NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.3005 7.8827 121.4524 61.2239 38.8833 173.8852 17 V 4.2380 8.5863 125.5468 61.6879 33.0946 174.4307 18 G 3.8166 8.3709 112.9781 46.0495 0.0000 173.3404 19 G 4.1304 7.7053 109.4170 43.9616 0.0000 172.2489 20 Y 4.9576 7.7799 116.6097 55.0900 42.2403 174.7856 21 T 4.1998 8.5982 116.7490 63.7848 68.3390 175.3464 22 C 4.3140 8.5045 125.2445 60.3672 35.9731 175.1252 23 G 4.1378 8.6168 106.0845 44.0919 0.0000 172.8817 24 A 4.1125 8.6074 125.5072 53.7833 18.6798 176.8839 25 N 4.2503 8.8710 118.7165 54.4605 36.2575 175.2877 26 T 4.2163 7.5752 107.3336 62.5989 69.8871 175.2135 27 V 4.0826 7.0341 122.3063 60.1594 31.2998 173.6386 28 P 4.5388 0.0000 0.0000 63.7085 31.9873 178.0659 29 Y 4.9487 6.6433 115.7855 56.2201 38.7950 174.7806 30 Q 4.5664 7.2461 123.2064 56.4643 29.6503 175.4378 31 V 4.8715 8.9650 118.3415 59.6854 36.5062 174.0980 32 S 4.8332 8.5766 116.5865 56.5743 65.2045 172.5623 33 L 4.6031 8.3975 127.1888 53.0965 43.4238 174.9535 34 N 5.8030 9.0449 122.5574 50.0141 42.2045 174.9065 *37 S 4.2702 8.4581 119.9542 58.4372 64.1927 174.5155 38 G 4.0332 9.7067 108.9378 46.2102 0.0000 172.8911 39 Y 4.5176 6.7734 115.4671 56.3329 40.0363 172.4529 40 H 4.6105 8.7997 121.2690 55.7871 30.4329 174.6331 41 F 4.9675 7.5838 119.6977 57.1046 39.8776 173.9450 42 C 4.7156 6.8501 114.8145 56.0300 44.9232 173.0889 43 G 4.2867 8.4196 108.8326 45.3189 0.0000 172.1540 44 G 4.4766 8.0405 105.7534 46.3944 0.0000 172.6009 45 S 5.5024 8.7516 115.4858 56.3869 66.8491 173.6759 46 L 4.6857 9.1666 127.4226 54.8648 42.3347 177.0897 47 I 4.3758 8.6003 119.6289 61.0791 39.1076 174.4033 48 N 4.8151 7.5681 117.3436 52.1516 39.6509 174.6821 49 S 4.2221 8.6501 111.2679 60.1322 63.4530 174.4855 50 Q 4.5518 9.1181 121.6001 55.3822 30.8468 174.3020 51 W 5.6009 8.3265 117.1134 55.5913 33.5100 174.3849 52 V 5.2069 8.9490 122.5580 61.0555 34.9687 174.3780 53 V 4.9299 8.6742 124.4920 60.4701 34.0420 174.8328 54 S 5.0244 8.9784 116.7975 57.8414 66.0127 171.9629 55 A 4.7774 8.7535 119.5525 49.7640 20.6606 178.3757 56 A 3.8212 8.2769 124.3604 55.3460 18.4495 179.0322 57 H 4.5494 8.3618 108.6342 56.8356 28.5352 175.1505 58 C 4.8056 7.8833 116.7485 56.9737 40.5957 173.3956 59 Y 4.1652 7.8511 122.3158 57.5016 38.8158 174.8672 60 K 3.5802 6.4610 123.4001 56.3642 34.5787 174.0475 61 S 4.3404 8.1430 114.5290 57.5651 65.1934 173.1754 62 G 3.6276 8.3394 105.6015 46.7810 0.0000 173.7029 63 I 4.6132 7.3195 118.6777 59.3073 40.2877 175.8304 64 Q 4.7284 8.8630 127.7896 54.2180 31.8442 174.0708 65 V 4.4810 8.6487 126.5962 61.5775 33.6628 174.4850 65A R 5.0659 8.8118 127.3889 54.7003 32.2181 175.2519 66 L 4.7073 8.9479 124.5413 52.6891 44.8433 177.2422 *69 G 3.9358 8.2382 106.1845 46.2989 0.0000 172.7868 70 E 4.6504 8.4277 118.7575 55.2728 30.4211 174.2019 71 D 4.7321 7.8108 117.0340 55.0816 43.6282 174.1697 72 N 4.8644 8.7822 120.9011 52.7282 39.1653 176.2354 73 I 3.7662 8.4840 120.2457 62.3752 37.8705 176.3444 74 N 4.7438 8.6069 117.9759 53.0824 39.2716 174.8674 75 V 4.3201 7.3955 117.0644 60.7107 34.2532 175.0262 76 V 4.1965 8.3851 126.5193 62.2853 31.0338 175.1526 77 E 4.3604 8.8125 127.2777 55.3244 30.5223 176.3703 78 G 4.0325 8.6902 105.8041 45.3845 0.0000 174.1929 79 N 4.6068 9.0267 116.5941 52.7040 36.6352 174.4865 80 E 4.6546 7.6129 117.0737 56.3015 30.7494 176.2754 81 Q 4.4273 8.9469 120.9781 54.2592 32.8888 174.0135 82 F 5.5401 8.8650 122.7414 55.9376 41.0875 175.0582 83 I 4.7073 8.6921 124.4118 59.4193 40.9721 175.5827 84 S 4.6687 8.6449 121.6263 58.1488 64.3594 173.2160 85 A 4.4266 8.1006 124.3995 52.2109 18.4124 177.6528 86 S 4.4736 8.9971 117.5319 60.2842 63.4703 174.3485 87 K 4.6993 7.5506 116.0446 55.8891 35.5818 174.7936 88 S 5.2642 8.7843 117.0255 56.9529 66.2162 173.9253 89 I 4.5096 9.2638 124.6893 59.5171 39.2859 175.0035 90 V 4.2085 8.3187 127.0718 61.9917 32.7678 175.3260 91 H 3.8301 8.4929 125.9608 55.7173 30.0798 174.6675 92 