NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.1683 7.8827 121.4525 60.8737 37.8438 174.2721 17 V 4.4576 8.1667 127.1685 62.4354 32.2133 173.9832 18 G 3.9844 8.4365 116.2925 46.1806 0.0000 170.5401 19 G 4.4904 7.5465 104.5180 44.7946 0.0000 170.5911 20 Y 5.1111 8.1945 116.5463 55.0044 41.5685 175.3054 21 T 4.1790 8.6146 118.0799 64.0409 68.5806 175.3903 22 C 4.2760 8.8269 124.8924 58.5632 40.4521 174.4213 23 G 4.0212 8.0519 108.2441 44.6026 0.0000 177.1828 24 A 3.4309 9.0405 122.9757 52.4209 17.8224 179.2421 25 N 4.3370 8.5967 117.5563 53.3471 40.4033 172.4882 26 T 4.5893 8.4259 112.3352 60.8830 70.4942 174.9595 27 V 3.9346 7.0264 120.9252 60.8088 31.2294 173.8754 28 P 4.3322 0.0000 0.0000 65.1657 32.1129 178.1377 29 Y 5.1122 7.0664 113.9322 57.3876 38.5677 174.9207 30 Q 4.6099 6.9444 122.8878 56.5322 29.7942 175.4757 31 V 4.8102 8.7115 117.1015 60.0206 36.9356 173.6754 32 S 4.8917 9.3924 118.7513 56.7574 64.7402 172.7204 33 L 4.6154 8.5581 127.4582 53.2920 43.0464 174.8953 34 N 6.0402 9.4131 123.4191 50.2701 41.6713 174.6503 *37 S 4.2042 8.1798 118.9911 57.9117 63.9371 171.9764 38 G 4.1886 10.4431 109.9552 46.4308 0.0000 171.7003 39 Y 4.7932 6.5080 114.9279 55.2435 41.0145 173.1020 40 H 4.6736 8.7977 120.7581 56.1911 30.2061 174.4685 41 F 5.1011 8.0225 119.6222 56.5699 39.5359 173.3813 42 C 4.5776 6.7458 115.5104 56.7037 44.7870 172.2822 43 G 4.2067 8.5174 108.2864 46.1356 0.0000 172.5558 44 G 4.4188 7.6790 104.8088 46.5098 0.0000 172.7808 45 S 5.4965 8.4157 116.5840 56.3269 66.2998 173.4588 46 L 4.5377 9.0739 127.0578 54.8660 42.1425 177.3799 47 I 4.0589 8.5535 128.1680 61.6680 37.9949 176.0447 48 N 4.3754 8.5131 119.6224 53.3401 38.6531 177.5021 49 S 3.8355 6.8426 114.8600 58.3967 65.3844 175.0032 50 Q 4.0096 8.0415 117.6397 54.7576 30.6561 174.8833 51 W 5.2488 8.7138 119.7559 54.7127 32.7372 174.9191 52 V 5.0321 9.3145 122.7095 61.1898 34.4379 174.4336 53 V 4.8695 8.8009 127.6572 60.6933 34.0953 174.9213 54 S 4.9912 9.1921 117.0367 57.1748 66.8542 172.6652 55 A 4.2487 8.4727 124.0043 51.5877 18.7006 178.4889 56 A 3.9292 8.4660 126.4383 55.3126 18.5011 178.6037 57 H 4.4300 8.0724 108.9283 57.1461 28.6129 175.1741 58 C 4.8149 8.0699 117.7490 57.0196 40.2847 173.1438 59 Y 4.2909 7.6779 122.2616 57.6708 38.8385 175.1583 60 K 4.3813 7.0245 124.3281 54.7200 36.2668 175.6383 61 S 3.9900 8.3043 116.0787 59.2878 63.8848 174.5427 62 G 3.8753 8.3264 110.7393 46.6548 0.0000 172.1502 63 I 4.3305 7.1320 122.1928 60.8251 40.1108 174.9412 64 Q 4.7479 8.8837 123.5003 54.1638 32.1066 174.6597 65 V 4.4003 8.8244 124.8123 61.8370 33.4109 174.7065 66 R 4.7300 9.0316 127.5968 54.6735 31.5008 175.7657 67 L 4.4966 8.3916 124.7420 52.6186 44.7376 177.3035 *69 G 4.3031 8.2234 106.2026 45.5264 0.0000 173.1503 70 E 4.3333 7.6777 118.3675 55.7245 30.3740 174.9025 71 D 4.8612 8.5090 117.7678 54.7360 43.8748 174.2787 72 N 5.5279 7.9988 116.7051 51.8105 40.9233 174.7417 73 I 4.2045 8.1273 120.9610 60.3659 38.0641 175.7090 74 N 4.9951 8.0395 116.0598 54.7907 45.7800 175.4269 75 V 4.4144 7.9125 116.5344 60.7234 33.6411 176.6310 76 V 4.6604 7.9290 124.9839 62.6429 29.5526 175.8868 77 E 4.2116 8.2133 127.8415 54.8444 27.5444 174.5444 78 G 3.8801 7.3866 108.5664 46.4943 0.0000 171.4729 79 N 4.4528 8.0298 120.3067 52.1257 39.4335 174.8795 80 E 4.5110 8.6752 124.1319 54.6458 32.0720 174.0706 81 Q 4.3943 8.4614 125.2460 54.5103 32.1757 173.9579 82 F 4.9672 9.2204 123.4831 56.1935 40.0363 175.4540 83 I 4.6151 8.7157 125.6375 59.2527 40.1926 176.0499 84 S 4.6136 8.7037 121.7795 58.4749 64.4528 172.7928 85 A 4.5186 7.8688 124.6760 50.8681 19.1877 177.0077 86 S 4.1258 9.3790 120.1615 60.1051 62.3883 173.7284 87 K 4.6218 7.6593 117.5756 54.6671 35.1780 174.8907 88 S 4.9269 8.8545 120.4887 56.9141 64.4525 173.0481 89 I 4.3737 9.1265 126.7358 59.9538 37.7008 175.5537 90 V 4.2593 8.3634 127.3826 62.2912 32.7428 175.1396 91 H 3.7133 8.7264 126.9663 55.1012 30.3808 174.3652 92 P 4.4508 0.0000 0.0000 