NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2859 7.8827 121.4450 61.1829 38.8031 173.7937 17 V 4.4472 8.5969 125.5795 61.6126 33.0765 174.2005 18 G 3.9440 8.9628 114.5738 46.6732 0.0000 173.0663 19 G 4.5025 7.8697 108.9398 44.6631 0.0000 172.6573 20 Y 5.0955 8.0626 117.4555 55.1918 42.3192 174.8127 21 T 4.3491 8.5556 116.9216 63.5977 68.4874 175.5427 22 C 4.2280 8.5572 125.5012 60.6113 35.3638 174.8164 23 G 4.1407 8.4373 106.9511 44.0925 0.0000 172.8437 24 A 4.0267 8.6585 125.2062 53.7677 18.5720 177.0408 25 N 4.2067 8.7714 120.3165 54.5582 36.2793 175.0834 26 T 4.3108 7.5502 106.1838 62.0877 69.9384 175.2047 27 V 4.0880 6.9656 122.0541 60.2139 31.4112 173.6822 28 P 4.4901 0.0000 0.0000 64.0380 32.0014 178.1848 29 Y 4.9440 6.6843 115.4271 56.3430 38.7245 174.5610 30 Q 4.4724 7.3336 123.4438 56.3038 29.3005 175.3770 31 V 4.9090 8.8421 118.4572 59.6527 36.4323 174.1464 32 S 4.9967 8.9362 116.8285 56.5846 65.1402 172.5685 33 L 4.6807 8.5124 127.3720 53.2130 43.3005 174.9249 34 N 6.0043 9.1004 122.8799 50.0969 41.9400 174.9415 *37 S 4.1921 8.3763 120.3649 58.4556 64.1385 174.2382 38 G 3.9952 9.4449 109.2711 46.7580 0.0000 172.9307 39 Y 4.5776 6.4354 115.3181 56.0175 40.2284 172.8208 40 H 4.7046 8.8141 121.3757 56.1907 30.2591 174.6426 41 F 5.0834 7.9691 119.9039 56.6780 39.4839 173.7419 42 C 4.7547 6.8891 115.0600 56.3853 44.7088 173.1675 43 G 4.3046 8.7716 109.3568 45.3752 0.0000 172.2448 44 G 4.5479 7.7077 103.7197 46.4263 0.0000 172.6676 45 S 5.4846 8.6708 115.1124 56.4445 67.1947 173.6496 46 L 4.7762 9.1745 127.3234 54.8840 42.3038 177.1417 47 I 4.3914 8.5740 119.9559 61.3370 38.6112 174.5482 48 N 4.7355 7.6235 117.3523 51.9238 39.5882 175.0907 49 S 4.3267 8.6553 112.2003 60.7484 63.1864 175.0455 50 Q 4.5895 9.1524 118.4791 55.0200 31.0454 174.8049 51 W 5.4601 8.4450 118.3332 54.7844 33.3895 174.4394 52 V 5.1498 9.0729 123.0174 61.0988 34.5462 174.4844 53 V 4.9775 8.6815 126.2967 60.6627 33.9380 175.0302 54 S 4.9995 8.8740 115.7164 57.9464 66.0957 171.9662 55 A 4.6776 8.5363 120.8785 50.7552 20.2376 178.5378 56 A 3.8283 8.3244 125.0675 55.2589 18.4595 179.0617 57 H 4.5413 8.4439 109.6495 57.3692 28.6372 175.3350 58 C 4.7080 7.8141 117.0892 57.1915 40.6505 173.4083 59 Y 4.2676 7.7429 122.0054 57.7378 38.7958 175.0282 60 K 3.5267 6.8585 122.9991 56.2483 34.6091 174.2532 61 S 4.3318 8.0951 114.2796 57.8449 64.9913 173.4106 62 G 3.6617 8.2718 106.5588 46.6517 0.0000 173.7811 63 I 4.5545 7.2301 118.7513 59.6295 39.9947 176.0895 64 Q 4.8213 8.8969 127.7392 54.2299 31.7827 174.0928 65 V 4.3948 8.9388 126.6988 61.6234 33.6611 174.5668 65A R 5.1151 9.0462 127.2049 54.7446 32.4605 175.1562 66 L 4.7381 8.9440 124.4842 52.7114 44.8723 177.2359 *69 G 4.0184 8.2166 105.4829 46.3205 0.0000 172.6977 70 E 4.6715 8.4509 118.8551 55.1288 30.3725 174.0701 71 D 4.7689 7.8902 117.5064 54.8809 44.1490 174.2392 72 N 5.1164 9.0339 121.0614 52.6469 39.1642 176.0887 73 I 3.8748 8.4070 119.3977 62.0510 37.6370 176.1934 74 N 4.8461 8.8106 117.8819 52.9959 39.4759 174.4847 75 V 4.2917 7.5166 118.3129 60.7175 34.1666 174.9641 76 V 4.0783 8.5088 127.1329 62.7678 31.0568 175.1915 77 E 4.3907 9.4419 127.5256 55.5248 30.1267 176.5206 78 G 3.9582 7.8468 107.7907 45.5241 0.0000 174.6051 79 N 4.9031 8.2159 115.4092 52.9905 39.9436 174.7249 80 E 5.2494 7.8662 118.2589 55.8643 30.9024 176.3340 81 Q 4.3228 