NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2593 7.8827 121.4470 61.2370 38.6087 173.8055 17 V 4.2754 8.6508 126.3571 61.9216 32.6504 174.6176 18 G 3.7646 8.5002 113.9229 46.6569 0.0000 173.6661 19 G 4.2769 7.7391 109.8463 44.6508 0.0000 172.6763 20 Y 4.9720 8.1350 118.5798 55.4474 42.7671 175.0828 21 T 4.1082 8.5527 117.3845 63.9223 68.9886 175.9709 22 C 3.9581 8.5440 125.4363 59.8160 35.6377 175.5072 23 G 4.0016 7.8020 104.7055 44.8340 0.0000 172.8340 24 A 4.2801 8.4782 125.8857 53.7766 18.6221 176.9732 25 N 4.2976 8.9702 118.7658 54.3260 36.1030 175.4165 26 T 4.1165 7.7188 108.0823 63.0650 69.7592 175.0415 27 V 4.0729 7.1020 121.9585 60.5930 31.2438 173.6261 28 P 4.4437 0.0000 0.0000 63.7775 32.3076 178.0744 29 Y 4.9486 6.9068 116.3437 57.1092 38.8404 174.7412 30 Q 4.5587 7.4858 123.5900 56.2773 29.5222 175.5487 31 V 4.8511 8.9899 119.2433 59.7012 35.7426 174.2082 32 S 4.9587 8.7165 117.3147 56.6753 64.7201 172.6981 33 L 4.6898 8.4641 127.5356 53.4072 43.2185 175.0048 34 N 5.8651 9.0306 122.5914 50.0240 41.9939 175.0098 *37 S 4.1816 8.4780 121.1423 58.2903 64.1709 174.6015 38 G 3.9579 9.3218 108.9849 46.3153 0.0000 172.9904 39 Y 4.5913 6.5737 114.8196 56.0108 40.0676 172.9641 40 H 4.5402 8.8826 121.9829 56.4630 30.3881 174.8659 41 F 5.0785 7.8913 119.3307 56.7991 39.6049 173.7906 42 C 4.7674 6.8753 114.7989 56.1499 44.6869 173.5882 43 G 4.3044 8.7898 109.7734 45.7338 0.0000 172.1845 44 G 4.5911 7.7780 103.0188 46.3988 0.0000 172.5514 45 S 5.3827 8.8129 115.3846 56.4087 66.6706 173.7366 46 L 4.7529 9.2770 128.1659 55.0030 42.2901 177.1271 47 I 4.4111 8.6202 120.0457 61.1407 38.6612 174.4734 48 N 4.6930 7.5010 117.2177 52.3963 39.4768 174.7527 49 S 4.3502 8.6300 111.5229 60.5086 63.3949 175.1069 50 Q 4.5158 8.1484 118.3171 55.2485 30.4152 174.6120 51 W 5.6138 8.0242 116.8881 54.7878 33.6914 174.2466 52 V 4.9294 9.0849 123.3601 61.1769 34.2581 174.1928 53 V 4.7462 8.8483 127.8620 62.0798 33.0682 174.8095 54 S 5.2715 9.0223 121.4775 57.2405 66.5114 171.9700 55 A 4.5311 8.4945 121.2301 50.9671 19.7811 178.5729 56 A 3.8274 8.2875 124.7236 55.2450 18.4291 179.2248 57 H 4.5343 8.4165 110.0357 57.5956 28.7218 175.4699 58 C 4.6651 7.8578 117.0101 57.3652 40.4881 173.3036 59 Y 4.2437 7.7138 122.2046 57.9153 38.7391 175.2124 60 K 3.3741 6.9701 123.4320 55.5835 34.8792 174.8765 61 S 4.2237 7.9406 114.4990 58.9075 63.8559 173.4463 62 G 3.7131 8.4729 106.8027 46.6787 0.0000 173.5850 63 I 4.1630 7.5889 119.9008 60.3679 38.9522 174.7565 64 Q 4.7282 8.9151 128.1319 54.2818 31.3280 174.2491 65 V 4.3491 8.7130 127.1926 62.0211 33.4960 174.6467 66 R 5.0867 8.9686 127.1306 54.6832 32.4852 175.0160 67 L 4.7559 9.1516 124.8191 52.8282 44.6622 177.7864 *69 G 4.1533 8.3109 108.0094 45.2649 0.0000 172.8045 70 E 4.3550 8.1782 118.6479 55.6709 29.8124 174.0456 71 D 4.8881 7.9375 117.8997 55.3775 44.4263 174.5251 72 N 4.9658 9.1395 118.8022 53.2058 39.3370 176.1974 73 I 3.9601 8.4189 119.7783 62.2061 37.9640 176.2261 74 N 4.7428 8.5029 117.8702 53.0965 39.2520 174.8693 75 V 4.3197 7.3595 116.9235 60.5977 34.2754 174.9581 76 V 4.0150 8.5013 126.8919 62.9611 31.1754 175.1058 77 E 4.3983 9.4102 127.5812 55.5312 30.5655 176.8223 78 G 3.9587 8.0000 105.1004 45.5671 0.0000 174.1566 79 N 4.8704 8.1710 116.1969 52.8438 39.4557 174.0267 80 E 4.5380 7.7654 117.8127 56.2524 30.9179 176.0885 81 Q 4.4527 8.9949 120.5669 54.2468 32.4045 174.3023 82 F 5.5785 8.7857 123.0472 56.0514 40.8178 175.3978 83 I 4.6685 8.8674 124.7948 59.3867 41.0018 175.4101 84 S 4.5918 8.7569 122.8183 58.2273 64.1310 173.5201 85 A 4.5488 8.5787 125.9526 52.2546 18.2092 177.8381 86 S 4.5551 8.8803 116.9511 59.9644 64.4676 174.5654 87 K 4.6618 7.5167 117.1059 55.9279 35.3219 174.8131 88 S 5.2699 8.7784 117.0028 57.0100 66.9220 173.8680 89 I 4.5926 9.1704 123.5115 59.5672 40.1156 174.9185 90 V 4.1680 8.4475 127.4098 62.2163 32.5958 175.2218 91 H 3.5187 8.6403 127.0818 55.7371 30.1211 174.5469 