64.6416 30.9734 176.7124 93 S 4.5679 7.7486 111.7083 58.3596 65.5322 173.1247 94 Y 4.2174 8.4175 123.8937 57.8736 38.9694 174.4764 95 N 4.6222 8.4405 126.4132 51.3734 39.4528 175.4846 96 S 4.5761 7.7560 120.6398 60.0592 63.1892 175.2672 97 N 4.4618 7.9090 118.1590 55.7975 38.9254 176.6272 98 T 3.7669 8.3020 107.5375 62.4477 69.1661 174.7263 99 L 3.8630 7.9595 120.9894 55.6882 39.5360 173.6582 100 N 4.6826 7.8787 116.6385 54.0409 39.6821 174.5719 101 N 4.8184 8.8886 120.4084 54.7914 35.7062 175.4548 102 D 4.6144 8.0331 117.7137 53.9156 38.7223 174.0533 103 I 4.7233 7.1210 120.8329 59.2140 42.2832 172.9349 104 M 5.5292 9.4474 127.9392 54.1132 36.3344 173.2142 105 L 5.4493 9.5860 124.6123 53.1231 45.1976 175.3534 106 I 4.9615 9.4626 124.1689 59.3494 40.4998 174.2729 107 K 3.9501 8.4902 128.0942 54.0204 34.0016 175.2108 108 L 4.3552 8.3081 128.5667 54.4479 41.8067 176.7765 109 K 3.9273 8.9932 126.2784 59.2886 32.2504 176.9231 110 S 4.7487 7.7926 112.7707 56.0604 65.7227 173.4798 111 A 4.3472 8.3608 125.1025 51.6625 18.7039 177.5003 112 A 4.1608 9.4057 126.1772 51.9434 19.4512 178.3894 113 S 4.4436 8.2387 115.9337 57.1337 62.2266 174.1408 114 L 4.3690 8.4642 127.1002 54.9216 41.0789 177.4756 115 N 4.1593 8.1482 115.8992 53.5730 42.2357 175.0860 116 S 4.2797 8.6979 111.4839 61.4115 62.8536 174.8393 117 R 4.0939 6.9981 119.3742 56.9956 30.6632 175.9623 118 V 4.2468 8.8978 116.7039 61.7165 32.7510 175.1338 119 A 5.1776 8.1976 128.1588 50.1263 22.8567 174.9998 120 S 5.0046 8.7246 114.1488 57.9173 64.5712 173.4187 121 I 4.2830 8.4288 122.3377 59.8989 39.1177 175.1632 122 S 4.6573 7.8019 123.2715 57.4966 64.5018 174.1431 123 L 4.1840 8.3127 122.7845 53.6047 42.3459 175.2662 124 P 4.6069 0.0000 0.0000 62.7320 32.5942 175.8968 125 T 4.3006 8.1614 107.2809 62.2101 70.7711 174.3896 *127 S 4.7695 7.6684 115.6854 58.0988 63.9944 174.2363 128 C 4.3132 8.5529 121.1582 56.5981 40.6175 173.5280 129 A 4.1060 8.1333 126.5829 51.9846 18.7287 177.8413 130 S 4.0396 8.3576 119.1107 58.1941 63.7736 173.3676 *132 A 4.1676 8.2897 125.8085 53.4103 19.3303 176.5210 133 G 4.0884 8.9637 110.3040 45.6625 0.0000 174.7104 134 T 3.9177 7.7438 117.3015 63.8977 69.4296 173.2945 135 Q 4.6847 8.5858 127.4644 55.6964 30.3423 175.1299 136 C 5.2296 9.4255 122.7309 55.1283 46.9220 172.3230 137 L 5.1818 9.1495 121.7083 53.6852 44.1149 174.9955 138 I 5.1623 9.0667 127.9205 59.1512 39.4959 175.0705 139 S 4.8800 8.2807 118.9953 56.8580 66.5127 172.9487 140 G 3.8415 7.4423 107.1000 46.6597 0.0000 173.4231 141 W 4.7533 8.9404 117.2786 56.0273 29.7180 176.4270 142 G 4.1190 8.5393 109.0592 44.9450 0.0000 172.8423 143 N 3.9467 8.5451 117.9163 54.2162 39.3548 174.3374 144 T 4.6045 8.1337 112.5900 61.8673 70.4260 175.2483 145 K 4.5172 7.8400 120.7082 55.6444 33.0198 177.1157 146 S 4.1615 8.7565 117.9333 60.7169 63.3401 174.4421 147 S 4.4708 7.8769 118.3020 59.5919 63.8887 173.5248 148 G 4.0279 8.7124 112.4164 44.6301 0.0000 172.0149 149 T 4.3755 8.1842 109.9593 59.8260 70.1518 174.9773 150 S 4.3966 9.0920 121.3406 56.3320 62.6514 170.2222 151 Y 4.4509 8.1716 120.9956 55.8763 38.1725 174.1349 152 P 4.5725 0.0000 0.0000 62.8365 32.3889 176.1860 153 D 4.5902 8.7960 119.5433 56.4447 41.4592 176.9324 154 V 5.3675 7.4449 110.2040 58.6209 34.0843 175.9896 155 L 3.2823 8.4153 125.1585 55.0507 43.2072 175.8090 156 K 4.8909 8.3721 125.0370 54.8753 35.0903 174.5974 157 C 5.1612 8.6035 119.8085 55.1161 42.6696 173.1059 158 L 4.9231 8.5011 122.9942 53.8805 45.3106 174.7594 159 K 4.9899 9.0470 125.9551 55.9539 33.3798 176.1030 160 A 4.6869 9.0864 124.5218 50.9665 23.1604 173.9853 161 P 5.0088 0.0000 0.0000 61.8179 34.2808 174.6967 162 I 4.4220 8.3601 121.8995 60.6310 37.9922 176.2277 163 L 4.6971 8.4468 127.8303 53.8451 42.9192 177.1520 164 S 4.2619 8.5582 115.6936 57.9802 63.8731 174.7328 165 D 4.4084 9.0165 123.5059 57.7451 40.6629 179.0927 166 S 4.1240 8.0187 114.2323 61.6702 63.2287 176.3569 167 S 4.5901 7.6376 120.8855 60.5390 