8.4746 119.9574 54.3534 32.7634 173.8837 82 F 5.5911 8.7242 123.0498 55.9004 41.2015 175.2923 83 I 4.7409 8.8675 124.1931 59.6444 41.4050 175.3508 84 S 4.7328 8.6658 121.4457 57.9679 64.5670 173.1459 85 A 4.5628 8.1667 123.5339 51.9414 18.7530 177.4482 86 S 4.5918 8.8819 115.8151 59.5503 63.9938 174.3125 87 K 4.6616 7.4524 116.0551 55.9078 35.4318 174.7983 88 S 5.2983 8.7450 116.9783 56.9586 66.5734 173.8020 89 I 4.5854 9.1274 124.1660 59.5900 40.1041 174.8527 90 V 4.2662 8.4160 127.3766 61.9919 32.7622 175.1718 91 H 3.4455 8.5290 126.6211 55.8595 29.9563 174.1839 92 P 4.2204 0.0000 0.0000 65.6041 30.9673 177.0371 93 S 4.6999 7.8571 112.3171 58.0035 63.0131 173.1960 94 Y 4.2996 7.9827 123.2139 57.6393 38.9989 174.3795 95 N 4.4238 8.1682 125.8490 51.3847 39.8968 175.0388 96 S 3.8833 7.6962 120.3167 59.7199 63.6369 175.3120 97 N 4.3794 8.1688 119.0169 55.5133 38.4892 176.0863 98 T 3.9956 7.7116 105.2650 60.7404 69.8507 174.9775 99 L 3.7537 7.8160 120.8169 55.4463 39.8539 173.8082 100 N 4.4612 7.6216 118.3444 54.5836 39.6037 174.5916 101 N 4.5103 8.6957 120.4879 54.4304 35.5081 175.7696 102 D 4.6841 7.8618 117.8635 52.8260 39.9878 174.8497 103 I 4.9183 7.1878 121.1555 59.4662 42.1183 172.7894 104 M 5.4727 9.2124 124.2617 54.0957 35.1897 173.3464 105 L 5.4107 9.1169 119.7465 53.2106 45.2962 175.5581 106 I 5.0182 9.1319 123.2837 59.4604 40.8500 174.1841 107 K 3.8179 8.7154 128.7803 54.3916 33.7880 175.4510 108 L 4.5026 8.2495 127.6265 54.0027 42.1180 177.0511 109 K 4.1542 8.8703 124.7810 58.9620 32.6031 176.9078 110 S 4.6737 7.7144 111.0882 55.9180 66.2689 172.9090 111 A 4.5138 8.2904 122.3129 51.6646 18.9925 177.3831 112 A 4.3580 8.8487 123.0886 51.8141 19.8978 177.4714 113 S 4.5736 9.0831 116.6431 57.2723 63.6534 174.3352 114 L 4.7291 8.4909 125.6914 53.7868 43.1543 176.4063 115 N 4.7537 8.8099 120.5990 52.4277 39.1679 174.4176 116 S 4.3305 8.7408 110.4584 61.1469 63.4647 175.3811 117 R 4.1515 8.5310 119.6707 56.9431 30.5885 175.9736 118 V 4.6833 7.8168 116.9025 60.9612 33.6242 173.5583 119 A 5.1081 8.4367 127.7587 50.5802 23.0044 175.1055 120 S 5.0546 8.6737 114.0735 57.5739 65.1031 173.0511 121 I 4.4644 8.1775 120.7755 59.1746 39.6677 175.5043 122 S 4.3899 8.3618 123.5157 58.1567 63.6611 174.0052 123 L 4.3014 8.0959 123.4524 53.3073 42.5775 175.0526 124 P 4.5967 0.0000 0.0000 62.7619 32.6046 176.0780 125 T 4.2281 8.2124 108.4440 62.2398 70.3367 174.5299 *127 S 4.9465 7.5809 114.4835 58.1613 64.0405 173.9185 128 C 4.4742 8.4118 118.1255 56.4558 40.9163 173.5353 129 A 4.4414 8.0438 124.9928 51.4896 19.7859 177.3790 130 S 4.3744 8.0574 115.5783 57.1514 64.7016 173.5608 *132 A 4.1428 8.1765 124.1485 53.4903 19.2785 176.4409 133 G 4.0516 8.8536 109.5362 45.6227 0.0000 174.7398 134 T 3.9215 7.6420 116.9532 63.8409 69.3721 173.4182 135 Q 4.8269 8.5620 127.1535 55.4271 30.5973 174.9477 136 C 5.2691 9.2839 122.2306 55.2103 46.4721 172.2087 137 L 5.2209 8.9323 121.8396 53.5207 44.2164 175.0168 138 I 5.2458 9.2011 127.1284 58.7583 40.2747 174.7956 139 S 4.9262 8.8051 119.1853 56.3153 66.5992 173.0244 140 G 3.7989 7.2904 108.5394 46.1739 0.0000 172.8443 141 W 4.5660 8.5125 116.9135 56.2576 29.3214 176.9880 142 G 4.0367 8.3879 108.9296 44.2500 0.0000 173.4957 143 N 3.5957 8.3181 118.3489 54.2966 38.9245 174.4977 144 T 5.0956 7.9511 112.4462 60.5199 69.5767 174.2840 145 K 4.6757 7.7284 