92 P 4.3297 0.0000 0.0000 65.0869 31.3774 177.1594 93 S 4.6754 7.9206 113.1969 58.0580 63.2873 173.1711 94 Y 4.3215 8.0495 123.4526 57.8991 38.9675 174.6078 95 N 4.6190 8.3557 125.8201 51.3432 39.9835 175.0708 96 S 3.8919 7.6204 120.4325 59.9920 63.6829 175.6243 97 N 4.3224 8.3209 119.2576 56.1591 38.2884 176.2747 98 T 3.8860 7.7320 105.0905 61.0334 69.7354 175.1373 99 L 3.7294 7.8026 120.3865 55.2621 39.9765 173.9113 100 N 4.3844 7.7947 118.3914 54.8156 39.4874 174.6318 101 N 4.9163 8.7195 120.8821 54.2256 35.7695 175.6903 102 D 4.6409 7.8868 117.6361 52.9666 39.7295 174.7510 103 I 4.8886 7.1090 121.1324 59.3622 42.1535 172.9068 104 M 5.5329 9.2511 124.4980 54.0277 35.2824 173.3690 105 L 5.3818 9.2525 120.1549 53.2498 44.9345 175.5155 106 I 5.0314 9.1127 123.7014 59.4742 40.4035 174.3319 107 K 3.8493 8.6642 129.0323 54.7099 33.4205 175.6068 108 L 4.4360 8.3428 127.6469 54.2175 42.4204 178.3035 109 K 4.1681 8.8308 122.9128 58.9041 32.5189 177.6651 110 S 4.5755 7.4485 109.1366 55.8032 66.0778 173.5470 111 A 4.3562 8.4280 123.8544 51.9350 18.7115 177.4049 112 A 4.2052 8.8695 124.2701 52.0040 19.5263 177.5217 113 S 4.4362 8.9838 116.3262 57.1078 62.7357 173.9834 114 L 4.4701 8.4830 128.4782 54.5030 42.3951 176.4169 115 N 4.8908 8.8700 119.9144 52.1443 39.7031 174.7976 116 S 4.2308 8.7261 111.5053 60.7941 63.2401 174.7111 117 R 4.3873 8.5377 118.8148 55.9192 31.1424 176.1370 118 V 4.4333 7.8911 117.7214 61.0993 33.5797 173.5390 119 A 5.1381 8.5986 128.6154 50.3668 22.8472 175.2828 120 S 5.0249 8.7405 114.6758 57.8969 64.8398 173.0248 121 I 4.3951 8.2374 121.6802 59.0858 39.4382 175.7505 122 S 4.3095 8.4309 124.6796 58.3443 63.5198 173.8867 123 L 4.3543 8.1301 123.5748 53.5363 42.3198 175.3405 124 P 4.5001 0.0000 0.0000 63.1431 32.5239 176.4044 125 T 4.0769 8.3113 116.2402 65.3424 69.3449 175.3187 *127 S 4.9291 7.5287 112.8053 57.9470 64.0565 174.1592 128 C 4.3620 8.4090 118.4300 56.7243 40.5947 173.7398 129 A 4.2519 7.3729 125.6724 52.0093 18.9978 177.1969 130 S 4.4555 8.0985 114.8309 56.9030 64.6677 173.8227 *132 A 4.1814 8.2979 125.8559 53.4461 19.2996 176.9941 133 G 3.9993 8.8728 111.2674 45.3617 0.0000 174.2631 134 T 4.0338 7.5858 117.4121 63.6414 69.5667 173.7341 135 Q 4.6584 8.6271 125.3078 55.8043 29.6612 175.9786 136 C 5.2031 9.3701 121.1743 54.9934 45.3043 172.4788 137 L 5.1111 8.9705 122.9009 53.6969 43.5938 175.0374 138 I 5.2863 9.0702 127.6721 58.8620 40.0061 174.9491 139 S 4.8552 8.4995 119.2145 56.5122 66.4632 173.1390 140 G 3.7256 7.5043 108.0386 46.3393 0.0000 172.9868 141 W 4.5920 8.6094 116.9233 56.3812 29.2461 176.8788 142 G 4.2150 8.5757 107.9748 45.1092 0.0000 173.3483 143 N 3.9176 8.5685 119.1081 54.4082 38.9791 174.8238 144 T 5.0954 8.3845 114.5015 60.6969 69.7746 174.2892 145 K 4.5783 7.8575 121.4981 54.6419 34.4823 176.2465 146 S 4.2570 8.7940 117.9567 60.4752 62.6118 174.0583 147 S 4.4944 8.1533 115.9976 58.7175 64.5793 173.9642 148 G 3.8567 9.6296 114.0653 44.3631 0.0000 171.0361 149 T 4.8078 7.9647 114.1125 62.0513 72.3884 173.9635 150 S 4.5827 9.2055 120.6809 57.4043 66.3345 172.0735 151 Y 4.9438 8.7250 125.1018 55.6084 39.5082 174.1164 152 P 4.6924 0.0000 0.0000 62.2989 32.9660 175.4959 153 D 4.6728 8.6689 117.7662 54.7716 40.4901 176.8953 154 V 5.1730 7.4267 110.9825 58.6189 34.0116 175.8034 155 L 3.2012 8.4192 124.7409 54.9456 42.9576 176.0234 156 K 4.8502 8.1492 124.9958 54.9463 35.1752 174.5863 157 C 5.2113 8.4600 119.0935 55.1954 43.4017 173.0217 158 L 5.0344 8.6899 122.7819 53.7650 45.5059 174.7191 159 K 5.1147 9.0643 125.6667 55.5566 33.3679 176.0103 160 A 4.9332 9.2780 126.1121 49.4829 23.0994 173.3681 161 P 5.0503 0.0000 0.0000 61.7407 33.7911 175.3725 162 I 4.2902 8.3992 123.1101 61.7032 37.9536 175.5835 163 L 4.8912 8.7199 127.3470 53.0927 43.3198 177.0312 164 S 4.3052 8.5285 115.4723 58.4223 63.7787 175.1749 165 D 4.4158 8.7752 122.1436 57.5975 40.4855 179.3335 166 S 4.1693 8.0154 114.4511 