62.5008 175.5898 168 C 4.3437 8.5432 121.2709 59.6779 40.6802 175.5313 169 K 3.9016 8.8205 120.4073 59.5879 31.9203 179.5302 170 S 4.1324 8.6665 114.5345 61.4710 62.6926 176.4288 171 A 3.8900 8.0118 123.6197 53.4554 19.3515 177.4164 172 Y 4.6796 7.9002 115.5504 54.4571 38.2155 171.2736 173 P 4.3592 0.0000 0.0000 63.1253 31.5126 178.7687 174 G 4.2116 9.0988 114.9930 46.8004 0.0000 174.3170 175 Q 4.0595 8.6743 118.1517 58.6579 28.8498 176.7665 176 I 4.0203 7.5706 118.8441 61.2976 36.7996 175.9486 177 T 4.4764 8.3368 116.9708 60.0924 70.4941 175.4828 178 S 4.3590 8.5527 114.7705 60.3156 63.3391 174.3989 179 N 4.9962 8.1894 118.2906 53.2624 38.5565 173.7585 180 M 5.5775 7.8387 116.9229 53.8337 36.2189 174.8962 181 F 5.0616 8.7461 115.1080 56.0270 41.8426 173.0009 182 C 5.2113 9.1080 118.6643 56.8171 40.4988 172.2564 183 A 4.9236 9.0371 121.7332 51.0876 22.3403 174.3336 184A G 3.6900 7.1433 107.4159 44.3595 0.0000 174.8085 184 Y 4.7550 8.2805 122.4477 55.9335 41.0232 175.9894 185 L 4.0180 8.8335 125.6868 57.7006 42.1178 179.3767 186 E 3.6498 8.2836 118.7193 57.6824 29.7627 176.3534 187 G 3.8368 7.8696 103.2746 44.3989 0.0000 171.9178 188A G 4.1151 9.5493 105.2701 44.8701 0.0000 173.6918 188 K 5.0456 7.4853 117.4593 55.1334 35.5145 175.3567 189 D 4.6455 8.9458 123.0956 53.3894 45.4551 175.1705 190 S 4.6101 8.1572 115.8059 58.6731 64.3791 172.0377 191 C 4.7805 9.8835 119.1739 55.1393 48.0566 172.6268 192 Q 4.1054 8.6001 120.4879 57.8348 28.2813 178.7147 193 G 4.3112 9.3149 110.8303 45.5984 0.0000 173.4277 194 D 4.8157 8.5239 118.8603 54.0499 41.9952 176.7384 195 S 4.4850 7.9522 116.2274 60.1523 63.4051 176.0213 196 G 4.4972 8.5032 110.1971 46.2460 0.0000 174.0901 197 G 4.2136 7.7350 107.5523 45.4692 0.0000 171.3801 198 P 4.9405 0.0000 0.0000 62.3467 33.5462 175.6632 199 V 4.6134 8.4693 120.4437 61.3528 33.9238 173.7040 200 V 4.6846 8.6441 128.3418 61.4727 33.6447 173.8608 201 C 5.0480 8.8410 124.7539 55.3554 43.6560 174.6175 202 S 3.6506 9.6262 121.6227 59.7280 59.1096 173.4769 203 G 3.8967 8.1176 105.6092 45.6490 0.0000 173.2095 204 K 4.8057 7.5809 118.3420 53.3922 34.7605 175.4364 *209 L 4.2287 8.1224 122.0920 55.3333 41.9657 176.0727 210 Q 4.2744 9.1033 126.3488 58.1858 30.3550 176.1062 211 G 5.2640 8.0229 103.6932 46.3182 0.0000 171.6358 212 I 5.1725 8.2070 120.1362 58.7963 40.5414 175.5695 213 V 3.3873 8.7746 127.0278 64.3165 31.7358 174.0195 214 S 4.9429 8.2391 121.6346 58.2532 64.5108 175.2434 215 W 5.1459 7.0698 114.3024 55.2816 32.4888 173.2784 216 G 3.9324 8.3600 106.8766 46.7001 0.0000 172.2547 217 S 4.7243 8.1573 116.7389 57.2128 63.6801 173.2733 *219 G 4.2155 8.0911 115.7995 45.3960 0.0000 172.6393 220 C 4.8565 8.2769 118.9685 56.5387 41.0035 173.8870 221A A 3.8124 9.2365 125.6866 53.0057 16.8516 176.7271 221 Q 4.3919 7.5062 117.5663 56.3826 29.3498 176.0707 222 K 4.2492 8.6145 123.4161 58.2176 32.6055 175.7787 223 N 4.2524 9.4669 121.3716 53.9681 36.8893 175.2743 224 K 4.3210 7.6310 117.5693 53.8533 32.5503 174.2527 225 P 4.5869 0.0000 0.0000 61.4500 32.7780 176.6405 226 G 3.5980 8.0579 107.8784 45.9049 0.0000 172.6277 227 V 4.4323 7.8130 123.6317 61.0145 33.5851 174.2436 228 Y 4.6961 8.2497 123.7285 56.0950 42.4628 174.7181 229 T 4.4817 8.4848 118.9367 63.3948 70.1462 174.7890 230 K 4.9012 9.2366 127.7283 55.6575 31.0420 177.3034 231 V 3.9309 9.0555 126.1400 65.8260 31.4559 174.8809 232 C 4.3731 8.3424 113.6202 58.5956 41.2450 175.3504 233 N 4.1853 8.1041 117.4552 54.8957 38.3584 175.8109 234 Y 4.7801 7.7032 116.9215 57.5572 38.4859 177.2456 235 V 3.6755 7.5531 120.5026 66.3388 31.5192 178.1407 236 S 4.0914 8.0765 114.0433 61.3645 62.7346 176.0724 237 W 4.2044 8.3759 130.3890 60.7406 30.4411 177.4078 238 I 3.0420 8.2021 119.7521 64.3931 36.6636 178.2487 239 K 3.6824 8.0783 118.9268 59.5830 31.8467 179.2136 240 Q 3.7993 8.3001 119.8165 59.4023 29.0116 178.1441 241 T 3.5246 7.4101 116.9764 66.6529 68.1320 176.5260 242 I 2.5449 6.6733 119.7752 63.9853 