121.1625 54.7552 34.9620 176.1890 146 S 4.3966 8.6140 116.3324 59.6554 63.7875 174.6723 147 S 4.5093 7.9616 114.7201 57.2409 64.9652 174.5359 148 G 4.0144 9.3374 110.5319 45.0570 0.0000 171.8631 149 T 4.8869 7.6766 107.1983 60.1748 72.2025 174.1466 150 S 4.4118 9.0238 116.3661 58.3182 65.6322 172.9669 151 Y 4.8398 8.8399 126.1062 55.8140 39.0313 174.3160 152 P 4.6762 0.0000 0.0000 62.5201 32.8495 175.7280 153 D 4.6861 8.6822 118.5218 55.4101 41.7435 176.7830 154 V 5.4863 7.4429 110.4899 58.2461 34.7226 175.5534 155 L 3.2713 8.3443 123.6924 55.1073 42.9507 176.0074 156 K 4.8372 8.2202 125.1505 54.8895 35.1378 174.5945 157 C 5.3052 8.6630 119.4961 55.1346 42.3750 172.9284 158 L 5.0269 8.6799 122.5231 53.6868 45.5433 174.6725 159 K 5.1429 9.0092 125.2404 55.0617 33.6247 175.6394 160 A 4.8971 9.2982 125.9018 49.3317 23.1638 173.3550 161 P 5.0746 0.0000 0.0000 61.7289 33.9900 175.0155 162 I 4.3342 8.2378 122.1254 61.3008 38.2194 175.7115 163 L 4.9250 8.7562 126.9525 53.0521 43.7021 176.7981 164 S 4.3811 8.3898 114.7816 58.1063 63.9527 175.1762 165 D 4.4668 8.6519 121.7092 57.3298 40.4791 179.2674 166 S 4.1244 8.0001 114.6090 61.6990 63.1316 176.6585 167 S 4.1380 8.1549 119.0957 61.0559 62.4929 175.9208 168 C 4.2997 8.3132 121.2211 59.8424 42.8414 175.9332 169 K 3.9935 8.3794 120.1118 59.4266 31.3478 179.6292 170 S 4.2180 8.0004 114.8328 61.2373 62.7631 176.0491 171 A 4.0710 7.7278 122.8992 53.4929 19.8601 177.2710 172 Y 4.8895 7.7939 114.3053 55.1270 38.2275 173.0695 173 P 4.5672 0.0000 0.0000 63.5152 32.1435 177.4126 174 G 4.0164 9.0100 108.2515 46.3971 0.0000 173.8069 175 Q 4.5933 8.2280 116.3580 55.0379 30.7937 175.5016 176 I 4.4198 7.8979 119.3813 60.0004 38.6034 175.1586 177 T 4.6496 8.1761 115.0370 59.5191 71.1703 174.8286 178 S 4.3901 8.5681 114.5007 60.1696 63.1977 174.2851 179 N 4.9544 8.2476 118.6735 53.3700 38.5765 173.8284 180 M 5.6085 7.8857 117.0163 53.7549 36.1672 174.5749 181 F 5.1277 8.8816 115.0726 55.8945 42.2185 172.4445 182 C 5.5933 9.0746 116.2716 55.6201 42.6066 172.7478 183 A 5.0135 9.2903 122.5116 50.6674 22.4096 176.2011 184 G 4.0164 6.9679 107.9786 44.9483 0.0000 172.2727 184A Y 4.6541 8.2152 119.6867 55.9924 40.9731 176.4470 185 L 4.1436 8.6494 125.2985 57.0638 42.0372 178.9341 186 E 4.1917 8.2070 115.7682 57.2027 30.0483 177.1867 187 G 3.8019 7.7800 106.2496 45.0100 0.0000 172.0979 188 G 4.1436 9.0455 106.6580 44.6677 0.0000 174.1130 188A K 4.8561 7.2945 117.4128 54.8402 35.3058 175.2747 189 D 4.6468 8.8231 123.1588 53.8457 45.6856 174.7928 190 S 4.8727 8.7331 116.9985 58.0512 65.3552 172.7056 191 C 4.6967 9.2575 118.6162 55.4168 44.8475 171.9824 192 Q 4.2448 8.6470 121.2239 57.9509 28.6074 177.1572 193 G 4.3844 9.2705 113.1440 45.8025 0.0000 173.8308 194 D 4.7068 8.5246 118.8858 55.2048 41.8586 176.7822 195 S 4.4168 8.0893 115.3743 60.5520 63.4729 175.4070 196 G 4.2213 8.9051 112.7164 46.4286 0.0000 173.7462 197 G 4.4944 7.8088 107.4427 45.0482 0.0000 171.0964 198 P 5.2271 0.0000 0.0000 62.1695 33.8176 175.7735 199 V 4.6072 8.2669 119.9061 61.5385 34.4288 173.7205 200 V 4.8894 8.7973 128.8503 61.2230 34.2593 173.6828 201 C 5.0601 8.7271 124.4989 55.5019 43.7035 174.6101 202 S 3.7273 9.7462 121.1889 59.7338 60.0786 173.1041 203 G 3.9203 8.3708 103.1794 45.9067 0.0000 173.7343 204 K 4.6843 7.5477 117.2278 52.8488 35.3731 175.5469 *209 L 4.2926 8.3144 