61.4256 63.1347 176.2573 167 S 4.0614 8.1730 116.8546 61.1793 62.2355 175.3998 168 C 4.3297 8.4649 121.2139 59.7945 41.7095 175.7477 169 K 4.0173 8.5629 120.5100 59.6129 31.3624 179.5973 170 S 4.2467 8.1938 114.6670 61.4107 62.7705 176.2496 171 A 4.0386 7.9295 122.8989 53.7624 19.5881 177.3093 172 Y 4.8531 7.7741 113.7312 55.2986 38.3632 172.8971 173 P 4.5067 0.0000 0.0000 63.3095 32.3913 177.2038 174 G 4.0238 9.0441 109.5482 46.1805 0.0000 173.8910 175 Q 4.5150 8.0928 116.3426 54.8880 30.9321 175.4005 176 I 4.3665 7.9563 119.2496 60.1143 38.1436 175.5884 177 T 4.5169 8.2713 115.9919 59.8503 70.5768 175.4938 178 S 4.3779 8.5431 115.1483 60.2259 63.1749 174.3877 179 N 5.0031 8.3162 118.9432 53.3347 38.5429 173.8156 180 M 5.5931 7.9544 116.7588 53.7622 36.1549 174.5923 181 F 5.1246 8.8244 115.3257 55.7177 42.1482 172.6674 182 C 5.3627 8.9604 116.5425 55.8952 37.4260 173.2034 183 A 5.0404 8.9202 123.6748 50.7529 21.6429 175.7954 184 Y 4.3625 8.7208 118.8896 58.3387 39.9929 179.4911 184A G 4.0959 7.8260 109.9352 45.5732 0.0000 176.5405 185 L 4.7457 8.9705 128.3560 54.7203 44.1756 177.6581 186 E 4.0737 8.3098 116.0349 56.9312 29.5013 174.8288 187 G 3.7302 8.1289 112.2772 46.7215 0.0000 174.6640 188 K 4.6717 7.2513 122.7317 58.2921 29.9025 179.0782 188A G 3.8597 7.6266 108.7393 48.3298 0.0000 173.7236 189 D 5.3265 8.4071 114.1766 52.1761 41.8532 175.3373 190 S 4.8788 7.6471 114.7921 57.9429 64.2380 172.1336 191 C 4.8412 9.2263 120.3938 54.9942 46.2832 172.7858 192 Q 4.2722 8.6524 119.2194 58.0491 28.4267 178.4419 193 G 4.2181 9.2806 111.1086 45.5909 0.0000 173.8459 194 D 4.6583 8.4407 118.9656 55.5972 41.6019 176.7197 195 S 4.5114 8.1021 115.4201 60.5166 63.5409 175.4996 196 G 4.0401 8.9088 112.5498 46.4528 0.0000 173.7657 197 G 4.5080 7.8765 107.5530 44.8671 0.0000 171.1567 198 P 5.1081 0.0000 0.0000 62.2993 33.5244 175.6228 199 V 4.5676 8.7439 121.5980 61.4305 34.0148 174.1337 200 V 4.8788 8.7536 128.9789 61.3130 33.9920 173.7287 201 C 5.1258 8.7415 124.5308 55.6901 44.0290 174.5856 202 S 3.4029 9.7780 119.9528 59.7492 60.1003 173.2392 203 G 3.9225 8.4253 104.0159 45.7563 0.0000 173.8772 204 K 4.6773 7.6435 117.7615 52.9778 35.2821 175.5784 *209 L 4.2970 8.2495 122.6492 55.4708 41.9887 175.7298 210 Q 4.5329 8.8679 125.8357 56.4548 30.9577 175.8459 211 G 5.2942 8.0599 104.4741 45.6021 0.0000 171.3796 212 I 5.2262 8.2011 119.7374 58.8243 41.1143 175.2308 213 V 3.8794 8.9316 127.1816 64.0963 31.8087 174.1715 214 S 4.9368 8.4434 120.5931 58.4249 64.3773 173.8555 215 W 4.7974 7.3973 113.9677 56.1120 32.0090 172.3506 216 G 3.2528 7.9039 105.2907 45.9878 0.0000 172.4764 217 S 4.5537 8.3266 115.5595 56.5374 63.0396 173.5746 *219 G 4.2393 7.9897 118.1452 45.8098 0.0000 171.4801 220 C 5.2352 9.2778 111.3698 55.2040 35.3670 174.8968 221 Q 5.4764 8.4329 130.8544 57.3844 29.9473 173.2449 221A A 3.8208 6.6796 123.3457 51.8165 16.8563 175.2340 222 K 4.5802 8.3825 121.8320 56.4906 33.8922 175.9917 223 N 4.2801 9.1684 121.6647 54.0112 36.9552 175.4096 224 K 4.2402 7.6239 116.6471 53.7915 32.4543 173.9331 225 P 4.5760 0.0000 0.0000 61.7710 32.8856 177.2722 226 G 3.5305 8.5532 105.8567 46.2824 0.0000 172.4874 227 V 4.3488 7.6851 122.7508 60.6789 34.0085 174.0957 228 Y 4.9452 8.1365 124.2969 55.9585 42.1812 175.0187 229 T 4.3254 8.6142 120.1734 63.7580 70.0353 174.1903 230 K 5.1412 9.3888 128.0140 55.2656 31.3298 177.2231 231 V 3.9908 8.9304 126.3368 65.8047 31.4213 174.8889 232 C 4.3364 8.3079 112.6597 58.2351 41.5094 174.9043 233 N 4.1758 8.0769 117.4521 54.6428 38.4675 175.5293 234 Y 4.7655 7.9279 117.4461 57.4859 38.8854 177.4213 235 V 3.6845 7.8221 120.8158 66.1341 31.5757 177.8640 236 S 4.1136 8.0912 114.3485 61.3431 62.7274 176.2092 237 W 4.2174 8.3470 130.4656 60.5544 30.4095 177.7552 238 I 2.9740 8.2743 119.9533 64.1843 36.6914 178.5258 239 K 3.7565 8.1127 119.3779 59.6303 31.6550 179.5140 240 Q 3.9317 7.9410 117.2809 59.0730 28.8999 178.6648 241 T 