37.0990 178.2365 243 A 4.0578 7.4456 119.5257 54.4348 18.2123 178.9344 244 S 4.4805 7.5980 111.8939 59.2950 63.6923 174.6088 245 N 4.8122 8.0348 123.3721 53.2976 38.8248 174.3428 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 4.17 1.81 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 1.25 1.01 0.88 0.00 0.00 17 V 8.17 4.46 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 1.00 0.00 0.00 0.96 0.00 0.00 18 G 8.44 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 19 G 7.55 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 Y 8.19 5.11 0.00 3.03 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 21 T 8.61 4.18 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 1.30 0.00 0.00 22 C 8.83 4.28 0.00 2.84 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 23 G 8.05 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 24 A 9.04 3.43 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 25 N 8.60 4.34 0.00 2.61 2.69 0.00 0.00 6.65 7.70 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 26 T 8.43 4.59 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 27 V 7.03 3.93 1.69 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 0.36 0.00 0.00 0.73 0.00 0.00 28 P 0.00 4.33 0.00 2.25 2.33 0.00 3.53 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.03 0.00 29 Y 7.07 5.11 0.00 3.24 3.38 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 30 Q 6.94 4.61 0.00 1.69 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.70 0.00 0.00 0.00 0.00 0.00 1.87 2.41 0.00 31 V 8.71 4.81 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 0.67 0.00 0.00 1.00 0.00 0.00 32 S 9.39 4.89 0.00 3.28 3.33 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 33 L 8.56 4.62 0.00 0.79 0.83 0.73 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 34 N 9.41 6.04 0.00 2.55 2.68 0.00 0.00 6.77 7.51 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 *37 S 8.18 4.20 0.00 3.60 3.41 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 0.00 0.00 0.00 0.00 38 G 10.44 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 0.00 0.00 0.00 39 Y 6.51 4.79 0.00 3.10 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 40 H 8.80 4.67 0.00 2.95 3.22 0.00 5.86 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 8.02 5.10 0.00 3.10 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 C 6.75 4.58 0.00 1.96 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 43 G 8.52 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 44 G 7.68 4.42 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 0.00 0.00 0.00 45 S 8.42 5.50 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 9.07 4.54 0.00 1.84 1.67 1.09 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.55 4.06 1.96 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 1.37 0.74 0.91 0.00 0.00 48 N 8.51 4.38 0.00 2.94 2.97 0.00 0.00 6.10 7.64 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 49 S 6.84 3.84 0.00 4.09 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 0.00 50 Q 8.04 4.01 0.00 2.04 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.87 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 51 W 8.71 5.25 0.00 3.40 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 52 V 9.31 5.03 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.95 0.00 0.00 53 V 8.80 4.87 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 0.75 0.00 0.00 1.07 0.00 0.00 54 S 9.19 4.99 0.00 3.84 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 55 A 8.47 4.25 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 56 A 8.47 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 H 8.07 4.43 0.00 3.32 3.38 0.00 5.55 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 8.07 4.81 0.00 3.11 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 Y 7.68 4.29 0.00 3.04 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 K 7.02 4.38 0.00 1.44 1.29 0.00 0.61 0.00 0.00 1.01 0.00 0.00 2.33 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.06 