122.9837 55.4300 42.3201 175.7801 210 Q 4.5751 8.8363 125.7945 56.5443 30.9708 175.7789 211 G 5.2767 8.0933 103.7275 45.6616 0.0000 171.9102 212 I 5.0163 8.1350 119.3579 58.8967 41.0619 175.4290 213 V 3.7591 8.9134 127.6375 63.8928 31.8218 174.1750 214 S 4.8142 8.4502 120.6577 58.6845 64.3601 173.9917 215 W 5.0400 7.6562 114.1266 56.0346 31.9711 172.2107 216 G 4.0640 8.4843 105.6204 46.4974 0.0000 173.5098 217 S 4.7390 8.4869 116.3611 56.8568 63.4979 173.4359 *219 G 4.2086 8.0259 116.1412 45.6435 0.0000 171.0965 220 C 4.9734 8.3010 115.7955 56.7374 43.2094 173.6884 221 A 4.0353 9.1453 125.3651 53.1619 16.7077 177.0232 221A Q 4.6127 7.3158 117.1163 56.0448 29.9922 175.9454 222 K 4.1856 8.4222 121.7467 57.9457 32.7264 176.1358 223 N 4.2520 9.2000 121.4082 54.0724 37.0095 175.3612 224 K 4.2710 7.5484 116.5818 53.6960 32.2131 173.6450 225 P 4.6131 0.0000 0.0000 62.2380 33.1507 177.2421 226 G 3.7890 8.4834 106.2684 45.8165 0.0000 172.8257 227 V 4.5095 7.5931 121.0168 60.7449 34.1542 174.1132 228 Y 4.9263 8.4389 124.1002 56.0384 42.0858 174.9913 229 T 4.3568 8.5033 119.5123 63.5295 70.2211 174.3955 230 K 5.0348 9.2214 127.8876 55.2601 31.6429 177.2241 231 V 3.9719 8.7534 126.8509 65.9818 31.3704 174.9469 232 C 4.3760 8.3740 112.5371 58.2191 41.4343 174.7392 233 N 4.3042 7.8759 116.5156 54.1573 38.6395 174.9587 234 Y 4.8511 7.9653 117.8342 57.4749 39.2874 177.5801 235 V 3.6977 7.9992 121.6519 66.2785 31.5000 178.1235 236 S 4.1301 8.0864 114.4594 61.2482 62.7875 176.2545 237 W 4.1557 8.2782 130.6534 60.3939 30.4415 177.9593 238 I 2.9968 8.2465 120.0613 64.2207 36.7009 178.5856 239 K 3.7679 8.0701 119.6061 59.3473 31.5972 179.4702 240 Q 3.9166 7.8630 117.2046 59.3502 28.7506 178.4286 241 T 3.7213 7.4607 117.5700 66.3626 67.9516 176.7028 242 I 2.5594 7.1875 121.5913 63.9878 36.7525 178.3897 243 A 4.1005 7.5486 120.1379 54.0883 18.1835 178.2498 244 S 4.6949 7.3948 111.0607 58.3193 63.6959 174.0628 245 N 4.6831 7.9428 122.9394 53.6413 39.4925 174.1328 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 4.29 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 1.46 0.79 0.91 0.00 0.00 17 V 8.60 4.45 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 1.03 0.00 0.00 0.94 0.00 0.00 18 G 8.96 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 19 G 7.87 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 20 Y 8.06 5.10 0.00 2.95 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 8.56 4.35 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 1.22 0.00 0.00 22 C 8.56 4.23 0.00 2.85 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 8.44 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 8.66 4.03 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 8.77 4.21 0.00 2.84 2.89 0.00 0.00 7.31 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 26 T 7.55 4.31 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 1.29 0.00 0.00 27 V 6.97 4.09 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.34 0.00 0.00 0.76 0.00 0.00 28 P 0.00 4.49 0.00 2.37 2.40 0.00 3.76 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 2.20 1.96 0.00 29 Y 6.68 4.94 0.00 3.20 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 Q 7.33 4.47 0.00 1.80 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.54 0.00 0.00 0.00 0.00 0.00 1.90 2.47 0.00 31 V 8.84 4.91 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 