3.7580 7.5725 117.1712 66.3886 68.2087 176.8221 242 I 3.1121 7.0982 113.1537 62.8747 37.6494 177.4137 243 A 4.2260 7.4935 121.0041 53.5860 18.3166 177.7716 244 S 4.7002 7.5962 110.9626 57.8104 64.7353 173.9807 245 N 4.6750 8.0497 123.5488 53.6849 39.4875 174.1536 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 4.26 1.79 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.57 0.92 0.00 0.00 17 V 8.65 4.28 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 0.92 0.00 0.00 0.95 0.00 0.00 18 G 8.50 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 0.00 0.00 0.00 19 G 7.74 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 20 Y 8.14 4.97 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 21 T 8.55 4.11 4.29 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 1.21 0.00 0.00 22 C 8.54 3.96 0.00 2.72 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 7.80 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 0.00 0.00 0.00 24 A 8.48 4.28 1.28 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 25 N 8.97 4.30 0.00 2.90 2.94 0.00 0.00 7.18 7.56 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 26 T 7.72 4.12 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 1.30 0.00 0.00 27 V 7.10 4.07 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 0.44 0.00 0.00 0.75 0.00 0.00 28 P 0.00 4.44 0.00 2.37 2.27 0.00 3.67 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 2.17 1.99 0.00 29 Y 6.91 4.95 0.00 3.27 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 7.49 4.56 0.00 1.77 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 1.90 2.48 0.00 31 V 8.99 4.85 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 1.00 0.00 0.00 32 S 8.72 4.96 0.00 3.06 3.31 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 33 L 8.46 4.69 0.00 0.40 0.99 0.79 0.14 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 34 N 9.03 5.87 0.00 2.51 2.46 0.00 0.00 6.60 8.31 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 *37 S 8.48 4.18 0.00 3.66 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 G 9.32 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 0.00 0.00 0.00 39 Y 6.57 4.59 0.00 3.11 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 40 H 8.88 4.54 0.00 2.90 3.21 0.00 5.86 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.89 5.08 0.00 3.13 3.25 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 42 C 6.88 4.77 0.00 2.22 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 43 G 8.79 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 0.00 0.00 0.00 0.00 44 G 7.78 4.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 S 8.81 5.38 0.00 3.82 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 46 L 9.28 4.75 0.00 1.87 1.69 1.08 1.01 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 47 I 8.62 4.41 1.90 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 1.54 0.91 1.00 0.00 0.00 48 N 7.50 4.69 0.00 2.95 3.01 0.00 0.00 6.30 8.15 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 49 S 8.63 4.35 0.00 4.20 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 Q 8.15 4.52 0.00 2.11 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.81 6.87 0.00 0.00 0.00 0.00 0.00 2.25 2.33 0.00 51 W 8.02 5.61 0.00 3.26 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 52 V 9.08 4.93 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.99 0.00 0.00 53 V 8.85 4.75 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 1.00 0.00 0.00 54 S 9.02 5.27 0.00 3.90 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 55 A 8.49 4.53 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 56 A 8.29 3.83 0.29 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 57 H 8.42 4.53 0.00 3.39 3.60 0.00 5.55 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.86 4.67 0.00 3.22 3.35 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 59 Y 7.71 4.24 0.00 2.96 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 60 K 6.97 3.37 0.00 1.43 1.29 0.00 0.61 0.00 0.00 1.20 0.00 0.00 2.41 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.69 0.94 7.81 61 S 7.94 4.22 0.00 3.96 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 62 G 8.47 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 0.00 0.00 0.00 63 I 7.59 4.16 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 1.42 0.65 0.94 0.00 0.00 64 Q 8.92 4.73 0.00 2.