1.11 7.81 61 S 8.30 3.99 0.00 3.93 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 62 G 8.33 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 I 7.13 4.33 1.84 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.67 1.03 0.00 0.00 64 Q 8.88 4.75 0.00 1.95 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.87 0.00 0.00 0.00 0.00 0.00 2.26 2.25 0.00 65 V 8.82 4.40 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 0.90 0.00 0.00 0.88 0.00 0.00 66 R 9.03 4.73 0.00 1.34 1.54 0.00 2.69 0.00 0.00 2.72 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.99 0.00 67 L 8.39 4.50 0.00 1.64 1.62 0.96 0.86 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 *69 G 8.22 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 70 E 7.68 4.33 0.00 2.19 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 1.99 0.00 71 D 8.51 4.86 0.00 2.69 2.61 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 72 N 8.00 5.53 0.00 2.76 2.72 0.00 0.00 6.94 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 73 I 8.13 4.20 1.36 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.23 0.13 -0.57 0.00 0.00 74 N 8.04 5.00 0.00 2.98 2.84 0.00 0.00 6.96 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 V 7.91 4.41 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 0.83 0.00 0.00 0.95 0.00 0.00 76 V 7.93 4.66 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 1.06 0.00 0.00 0.96 0.00 0.00 77 E 8.21 4.21 0.00 2.05 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.50 0.00 78 G 7.39 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 N 8.03 4.45 0.00 3.00 2.80 0.00 0.00 6.54 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 8.68 4.51 0.00 2.06 1.89 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 2.46 2.95 0.00 81 Q 8.46 4.39 0.00 1.99 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.68 0.00 0.00 0.00 0.00 0.00 2.38 2.41 0.00 82 F 9.22 4.97 0.00 2.76 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 8.72 4.62 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 1.24 0.79 0.93 0.00 0.00 84 S 8.70 4.61 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 7.87 4.52 1.21 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 86 S 9.38 4.13 0.00 3.73 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 K 7.66 4.62 0.00 1.68 1.73 0.00 1.47 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.48 1.51 7.81 88 S 8.85 4.93 0.00 3.94 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 I 9.13 4.37 2.16 0.00 0.00 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 1.29 0.84 1.20 0.00 0.00 90 V 8.36 4.26 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 0.74 0.00 0.00 0.82 0.00 0.00 91 H 8.73 3.71 0.00 2.68 2.96 0.00 5.65 0.00 0.00 0.00 0.00 6.71 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 4.45 0.00 2.15 2.14 0.00 2.65 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.86 0.00 93 S 7.75 4.57 0.00 3.89 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 94 Y 8.42 4.22 0.00 3.05 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 95 N 8.44 4.62 0.00 2.60 2.50 0.00 0.00 6.54 7.21 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 96 S 7.76 4.58 0.00 3.94 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 97 N 7.91 4.46 0.00 2.82 2.78 0.00 0.00 6.97 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 T 8.30 3.77 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 1.12 0.00 0.00 99 L 7.96 3.86 0.00 1.37 1.81 0.50 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.88 4.68 0.00 2.85 2.67 0.00 0.00 7.31 6.02 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 0.00 101 N 8.89 4.82 0.00 2.95 2.67 0.00 0.00 7.23 8.