0.91 0.00 0.00 1.00 0.00 0.00 32 S 8.94 5.00 0.00 3.02 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 33 L 8.51 4.68 0.00 0.60 1.03 0.80 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 34 N 9.10 6.00 0.00 2.47 2.52 0.00 0.00 6.60 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 *37 S 8.38 4.19 0.00 3.64 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 G 9.44 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 39 Y 6.44 4.58 0.00 3.08 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 40 H 8.81 4.70 0.00 2.90 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 7.97 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 6.89 4.75 0.00 2.18 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 43 G 8.77 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 7.71 4.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 S 8.67 5.48 0.00 3.83 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 4.78 0.00 1.87 1.68 1.08 1.19 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 47 I 8.57 4.39 1.89 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 1.58 0.90 1.01 0.00 0.00 48 N 7.62 4.74 0.00 2.99 2.99 0.00 0.00 6.17 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 49 S 8.66 4.33 0.00 4.05 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 50 Q 9.15 4.59 0.00 1.98 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.97 0.00 0.00 0.00 0.00 0.00 2.24 2.26 0.00 51 W 8.44 5.46 0.00 3.26 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 52 V 9.07 5.15 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 1.16 0.00 0.00 0.99 0.00 0.00 53 V 8.68 4.98 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 0.78 0.00 0.00 1.06 0.00 0.00 54 S 8.87 5.00 0.00 3.90 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.54 4.68 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 56 A 8.32 3.83 0.33 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 57 H 8.44 4.54 0.00 3.36 3.56 0.00 5.55 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.81 4.71 0.00 3.21 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 59 Y 7.74 4.27 0.00 2.93 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 6.86 3.53 0.00 1.45 1.33 0.00 0.61 0.00 0.00 1.19 0.00 0.00 2.46 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.70 0.94 7.81 61 S 8.10 4.33 0.00 3.91 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 62 G 8.27 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 I 7.23 4.55 1.87 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 1.35 1.10 0.95 0.00 0.00 64 Q 8.90 4.82 0.00 2.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.85 0.00 0.00 0.00 0.00 0.00 2.17 2.23 0.00 65 V 8.94 4.39 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 0.96 0.00 0.00 0.91 0.00 0.00 65A R 9.05 5.12 0.00 1.69 1.78 0.00 2.70 0.00 0.00 2.50 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 1.28 0.00 66 L 8.94 4.74 0.00 1.62 1.62 0.96 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 *69 G 8.22 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 70 E 8.45 4.67 0.00 2.17 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.11 0.00 71 D 7.89 4.77 0.00 2.72 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 N 9.03 5.12 0.00 2.82 2.82 0.00 0.00 7.21 8.