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.92 0.00 0.00 0.00 0.00 0.00 2.13 2.22 0.00 65 V 8.71 4.35 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 1.08 0.00 0.00 0.91 0.00 0.00 66 R 8.97 5.09 0.00 1.64 1.75 0.00 2.65 0.00 0.00 2.47 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 1.19 0.00 67 L 9.15 4.76 0.00 1.61 1.63 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 8.31 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 70 E 8.18 4.35 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 2.37 2.06 0.00 71 D 7.94 4.89 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 9.14 4.97 0.00 2.81 2.81 0.00 0.00 7.18 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 73 I 8.42 3.96 1.41 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.50 -0.49 0.00 0.00 74 N 8.50 4.74 0.00 2.82 2.88 0.00 0.00 6.63 8.54 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 75 V 7.36 4.32 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 0.86 0.00 0.00 0.99 0.00 0.00 76 V 8.50 4.02 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 0.90 0.00 0.00 0.99 0.00 0.00 77 E 9.41 4.40 0.00 1.96 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 2.28 2.44 0.00 78 G 8.00 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 0.00 0.00 0.00 79 N 8.17 4.87 0.00 2.77 2.80 0.00 0.00 7.13 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 7.77 4.54 0.00 1.44 1.72 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 2.47 2.46 0.00 81 Q 8.99 4.45 0.00 1.98 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.02 0.00 0.00 0.00 0.00 0.00 2.22 2.28 0.00 82 F 8.79 5.58 0.00 2.81 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 83 I 8.87 4.67 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.88 0.95 0.00 0.00 84 S 8.76 4.59 0.00 3.75 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 85 A 8.58 4.55 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 86 S 8.88 4.56 0.00 3.79 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 K 7.52 4.66 0.00 1.86 1.90 0.00 1.58 0.00 0.00 1.90 0.00 0.00 2.82 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.26 1.48 7.81 88 S 8.78 5.27 0.00 4.01 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 89 I 9.17 4.59 2.05 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.04 1.16 0.00 0.00 90 V 8.45 4.17 2.02 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 0.79 0.00 0.00 0.81 0.00 0.00 91 H 8.64 3.52 0.00 2.78 3.02 0.00 5.64 0.00 0.00 0.00 0.00 6.60 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 4.33 0.00 2.17 2.16 0.00 2.30 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.85 0.00 93 S 7.92 4.68 0.00 3.92 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 8.05 4.32 0.00 3.03 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 95 N 8.36 4.62 0.00 2.57 2.45 0.00 0.00 6.48 6.92 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 96 S 7.62 3.89 0.00 3.97 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 97 N 8.32 4.32 0.00 2.76 2.78 0.00 0.00 6.82 7.63 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 98 T 7.73 3.89 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 99 L 7.80 3.73 0.00 1.36 1.84 0.66 0.95 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 0.00 100 N 7.79 4.38 0.00 2.80 2.66 0.00 0.00 7.24 6.73 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 0.00 101 N 8.72 4.92 0.00 2.93 2.60 0.00 0.00 7.42 8.08 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 0.00 102 D 7.89 4.64 0.00 3.06 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 7.11 