30 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 1.96 1.15 0.00 0.00 179 K 8.61 4.36 0.00 1.66 1.66 0.00 1.82 0.00 0.00 1.84 0.00 0.00 2.86 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.39 1.30 7.81 180 A 8.81 3.69 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 R 8.05 4.50 0.00 1.80 1.99 0.00 3.40 0.00 0.00 2.94 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.52 0.00 182 S 7.81 4.37 0.00 4.07 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 I 7.57 4.18 1.94 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 1.15 0.59 0.86 0.00 0.00 184 D 7.53 4.61 0.00 2.56 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 V 8.37 4.27 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 0.81 0.00 0.00 0.91 0.00 0.00 186 T 7.97 4.36 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 1.20 0.00 0.00 187 K 8.39 4.07 0.00 1.63 1.71 0.00 1.66 0.00 0.00 1.60 0.00 0.00 2.93 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.45 1.61 7.81 188 D 8.37 4.47 0.00 2.70 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 0.00 189 P 0.00 3.90 0.00 2.22 1.98 0.00 3.64 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.08 0.00 190 K 8.01 4.13 0.00 1.95 1.91 0.00 1.67 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.59 7.81 191 E 7.99 4.08 0.00 2.15 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.34 0.00 192 I 7.74 3.63 1.58 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 1.40 0.65 0.73 0.00 0.00 193 F 8.21 4.58 0.00 3.18 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 K 8.08 4.02 0.00 1.96 2.06 0.00 1.68 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.54 7.81 195 E 8.17 4.29 0.00 2.19 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 196 Q 8.30 3.92 0.00 2.19 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.79 0.00 0.00 0.00 0.00 0.00 2.57 2.53 0.00 197 K 8.12 3.51 0.00 1.86 2.01 0.00 1.86 0.00 0.00 1.75 0.00 0.00 3.00 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.46 1.51 7.81 198 E 8.10 3.97 0.00 2.25 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 2.34 2.57 0.00 199 I 7.78 3.74 1.99 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 1.52 0.73 0.92 0.00 0.00 200 L 8.01 4.14 0.00 1.75 1.72 0.49 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 201 E 8.71 4.91 0.00 2.16 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 2.55 2.43 0.00 202 A 8.33 4.18 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 G 7.92 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 G 6.92 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 0.00 0.00 0.00 205 F 8.46 5.33 0.00 3.29 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 0.00 206 K 8.75 4.80 0.00 1.83 1.70 0.00 1.63 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.41 7.81 207 I 8.59 4.41 1.97 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 1.42 0.99 1.10 0.00 0.00 208 V 8.94 4.42 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 0.75 0.00 0.00 1.17 0.00 0.00 209 D 7.92 4.74 0.00 2.72 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 0.00 210 E 8.41 4.52 0.00 1.87 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 1.71 1.47 0.00 211 V 7.93 4.21 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 0.89 0.00 0.00 0.89 0.00 0.00 212 D 8.66 4.51 0.00 2.54 2.50 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 0.00 213 I 8.36 4.37 1.96 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 1.35 0.53 0.92 0.00 0.00 214 E 8.05 3.71 0.00 2.36 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 2.27 2.47 0.00 215 P 0.00 4.20 0.00 0.86 1.64 0.00 3.67 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.90 0.00 216 F 7.31 4.37 0.00 3.05 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 0.00 217 E 8.09 4.61 0.00 1.90 1.52 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 2.27 2.32 0.00 218 K 8.75 4.22 0.00 1.79 1.78 0.00 1.91 0.00 0.00 1.71 0.00 0.00 2.76 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.43 1.46 7.81 219 D 8.89 4.67 0.00 2.94 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 H 8.10 5.56 0.00 3.11 3.19 0.00 5.75 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 V 8.09 4.63 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.29 0.00 0.00 -0.20 0.00 0.00 *223 F 8.65 4.80 0.00 2.90 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 0.00 224 V 8.74 4.71 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 1.20 0.00 0.00 0.93 0.00 0.00 225 G 9.18 4.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 226 I 8.71 4.44 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 0.17 0.75 0.77 0.00 0.00 227 W 9.21 4.30 0.00 3.16 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 0.00 228 E 8.62 3.61 0.00 1.45 1.71 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 2.38 2.25 0.00 229 G 5.75 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 0.00 0.00 0.00 230 K 7.82 3.99 0.00 1.62 1.66 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.18 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.40 1.50 7.81 * Residues marked with a * may have inaccurate shift predictions.