P 4.3259 0.0000 0.0000 65.2533 31.3336 177.1978 93 S 4.7120 7.9464 111.9957 58.1183 63.2038 173.3538 94 Y 4.3066 8.0355 123.1463 57.6594 39.0467 174.5581 95 N 4.5664 7.9426 125.0868 51.3190 39.8623 175.1354 96 S 3.8651 7.7975 120.4283 59.7199 63.3999 175.1208 97 N 4.4264 8.6753 119.0116 54.9767 38.7312 176.0235 98 T 4.0371 7.7583 105.5325 60.7029 70.0685 174.9611 99 L 3.8095 7.8771 120.8554 55.4283 39.6462 173.8828 100 N 4.4893 7.6204 117.5679 54.6164 39.5081 174.5679 101 N 5.0869 8.6929 119.8509 54.3841 35.9807 175.3716 102 D 4.7083 7.7888 117.5459 53.1972 39.8751 174.4572 103 I 4.8970 7.0872 120.8376 59.3309 42.5491 173.3806 104 M 5.3547 9.0409 126.1645 54.2234 36.3020 173.2318 105 L 5.3456 9.1299 124.7348 53.1677 44.9254 175.3408 106 I 4.9578 8.9086 123.6279 59.4393 40.3976 174.4132 107 K 3.8005 8.7361 128.4657 54.6011 33.8130 175.4314 108 L 4.6034 8.0296 126.9362 53.6472 42.4951 176.8899 109 K 4.0567 8.8807 124.2677 59.1643 32.5067 177.1327 110 S 4.6949 7.7423 112.3093 56.1382 66.8020 173.2591 111 A 4.4964 8.2834 123.2432 51.8297 18.9816 177.3868 112 A 4.4064 8.8743 122.4156 51.7538 19.8847 177.3274 113 S 4.5795 9.0417 116.5806 57.4558 63.7395 174.4152 114 L 4.7786 8.4886 125.1197 53.8329 43.5789 176.3778 115 N 4.6567 8.7852 119.4741 52.8124 39.4717 174.7999 116 S 4.3978 8.7371 110.0417 60.4582 64.1766 175.4196 117 R 4.1879 9.0215 120.1277 56.8579 30.6940 175.9923 118 V 4.3983 7.8906 116.9086 60.9168 33.6095 173.6088 119 A 5.1020 8.5620 128.1487 50.6011 23.0498 175.0901 120 S 5.0633 8.6593 114.1054 57.5441 65.1317 173.0139 121 I 4.5035 8.1038 120.3869 59.2225 40.0345 175.2792 122 S 4.5112 8.3087 122.4552 57.7383 63.9036 174.0394 123 L 4.3447 8.0967 123.1481 53.5349 42.3793 175.2306 124 P 4.6023 0.0000 0.0000 62.7535 32.6006 176.0196 125 T 4.2578 8.1781 107.5736 61.9617 70.3315 174.2973 *127 S 4.9490 7.5845 114.8292 58.2302 64.0169 173.8714 128 C 4.4733 8.3930 117.8379 56.4354 40.8946 173.3678 129 A 4.5117 7.9680 124.0821 51.2928 20.1941 177.0474 130 S 4.4562 8.0010 114.8508 56.9020 65.0567 173.6849 *132 A 4.3001 8.1564 124.0999 53.3333 19.2485 176.9146 133 G 4.0363 9.0541 109.4042 45.5557 0.0000 174.6813 134 T 3.9208 7.6661 117.1217 63.8401 69.4245 173.3313 135 Q 4.6409 8.5622 127.3617 55.6240 30.2721 175.2084 136 C 5.2579 9.2345 122.5247 55.1680 46.7484 172.2680 137 L 5.2152 9.0140 122.5994 53.5355 44.0464 175.0130 138 I 5.2693 9.0231 127.1383 58.7391 40.0613 174.8369 139 S 4.9636 9.0725 119.6168 56.0995 66.7188 173.1254 140 G 3.8945 7.4774 109.5660 46.0030 0.0000 172.6586 141 W 4.8272 8.5127 117.5405 56.3037 29.4375 177.1938 142 G 4.1788 8.2513 108.5587 44.2629 0.0000 173.5825 143 N 3.8676 8.8296 118.3811 54.4135 38.9855 174.4408 144 T 5.2727 8.0610 112.0609 60.4727 69.4446 174.2188 145 K 4.6492 7.8039 120.8995 54.8878 35.1384 176.1831 146 S 4.4537 8.5760 115.7241 59.3162 63.7928 174.5675 147 S 4.4001 7.8590 116.4331 56.5716 63.1929 172.2189 148 G 3.9279 8.2277 110.4196 43.8160 0.0000 170.5883 149 T 4.5050 8.1911 109.2993 59.7449 70.9522 174.1985 150 S 4.3406 9.2705 120.6791 57.0983 65.0546 171.6872 151 Y 5.0008 8.5318 125.0656 55.9284 39.2230 174.2448 152 P 4.7729 0.0000 0.0000 62.1121 33.2791 175.4471 153 D 4.6310 8.6683 117.8113 55.9600 41.5676 177.2677 154 V 5.5735 7.4103 110.0644 58.5708 34.5193 175.7907 155 L 3.1649 8.2693 123.7497 55.0104 42.8603 175.9440 156 K 4.8477 8.1200 124.8948 54.8892 35.1737 174.5986 157 C 5.2448 8.4496 119.6765 55.1721 44.3598 172.9500 158 L 4.9806 8.5084 122.5019 53.7779 45.6033 174.4825 159 K 5.0909 8.9638 125.2324 55.1917 33.6559 175.7773 160 A 4.8271 9.1359 126.1603 49.7842 23.1302 173.4771 161 P 5.0271 0.0000 0.0000 61.8469 33.9106 175.2622 162 I 4.2990 8.2941 122.5303 61.4948 38.1829 175.8461 163 L 4.8734 8.6602 127.0503 53.0782 43.7420 176.6634 164 S 4.4071 8.3764 114.4414 58.0368 64.0682 175.1077 165 D 4.4398 8.7323 121.9696 57.5375 40.5273 179.1930 166 S 4.1311 8.0336 114.3429 61.7316 63.0258 