4.89 1.44 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 1.56 1.13 0.06 0.00 0.00 104 M 9.25 5.53 0.00 2.07 2.30 0.00 0.00 0.00 0.00 0.00 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.59 0.00 105 L 9.25 5.38 0.00 1.67 1.86 -0.08 1.06 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 9.11 5.03 1.94 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 1.22 0.94 0.92 0.00 0.00 107 K 8.66 3.85 0.00 0.79 1.13 0.00 1.10 0.00 0.00 1.32 0.00 0.00 2.60 0.00 0.00 2.64 0.00 0.00 0.00 0.00 0.72 0.21 7.81 108 L 8.34 4.44 0.00 1.50 1.57 0.96 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.83 4.17 0.00 1.64 1.83 0.00 1.62 0.00 0.00 1.73 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.44 7.81 110 S 7.45 4.58 0.00 3.95 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 8.43 4.36 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 8.87 4.21 1.28 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 0.00 113 S 8.98 4.44 0.00 3.88 3.81 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 0.00 114 L 8.48 4.47 0.00 1.70 1.62 0.96 1.06 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 0.00 115 N 8.87 4.89 0.00 2.88 2.92 0.00 0.00 6.43 8.53 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 0.00 116 S 8.73 4.23 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 0.00 117 R 8.54 4.39 0.00 1.88 2.00 0.00 3.11 0.00 0.00 3.23 7.31 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.53 4.93 0.00 3.97 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 0.00 128 C 8.41 4.36 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 7.37 4.25 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 S 8.10 4.46 0.00 3.83 3.72 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 *132 A 8.30 4.18 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 0.00 133 G 8.87 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 0.00 0.00 0.00 134 T 7.59 4.03 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 1.16 0.00 0.00 135 Q 8.63 4.66 0.00 1.94 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.84 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 136 C 9.37 5.20 0.00 2.76 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 0.00 137 L 8.97 5.11 0.00 1.76 1.59 1.04 1.17 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 0.00 138 I 9.07 5.29 1.87 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 1.62 0.95 0.00 0.00 139 S 8.50 4.86 0.00 3.54 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 G 7.50 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 0.00 141 W 8.61 4.59 0.00 3.15 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 G 8.58 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 N 8.57 3.92 0.00 2.25 2.59 0.00 0.00 7.06 7.94 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 0.00 144 T 8.38 5.10 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 1.23 0.00 0.00 145 K 7.86 4.58 0.00 1.94 1.88 0.00 1.62 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.31 1.33 7.81 146 S 8.79 4.26 0.00 3.83 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 0.00 147 S 8.15 4.49 0.00 3.85 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 0.00 148 G 9.63 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 T 7.96 4.81 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 1.43 0.00 0.00 150 S 9.21 4.58 0.00 3.84 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 0.00 151 Y 8.73 4.94 0.00 2.90 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 0.00 152 P 0.00 4.69 0.00 2.42 2.08 0.00 4.10 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 1.99 0.00 153 D 8.67 4.67 0.00 3.12 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 0.00 154 V 7.43 5.17 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.96 0.00 0.00 155 L 8.42 3.20 0.00 1.30 1.24 -0.76 0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.15 4.85 0.00 1.66 1.50 0.00 1.59 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 1.40 