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 D 8.03 4.61 0.00 2.91 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 0.00 103 I 7.12 4.72 1.27 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 1.36 1.17 0.19 0.00 0.00 104 M 9.45 5.53 0.00 2.10 1.84 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.69 0.00 105 L 9.59 5.45 0.00 1.77 1.88 -0.02 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 106 I 9.46 4.96 2.01 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 1.17 0.79 0.86 0.00 0.00 107 K 8.49 3.95 0.00 0.79 0.96 0.00 1.20 0.00 0.00 1.32 0.00 0.00 2.67 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.78 0.21 7.81 108 L 8.31 4.36 0.00 1.50 1.57 0.93 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.99 3.93 0.00 1.71 1.89 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.87 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.42 7.81 110 S 7.79 4.75 0.00 3.84 3.70 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 0.00 0.00 0.00 0.00 111 A 8.36 4.35 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 0.00 112 A 9.41 4.16 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 0.00 113 S 8.24 4.44 0.00 4.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 L 8.46 4.37 0.00 1.68 1.67 0.98 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.15 4.16 0.00 2.90 3.00 0.00 0.00 6.88 8.42 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 0.00 116 S 8.70 4.28 0.00 4.01 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 R 7.00 4.09 0.00 2.00 2.00 0.00 3.32 0.00 0.00 3.16 7.66 0.00 0.00 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0.00 1.19 0.00 0.00 *127 S 7.67 4.77 0.00 3.88 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 0.00 128 C 8.55 4.31 0.00 2.90 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 A 8.13 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 S 8.36 4.04 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 *132 A 8.29 4.17 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 G 8.96 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 0.00 0.00 0.00 0.00 134 T 7.74 3.92 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 135 Q 8.59 4.68 0.00 2.06 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.79 0.00 0.00 0.00 0.00 0.00 2.33 2.41 0.00 136 C 9.43 5.23 0.00 2.74 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 0.00 137 L 9.15 5.18 0.00 1.73 1.55 1.03 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.07 5.16 1.87 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 1.35 1.01 0.00 0.00 139 S 8.28 4.88 0.00 3.60 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 0.00 140 G 7.44 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 0.00 0.00 0.00 141 W 8.94 4.75 0.00 3.25 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 8.54 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 N 8.55 3.95 0.00 1.85 2.57 0.00 0.00 7.11 7.33 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 0.00 144 T 8.13 4.60 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 1.21 0.00 0.00 145 K 7.84 4.52 0.00 1.87 1.88 0.00 1.71 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.42 1.38 7.81 146 S 8.76 4.16 0.00 3.98 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 S 7.88 4.47 0.00 3.84 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 G 8.71 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 T 8.18 4.38 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 1.26 0.00 0.00 150 S 9.09 4.40 0.00 3.71 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 Y 8.17 4.45 0.00 3.08 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 0.00 152 P 0.00 4.57 0.00 2.45 2.11 0.00 4.11 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.08 0.00 153 D 8.80 4.59 0.00 2.83 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 0.00 154 V 7.44 5.37 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.97 0.00 0.00 155 L 8.42 3.28 0.00 1.11 1.20 -0.49 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.37 4.89 0.00 1.55 1.50 0.00 1.62 0.00 0.00 1.55 0.00 0.00 2.98 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.48 7.81 157 C 8.60 5.16 0.00 1.23 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 L 8.50 4.92 0.00 1.72 1.46 1.14 0.68 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 