176.7032 167 S 4.1331 8.0591 118.6649 61.0756 62.5381 175.7799 168 C 4.3006 8.2859 121.2167 59.8866 41.5538 175.9415 169 K 3.9565 8.3636 120.0808 59.5288 31.3354 179.6366 170 S 4.1567 7.9713 114.8165 61.3405 62.7791 176.1723 171 A 3.9850 7.8192 122.8371 53.7882 19.7276 177.4818 172 Y 4.8948 7.8416 113.7746 55.6188 38.1323 173.6911 173 P 4.6368 0.0000 0.0000 63.6369 32.1817 177.9533 174 G 4.0101 9.0841 110.0646 45.7413 0.0000 173.5541 175 Q 4.5271 8.0872 116.6530 55.5253 29.9920 175.2982 176 I 4.4455 7.8250 119.8923 59.9945 38.2296 175.4350 177 T 4.5735 8.2134 115.8623 59.8762 71.0229 174.8981 178 S 4.4495 8.5527 114.1050 59.7402 63.2858 174.0907 179 N 4.9962 8.3113 118.6930 53.4002 38.6245 173.7169 180 M 6.0499 7.9780 116.6008 52.7803 36.2109 174.5539 181 F 5.0857 8.1839 113.8710 56.0477 41.7779 173.6348 182 C 5.5135 9.0588 116.5955 55.7455 40.8629 172.6338 183 A 5.0308 9.1634 122.0283 50.8342 22.5084 176.7748 184 G 3.9387 6.7053 107.3940 44.9620 0.0000 172.2252 184A Y 4.6093 8.2762 119.6162 56.0274 40.8136 176.2815 185 L 4.1476 8.6568 125.8443 57.0847 41.9533 178.7999 186 E 4.1607 8.2172 115.1776 56.9211 30.0826 177.1908 187 G 3.8589 7.7948 106.1719 45.4336 0.0000 172.2867 188 G 4.1231 9.3973 105.7468 44.5978 0.0000 173.6666 188A K 5.0637 7.2254 117.2473 54.7739 35.4574 175.3084 189 D 4.6327 8.5822 122.8391 53.9234 45.6662 174.8712 190 S 4.9223 8.7892 116.7815 58.0563 65.3271 173.0605 191 C 4.7351 9.3117 118.6653 55.4306 44.6567 172.0618 192 Q 4.3901 8.7099 120.4806 58.1415 28.7428 177.3913 193 G 4.3340 9.3001 113.0134 45.7086 0.0000 173.9830 194 D 4.6871 8.3996 118.7381 55.5366 41.7651 176.7626 195 S 4.4405 8.0301 114.6364 60.2583 63.4519 174.9439 196 G 3.9665 8.9108 112.4620 46.5567 0.0000 173.8919 197 G 4.4622 7.9231 107.0148 44.7900 0.0000 171.0297 198 P 5.1776 0.0000 0.0000 62.1994 33.5986 175.6697 199 V 4.5722 8.4647 120.9592 61.4335 34.2423 174.0272 200 V 4.8987 8.6956 128.7018 61.2694 34.0369 173.7362 201 C 5.1301 8.8550 124.4349 55.8560 44.1643 174.5224 202 S 3.6423 9.8261 119.1749 59.6805 60.2101 172.9613 203 G 3.9251 8.4088 103.3606 46.0193 0.0000 174.0145 204 K 4.6699 7.8095 117.8038 52.8831 35.2648 175.5965 *209 L 4.2106 8.2757 122.6605 55.4570 42.1192 175.8162 210 Q 4.5640 8.8199 125.7956 56.4920 31.2332 175.7803 211 G 5.3256 8.0048 104.4991 45.7694 0.0000 171.4218 212 I 5.2308 8.1664 119.3762 58.8998 41.1715 175.3718 213 V 3.7408 8.8785 127.4489 63.9128 31.8092 174.1394 214 S 4.8092 8.4701 120.6841 58.7173 64.3857 174.3080 215 W 4.9800 7.2070 114.1316 56.7534 31.7389 172.1967 216 G 3.9225 8.3767 106.0974 46.9594 0.0000 173.3066 217 S 4.6963 8.3303 116.1013 56.8904 63.0726 173.6395 *219 G 4.1987 7.9621 115.5098 45.5086 0.0000 170.6785 220 C 4.9978 8.1294 115.1130 56.4024 45.2917 173.8752 221 A 3.7428 8.9021 126.0872 53.1995 16.5795 176.9209 221A Q 4.6378 7.2785 114.8783 55.8584 30.1111 176.0962 222 K 4.0747 8.4449 121.7831 57.9991 32.7181 176.0591 223 N 4.2389 9.1951 120.8738 53.9951 37.0057 175.3395 224 K 4.2843 7.4831 117.9205 53.5780 32.2197 173.7201 225 P 4.6457 0.0000 0.0000 62.0370 33.3030 176.7649 226 G 3.7373 8.4925 106.6461 45.7830 0.0000 172.9011 227 V 4.4264 7.4606 121.1642 60.7185 34.1750 174.1418 228 Y 4.9130 8.0382 123.6933 56.1040 42.3221 174.7416 229 T 4.5094 8.5403 118.7464 63.3604 70.2476 174.7104 230 K 5.0960 9.2464 128.0708 55.2489 31.3064 177.1720 231 V 3.9184 8.6561 125.8170 65.9659 31.4038 174.8541 232 C 4.4414 8.3978 112.4647 58.3775 41.3904 174.8361 233 N 4.2687 8.0234 116.8803 54.3395 38.6017 175.5697 234 Y 4.7777 8.0327 117.8806 57.5355 38.7121 177.3183 235 V 3.7012 7.8676 121.3338 66.3666 31.6237 178.0501 236 S 4.1405 8.0974 114.3663 61.1098 62.7567 176.2556 237 W 4.1556 8.2879 130.6246 60.5229 30.5001 177.7457 238 I 3.1540 8.1488 119.7211 64.2882 36.6236 178.4849 239 K 3.7454 8.0401 119.0615 59.6175 31.6769 179.5232 240 Q 3.8927 8.1166 117.2492 59.0761 29.0210 178.6685 241 T 3.6922 7.7113 117.0065 