1.46 7.81 157 C 8.46 5.21 0.00 1.40 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 0.00 158 L 8.69 5.03 0.00 1.72 1.47 1.02 1.17 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 0.00 159 K 9.06 5.11 0.00 1.80 1.82 0.00 1.87 0.00 0.00 1.83 0.00 0.00 2.83 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.64 1.45 7.81 160 A 9.28 4.93 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 0.00 161 P 0.00 5.05 0.00 2.02 2.09 0.00 3.05 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 1.83 1.73 0.00 162 I 8.40 4.29 1.92 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.73 0.83 0.00 0.00 163 L 8.72 4.89 0.00 1.56 1.60 0.92 1.04 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 0.00 164 S 8.53 4.31 0.00 4.01 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 0.00 165 D 8.78 4.42 0.00 2.74 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 S 8.02 4.17 0.00 4.06 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 S 8.17 4.06 0.00 3.93 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 168 C 8.46 4.33 0.00 3.21 3.31 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 0.00 169 K 8.56 4.02 0.00 1.85 1.90 0.00 1.76 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.54 1.72 7.81 170 S 8.19 4.25 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 7.93 4.04 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 Y 7.77 4.85 0.00 3.10 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 4.51 0.00 2.08 2.03 0.00 3.87 0.00 0.00 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.17 0.00 174 G 9.04 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 0.00 175 Q 8.09 4.51 0.00 2.42 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.93 6.90 0.00 0.00 0.00 0.00 0.00 2.27 2.50 0.00 176 I 7.96 4.37 1.98 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 1.83 1.05 1.00 0.00 0.00 177 T 8.27 4.52 4.29 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 1.28 0.00 0.00 178 S 8.54 4.38 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 8.32 5.00 0.00 3.10 3.11 0.00 0.00 7.00 7.76 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 0.00 180 M 7.95 5.59 0.00 1.86 2.11 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.63 0.00 181 F 8.82 5.12 0.00 3.11 3.08 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 0.00 182 C 8.96 5.36 0.00 2.98 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 A 8.92 5.04 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 0.00 184 Y 8.72 4.36 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 184A G 7.83 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 L 8.97 4.75 0.00 1.69 1.65 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.31 4.07 0.00 2.02 2.02 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 2.35 2.29 0.00 187 G 8.13 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 0.00 188 K 7.25 4.67 0.00 1.87 1.98 0.00 1.39 0.00 0.00 1.42 0.00 0.00 2.29 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.46 1.16 7.81 188A G 7.63 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 D 8.41 5.33 0.00 2.99 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 S 7.65 4.88 0.00 4.18 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 0.00 191 C 9.23 4.84 0.00 2.91 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 192 Q 8.65 4.27 0.00 2.27 2.23 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 2.53 2.43 0.00 193 G 9.28 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 D 8.44 4.66 0.00 2.94 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 0.00 195 S 8.10 4.51 0.00 4.