0.00 159 K 9.05 4.99 0.00 1.83 1.82 0.00 1.93 0.00 0.00 1.82 0.00 0.00 2.83 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.66 1.46 7.81 160 A 9.09 4.69 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 0.00 161 P 0.00 5.01 0.00 2.09 2.18 0.00 3.22 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.99 0.00 162 I 8.36 4.42 1.74 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 0.99 0.62 0.74 0.00 0.00 163 L 8.45 4.70 0.00 1.61 1.63 0.95 0.98 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 8.56 4.26 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 9.02 4.41 0.00 2.84 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 S 8.02 4.12 0.00 4.10 4.11 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 0.00 167 S 7.64 4.59 0.00 3.74 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 0.00 168 C 8.54 4.34 0.00 3.19 3.34 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 0.00 169 K 8.82 3.90 0.00 2.03 1.92 0.00 1.77 0.00 0.00 1.74 0.00 0.00 3.31 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.55 1.65 7.81 170 S 8.67 4.13 0.00 3.99 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 0.00 171 A 8.01 3.89 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 Y 7.90 4.68 0.00 3.18 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 P 0.00 4.36 0.00 2.26 2.29 0.00 4.12 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.01 0.00 174 G 9.10 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 0.00 175 Q 8.67 4.06 0.00 2.45 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.91 0.00 0.00 0.00 0.00 0.00 2.43 2.66 0.00 176 I 7.57 4.02 2.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.80 1.00 0.00 0.00 177 T 8.34 4.48 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 1.33 0.00 0.00 178 S 8.55 4.36 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 8.19 5.00 0.00 3.12 3.15 0.00 0.00 6.61 7.89 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 0.00 180 M 7.84 5.58 0.00 1.84 2.11 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.62 0.00 181 F 8.75 5.06 0.00 3.02 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 C 9.11 5.21 0.00 3.00 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 A 9.04 4.92 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184A G 7.14 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 0.00 0.00 0.00 184 Y 8.28 4.75 0.00 3.11 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 0.00 185 L 8.83 4.02 0.00 1.75 1.76 0.94 0.84 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 0.00 186 E 8.28 3.65 0.00 1.96 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 2.30 2.32 0.00 187 G 7.87 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 0.00 0.00 0.00 188A G 9.55 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 K 7.49 5.05 0.00 2.10 1.94 0.00 1.45 0.00 0.00 1.72 0.00 0.00 2.71 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.55 1.43 7.81 189 D 8.95 4.65 0.00 2.76 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 S 8.16 4.61 0.00 4.03 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 0.00 191 C 9.88 4.78 0.00 2.90 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 0.00 192 Q 8.60 4.11 0.00 2.36 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.44 0.00 0.00 0.00 0.00 0.00 2.57 2.58 0.00 193 G 9.31 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 0.00 0.00 0.00 0.00 194 D 8.52 4.82 0.00 2.93 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 0.00 195 S 7.95 4.48 0.00 3.94 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 G 8.50 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 0.00 197 G 7.74 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 0.00 198 P 0.00 4.94 0.00 2.30 2.34 0.00 3.69 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.22 0.00 199 V 8.47 4.61 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 0.98 0.00 0.00 0.69 0.00 0.00 200 V 8.64 4.68 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 0.67 0.00 0.00 0.67 0.00 