66.5797 68.2656 176.7562 242 I 2.6633 7.1795 121.5494 64.0561 36.7647 178.4141 243 A 4.0072 7.7077 120.5102 54.1315 18.1769 178.7406 244 S 4.6478 7.3967 110.0821 58.2750 63.5343 174.0906 245 N 4.6722 7.8984 125.7112 53.8809 39.3141 174.0269 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 4.30 1.80 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 1.41 0.53 0.93 0.00 0.00 17 V 8.59 4.24 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 1.02 0.00 0.00 0.91 0.00 0.00 18 G 8.37 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 0.00 0.00 0.00 19 G 7.71 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 0.00 0.00 0.00 20 Y 7.78 4.96 0.00 2.90 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 21 T 8.60 4.20 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 22 C 8.50 4.31 0.00 2.79 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 23 G 8.62 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 0.00 0.00 24 A 8.61 4.11 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 N 8.87 4.25 0.00 2.85 2.90 0.00 0.00 7.27 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 7.58 4.22 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 1.32 0.00 0.00 27 V 7.03 4.08 1.75 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 0.31 0.00 0.00 0.78 0.00 0.00 28 P 0.00 4.54 0.00 2.38 2.42 0.00 3.82 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 1.96 0.00 29 Y 6.64 4.95 0.00 3.18 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 7.25 4.57 0.00 1.82 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.54 0.00 0.00 0.00 0.00 0.00 1.92 2.52 0.00 31 V 8.97 4.87 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.99 0.00 0.00 32 S 8.58 4.83 0.00 3.07 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.40 4.60 0.00 0.55 0.92 0.79 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 34 N 9.04 5.80 0.00 2.38 2.44 0.00 0.00 6.53 7.03 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 *37 S 8.46 4.27 0.00 3.80 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 G 9.71 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 39 Y 6.77 4.52 0.00 3.04 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 40 H 8.80 4.61 0.00 2.85 3.16 0.00 5.86 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.58 4.97 0.00 3.03 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 42 C 6.85 4.72 0.00 2.29 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 8.42 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 0.00 0.00 0.00 0.00 44 G 8.04 4.48 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 0.00 0.00 0.00 45 S 8.75 5.50 0.00 3.82 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 L 9.17 4.69 0.00 1.87 1.68 1.06 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.60 4.38 1.90 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 1.55 0.91 1.01 0.00 0.00 48 N 7.57 4.82 0.00 3.01 3.01 0.00 0.00 6.18 7.65 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 49 S 8.65 4.22 0.00 4.05 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 9.12 4.55 0.00 2.08 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.85 0.00 0.00 0.00 0.00 0.00 2.11 2.20 0.00 51 W 8.33 5.60 0.00 3.39 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 52 V 8.95 5.21 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 1.16 0.00 0.00 0.99 0.00 0.00 53 V 8.67 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 0.72 0.00 0.00 1.01 0.00 0.00 54 S 8.98 5.02 0.00 3.88 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 55 A 8.75 4.78 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 A 8.28 3.82 0.25 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 57 H 8.36 4.55 0.00 3.36 3.56 0.00 5.54 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.88 4.81 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 59 Y 7.85 4.17 0.00 3.00 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 60 K 6.46 3.58 0.00 1.48 1.35 0.00 0.61 0.00 0.00 1.23 0.00 