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 G 8.91 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 0.00 197 G 7.88 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 5.11 0.00 2.34 2.39 0.00 3.69 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.19 0.00 199 V 8.74 4.57 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.52 0.00 0.00 200 V 8.75 4.88 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.67 0.00 0.00 201 C 8.74 5.13 0.00 2.80 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 0.00 202 S 9.78 3.40 0.00 3.94 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 0.00 203 G 8.43 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 0.00 204 K 7.64 4.68 0.00 1.72 1.66 0.00 1.87 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.40 7.81 *209 L 8.25 4.30 0.00 1.51 1.65 0.97 0.76 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 0.00 210 Q 8.87 4.53 0.00 2.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.55 6.49 0.00 0.00 0.00 0.00 0.00 2.42 2.36 0.00 211 G 8.06 5.29 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 0.00 212 I 8.20 5.23 1.93 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 1.30 1.14 0.99 0.00 0.00 213 V 8.93 3.88 2.39 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 1.00 0.00 0.00 1.23 0.00 0.00 214 S 8.44 4.94 0.00 4.02 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 0.00 215 W 7.40 4.80 0.00 3.35 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 0.00 216 G 7.90 3.25 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 0.00 217 S 8.33 4.55 0.00 4.16 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *219 G 7.99 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 C 9.28 5.24 0.00 2.93 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 Q 8.43 5.48 0.00 2.18 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.79 0.00 0.00 0.00 0.00 0.00 2.24 2.06 0.00 221A A 6.68 3.82 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 0.00 222 K 8.38 4.58 0.00 1.72 1.69 0.00 1.92 0.00 0.00 1.71 0.00 0.00 3.06 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.33 1.57 7.81 223 N 9.17 4.28 0.00 2.82 2.82 0.00 0.00 6.74 7.56 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 0.00 224 K 7.62 4.24 0.00 1.70 1.74 0.00 1.44 0.00 0.00 1.12 0.00 0.00 2.84 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.46 7.81 225 P 0.00 4.58 0.00 2.23 2.10 0.00 3.64 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 2.11 1.98 0.00 226 G 8.55 3.53 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 0.00 0.00 0.00 0.00 0.00 0.00 227 V 7.69 4.35 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 0.42 0.00 0.00 -0.75 0.00 0.00 228 Y 8.14 4.95 0.00 1.44 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 T 8.61 4.33 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 230 K 9.39 5.14 0.00 2.14 1.92 0.00 1.84 0.00 0.00 1.60 0.00 0.00 3.04 0.00 0.00 3.33 0.00 0.00 0.00 0.00 1.52 1.61 7.81 231 V 8.93 3.99 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 1.13 0.00 0.00 232 C 8.31 4.34 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 8.08 4.18 0.00 2.29 2.34 0.00 0.00 7.00 7.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 234 Y 7.93 4.77 0.00 3.29 3.31 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 0.00 235 V 7.82 3.68 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 1.26 0.00 0.00 1.10 0.00 0.00 236 S 8.09 4.11 0.00 3.97 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 0.00 237 W 8.35 4.22 0.00 3.49 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 I 8.27 2.97 1.96 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 1.49 0.94 0.68 0.00 0.00 239 K 8.11 3.76 0.00 1.78 1.78 0.00 1.64 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.57 7.81 240 Q 7.94 3.93 0.00 1.92 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.96 0.00 0.00 0.00 0.00 0.00 2.37 2.53 0.00 241 T 7.57 3.76 3.45 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 0.74 0.00 0.00 242 I 7.10 3.11 0.97 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.25 -0.75 0.00 0.00 243 A 7.49 4.23 1.33 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 0.00 244 S 7.60 4.70 0.00 3.81 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 0.00 245 N 8.05 4.67 0.00 3.03 2.96 0.00 0.00 7.08 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.