0.00 201 C 8.84 5.05 0.00 2.77 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 9.63 3.65 0.00 3.95 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 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 0.00 204 K 7.58 4.81 0.00 1.84 1.65 0.00 1.90 0.00 0.00 1.62 0.00 0.00 2.85 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.39 7.81 *209 L 8.12 4.23 0.00 1.50 1.64 0.91 0.77 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 9.10 4.27 0.00 2.10 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.35 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 211 G 8.02 5.26 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 0.00 212 I 8.21 5.17 1.90 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 1.29 0.92 1.01 0.00 0.00 213 V 8.77 3.39 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 0.83 0.00 0.00 1.13 0.00 0.00 214 S 8.24 4.94 0.00 3.82 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 W 7.07 5.15 0.00 3.37 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 G 8.36 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 0.00 0.00 0.00 217 S 8.16 4.72 0.00 4.00 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 *219 G 8.09 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 0.00 220 C 8.28 4.86 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 221A A 9.24 3.81 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 Q 7.51 4.39 0.00 2.49 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.89 0.00 0.00 0.00 0.00 0.00 2.41 2.36 0.00 222 K 8.61 4.25 0.00 1.79 1.73 0.00 1.94 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.43 1.68 7.81 223 N 9.47 4.25 0.00 2.83 2.82 0.00 0.00 6.76 7.14 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 0.00 224 K 7.63 4.32 0.00 1.90 1.79 0.00 1.56 0.00 0.00 1.24 0.00 0.00 2.86 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.52 7.81 225 P 0.00 4.59 0.00 2.12 2.01 0.00 3.92 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 2.08 2.10 0.00 226 G 8.06 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 0.00 0.00 0.00 227 V 7.81 4.43 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 0.20 0.00 0.00 -0.61 0.00 0.00 228 Y 8.25 4.70 0.00 1.43 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 8.48 4.48 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 1.28 0.00 0.00 230 K 9.24 4.90 0.00 2.08 1.87 0.00 1.81 0.00 0.00 1.71 0.00 0.00 2.87 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.73 7.81 231 V 9.06 3.93 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 1.13 0.00 0.00 1.06 0.00 0.00 232 C 8.34 4.37 0.00 3.18 3.34 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 0.00 233 N 8.10 4.19 0.00 2.23 2.42 0.00 0.00 6.91 7.48 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 0.00 234 Y 7.70 4.78 0.00 3.16 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 V 7.55 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 1.15 0.00 0.00 1.08 0.00 0.00 236 S 8.08 4.09 0.00 3.98 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 0.00 237 W 8.38 4.20 0.00 3.54 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 0.00 238 I 8.20 3.04 1.98 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 1.68 1.25 0.73 0.00 0.00 239 K 8.08 3.68 0.00 1.92 1.77 0.00 1.64 0.00 0.00 1.53 0.00 0.00 2.88 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.38 1.53 7.81 240 Q 8.30 3.80 0.00 2.04 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.77 0.00 0.00 0.00 0.00 0.00 2.33 2.36 0.00 241 T 7.41 3.52 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 242 I 6.67 2.54 1.52 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 -0.30 -0.36 0.50 0.00 0.00 243 A 7.45 4.06 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 0.00 244 S 7.60 4.48 0.00 3.77 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 0.00 245 N 8.03 4.81 0.00 3.14 3.01 0.00 0.00 6.83 7.62 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 * Residues marked with a * may have inaccurate shift predictions.