0.00 2.46 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.73 0.95 7.81 61 S 8.14 4.34 0.00 3.94 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 62 G 8.34 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 0.00 0.00 0.00 63 I 7.32 4.61 1.85 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 1.39 1.32 0.91 0.00 0.00 64 Q 8.86 4.73 0.00 1.98 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.85 0.00 0.00 0.00 0.00 0.00 2.09 2.21 0.00 65 V 8.65 4.48 2.17 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 0.85 0.00 0.00 0.89 0.00 0.00 65A R 8.81 5.07 0.00 1.64 1.70 0.00 2.64 0.00 0.00 2.32 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 1.14 0.00 66 L 8.95 4.71 0.00 1.63 1.61 0.96 0.87 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 8.24 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 E 8.43 4.65 0.00 2.10 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 2.36 2.09 0.00 71 D 7.81 4.73 0.00 2.72 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 N 8.78 4.86 0.00 2.84 2.84 0.00 0.00 7.22 7.59 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 73 I 8.48 3.77 1.46 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.56 -0.43 0.00 0.00 74 N 8.61 4.74 0.00 2.83 2.89 0.00 0.00 6.65 7.59 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 75 V 7.40 4.32 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.95 0.00 0.00 76 V 8.39 4.20 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.96 0.00 0.00 77 E 8.81 4.36 0.00 2.02 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 2.43 0.00 78 G 8.69 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 79 N 9.03 4.61 0.00 2.92 3.14 0.00 0.00 6.91 7.67 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 80 E 7.61 4.65 0.00 1.54 1.62 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 2.69 2.46 0.00 81 Q 8.95 4.43 0.00 1.99 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.76 0.00 0.00 0.00 0.00 0.00 2.23 2.30 0.00 82 F 8.87 5.54 0.00 2.78 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 83 I 8.69 4.71 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.91 0.95 0.00 0.00 84 S 8.64 4.67 0.00 3.75 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 A 8.10 4.43 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 86 S 9.00 4.47 0.00 3.72 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 87 K 7.55 4.70 0.00 1.87 1.84 0.00 1.59 0.00 0.00 1.92 0.00 0.00 2.85 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.31 1.38 7.81 88 S 8.78 5.26 0.00 4.09 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 89 I 9.26 4.51 2.06 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 1.24 0.98 1.08 0.00 0.00 90 V 8.32 4.21 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 0.60 0.00 0.00 0.77 0.00 0.00 91 H 8.49 3.83 0.00 2.80 3.10 0.00 5.65 0.00 0.00 0.00 0.00 6.75 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 2.06 2.13 0.00 3.08 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.21 0.00 93 S 7.95 4.71 0.00 3.90 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 8.04 4.31 0.00 3.03 2.91 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 95 N 7.94 4.57 0.00 2.55 2.45 0.00 0.00 6.62 8.64 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 96 S 7.80 3.87 0.00 3.93 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 97 N 8.68 4.43 0.00 2.71 2.78 0.00 0.00 6.78 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 98 T 7.76 4.04 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 99 L 7.88 3.81 0.00 1.52 1.91 0.75 1.28 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 0.00 100 N 7.62 4.49 0.00 2.79 2.65 0.00 0.00 7.27 6.38 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 0.00 101 N 8.69 5.09 0.00 3.05 2.62 0.00 0.00 7.23 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 0.00 102 D 7.79 4.71 0.00 3.22 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 7.09 4.90 1.44 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 1.36 1.30 0.18 0.00 0.00 104 M 9.04 5.35 0.00 2.13 1.82 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.64 0.00 105 L 9.13 5.35 0.00 1.79 1.86 0.25 0.61 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 0.00 106 I 8.91 4.96 1.92 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 1.20 0.97 0.89 0.00 0.00 107 K 8.74 3.80 0.00 0.79 1.10 0.00 1.17 0.00 0.00 1.33 0.00 0.00 2.60 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.68 0.21 7.81 108 L 8.03 4.60 0.00 1.50 1.54 0.96 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.88 4.06 0.00 1.77 1.80 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.39 7.81 110 S 7.74 4.69 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 0.00 111 A 8.28 4.50 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 8.87 4.41 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 0.00 113 S 9.04 4.58 0.00 3.75 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 0.00 114 L 8.49 4.78 0.00 1.65 1.62 0.96 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.79 4.66 0.00 2.72 2.71 0.00 0.00 6.95 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 0.00 116 S 8.74 4.40 0.00 4.01 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 0.00 117 R 9.02 4.19 0.00 2.07 2.02 0.00 3.12 0.00 0.00 3.10 7.39 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.58 4.95 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 0.00 128 C 8.39 4.47 0.00 2.95 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 0.00 129 A 7.97 4.51 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 S 8.00 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 8.16 4.30 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 9.05 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 0.00 134 T 7.67 3.92 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 135 Q 8.56 4.64 0.00 2.03 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.72 6.87 0.00 0.00 0.00 0.00 0.00 2.32 2.46 0.00 136 C 9.23 5.26 0.00 2.79 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 0.00 137 L 9.01 5.22 0.00 1.75 1.57 1.04 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.02 5.27 1.88 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 1.58 0.99 0.00 0.00 139 S 9.07 4.96 0.00 3.51 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 0.00 140 G 7.48 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 0.00 141 W 8.51 4.83 0.00 3.11 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 0.00 142 G 8.25 4.18 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 0.00 143 N 8.83 3.87 0.00 2.28 2.68 0.00 0.00 7.00 7.46 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 0.00 144 T 8.06 5.27 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 1.27 0.00 0.00 145 K 7.80 4.65 0.00 1.83 1.67 0.00 1.70 0.00 0.00 1.69 0.00 0.00 3.04 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.29 1.31 7.81 146 S 8.58 4.45 0.00 3.99 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 0.00 147 S 7.86 4.40 0.00 3.82 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 0.00 148 G 8.23 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 0.00 149 T 8.19 4.51 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 150 S 9.27 4.34 0.00 3.74 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 0.00 151 Y 8.53 5.00 0.00 3.00 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 4.77 0.00 2.41 2.11 0.00 4.19 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.04 0.00 153 D 8.67 4.63 0.00 2.80 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 0.00 154 V 7.41 5.57 2.28 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 0.66 0.00 0.00 0.97 0.00 0.00 155 L 8.27 3.16 0.00 1.33 1.26 -0.67 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.12 4.85 0.00 1.70 1.51 0.00 1.61 0.00 0.00 1.56 0.00 0.00 2.82 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.48 7.81 157 C 8.45 5.24 0.00 1.72 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 0.00 0.00 0.00 0.00 158 L 8.51 4.98 0.00 1.70 1.45 0.99 0.93 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 8.96 5.09 0.00 1.83 1.82 0.00 1.88 0.00 0.00 1.77 0.00 0.00 2.78 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.65 7.81 160 A 9.14 4.83 1.19 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 0.00 161 P 0.00 5.03 0.00 2.02 2.26 0.00 3.18 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.75 0.00 162 I 8.29 4.30 1.85 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.44 0.70 0.00 0.00 163 L 8.66 4.87 0.00 1.55 1.61 0.93 0.89 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 0.00 164 S 8.38 4.41 0.00 4.00 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 0.00 165 D 8.73 4.44 0.00 2.76 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 0.00 166 S 8.03 4.13 0.00 4.05 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 8.06 4.13 0.00 3.93 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 0.00 168 C 8.29 4.30 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 8.36 3.96 0.00 1.95 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 1.66 7.81 170 S 7.97 4.16 0.00 4.02 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 0.00 171 A 7.82 3.99 1.08 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 0.00 172 Y 7.84 4.89 0.00 3.14 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 P 0.00 4.64 0.00 2.21 2.10 0.00 3.56 0.00 0.00 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.96 0.00 174 G 9.08 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 Q 8.09 4.53 0.00 2.34 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.99 0.00 0.00 0.00 0.00 0.00 2.29 2.55 0.00 176 I 7.83 4.45 1.99 0.00 0.00 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 1.89 0.98 1.01 0.00 0.00 177 T 8.21 4.57 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 178 S 8.55 4.45 0.00 4.01 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 0.00 179 N 8.31 5.00 0.00 3.06 3.09 0.00 0.00 6.68 8.12 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 0.00 180 M 7.98 6.05 0.00 1.85 2.00 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.43 0.00 181 F 8.18 5.09 0.00 2.95 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 0.00 182 C 9.06 5.51 0.00 2.99 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 A 9.16 5.03 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184 G 6.71 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184A Y 8.28 4.61 0.00 2.95 3.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 L 8.66 4.15 0.00 1.73 1.73 0.92 0.87 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 0.00 186 E 8.22 4.16 0.00 2.10 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 0.00 2.32 2.27 0.00 187 G 7.79 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 0.00 188 G 9.40 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 188A K 7.23 5.06 0.00 1.37 1.62 0.00 0.78 0.00 0.00 1.35 0.00 0.00 2.43 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.18 1.14 7.81 189 D 8.58 4.63 0.00 2.82 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 8.79 4.92 0.00 4.01 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 0.00 191 C 9.31 4.74 0.00 2.94 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 0.00 192 Q 8.71 4.39 0.00 2.24 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.14 5.33 0.00 0.00 0.00 0.00 0.00 2.64 2.52 0.00 193 G 9.30 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 D 8.40 4.69 0.00 2.99 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 8.03 4.44 0.00 3.95 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 0.00 196 G 8.91 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 0.00 0.00 0.00 197 G 7.92 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 P 0.00 5.18 0.00 2.30 2.34 0.00 3.70 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.24 0.00 199 V 8.46 4.57 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 0.82 0.00 0.00 0.69 0.00 0.00 200 V 8.70 4.90 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 0.75 0.00 0.00 0.61 0.00 0.00 201 C 8.85 5.13 0.00 2.78 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 0.00 202 S 9.83 3.64 0.00 3.93 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 8.41 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 0.00 204 K 7.81 4.67 0.00 1.69 1.63 0.00 1.88 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.40 7.81 *209 L 8.28 4.21 0.00 1.52 1.64 0.97 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 210 Q 8.82 4.56 0.00 1.98 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.36 0.00 0.00 0.00 0.00 0.00 2.40 2.34 0.00 211 G 8.00 5.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 I 8.17 5.23 1.91 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 0.79 0.98 0.00 0.00 213 V 8.88 3.74 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 0.96 0.00 0.00 1.18 0.00 0.00 214 S 8.47 4.81 0.00 3.89 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 W 7.21 4.98 0.00 3.39 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 0.00 216 G 8.38 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 0.00 217 S 8.33 4.70 0.00 4.14 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 *219 G 7.96 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 C 8.13 5.00 0.00 2.95 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 A 8.90 3.74 1.39 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 221A Q 7.28 4.64 0.00 2.11 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.18 6.94 0.00 0.00 0.00 0.00 0.00 2.39 2.47 0.00 222 K 8.44 4.07 0.00 1.72 1.72 0.00 1.94 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.56 7.81 223 N 9.20 4.24 0.00 2.80 2.81 0.00 0.00 6.75 7.46 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 0.00 224 K 7.48 4.28 0.00 1.68 1.83 0.00 1.74 0.00 0.00 1.37 0.00 0.00 3.00 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.45 1.51 7.81 225 P 0.00 4.65 0.00 2.14 2.12 0.00 3.57 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.99 0.00 226 G 8.49 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 0.00 0.00 0.00 227 V 7.46 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 0.36 0.00 0.00 -0.70 0.00 0.00 228 Y 8.04 4.91 0.00 1.43 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 T 8.54 4.51 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 230 K 9.25 5.10 0.00 2.08 1.90 0.00 1.81 0.00 0.00 1.78 0.00 0.00 2.90 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.54 1.67 7.81 231 V 8.66 3.92 2.26 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 1.12 0.00 0.00 1.12 0.00 0.00 232 C 8.40 4.44 0.00 3.17 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 233 N 8.02 4.27 0.00 2.27 2.43 0.00 0.00 6.98 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 0.00 234 Y 8.03 4.78 0.00 3.18 3.19 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 0.00 235 V 7.87 3.70 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 1.12 0.00 0.00 1.12 0.00 0.00 236 S 8.10 4.14 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 8.29 4.16 0.00 3.51 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 8.15 3.15 2.04 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 1.63 1.03 0.75 0.00 0.00 239 K 8.04 3.75 0.00 1.86 1.78 0.00 1.65 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.39 1.61 7.81 240 Q 8.12 3.89 0.00 1.91 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.96 0.00 0.00 0.00 0.00 0.00 2.36 2.50 0.00 241 T 7.71 3.69 3.48 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 0.77 0.00 0.00 242 I 7.18 2.66 1.36 0.00 0.00 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.08 0.40 0.00 0.00 243 A 7.71 4.01 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 0.00 244 S 7.40 4.65 0.00 4.05 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 0.00 245 N 7.90 4.67 0.00 2.98 3.00 0.00 0.00 6.75 7.78 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 * Residues marked with a * may have inaccurate shift predictions.