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 I 8.41 3.87 1.46 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.54 -0.37 0.00 0.00 74 N 8.81 4.85 0.00 2.78 2.85 0.00 0.00 6.60 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 75 V 7.52 4.29 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 0.74 0.00 0.00 1.00 0.00 0.00 76 V 8.51 4.08 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 0.80 0.00 0.00 1.05 0.00 0.00 77 E 9.44 4.39 0.00 1.98 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.51 0.00 78 G 7.85 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 8.22 4.90 0.00 2.84 2.81 0.00 0.00 7.19 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 80 E 7.87 5.25 0.00 1.40 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 2.74 2.32 0.00 81 Q 8.47 4.32 0.00 1.96 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.86 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 82 F 8.72 5.59 0.00 2.82 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 8.87 4.74 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 1.24 0.73 0.95 0.00 0.00 84 S 8.67 4.73 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 8.17 4.56 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 86 S 8.88 4.59 0.00 3.74 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 7.45 4.66 0.00 1.86 1.83 0.00 1.65 0.00 0.00 1.91 0.00 0.00 2.85 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.30 1.45 7.81 88 S 8.74 5.30 0.00 3.97 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 89 I 9.13 4.59 2.09 0.00 0.00 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 1.25 1.01 1.16 0.00 0.00 90 V 8.42 4.27 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.00 0.00 0.70 0.00 0.00 91 H 8.53 3.45 0.00 2.80 3.06 0.00 5.66 0.00 0.00 0.00 0.00 6.67 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 4.22 0.00 2.14 2.16 0.00 2.52 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 1.53 1.85 0.00 93 S 7.86 4.70 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 7.98 4.30 0.00 2.97 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 N 8.17 4.42 0.00 2.58 2.44 0.00 0.00 6.52 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 96 S 7.70 3.88 0.00 3.97 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 97 N 8.17 4.38 0.00 2.75 2.79 0.00 0.00 6.82 6.96 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 98 T 7.71 4.00 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 1.11 0.00 0.00 99 L 7.82 3.75 0.00 1.48 1.85 0.55 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.62 4.46 0.00 2.75 2.65 0.00 0.00 7.28 6.60 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 0.00 101 N 8.70 4.51 0.00 3.06 2.62 0.00 0.00 7.24 8.27 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 0.00 102 D 7.86 4.68 0.00 3.08 2.67 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 0.00 103 I 7.19 4.92 1.52 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 1.58 1.24 0.11 0.00 0.00 104 M 9.21 5.47 0.00 2.07 2.19 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.60 0.00 105 L 9.12 5.41 0.00 1.76 1.89 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 106 I 9.13 5.02 1.92 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.84 0.89 0.00 0.00 107 K 8.72 3.82 0.00 0.79 1.05 0.00 1.35 0.00 0.00 1.35 0.00 0.00 2.66 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.72 0.21 7.81 108 L 8.25 4.50 0.00 1.49 1.53 0.97 0.86 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 8.87 4.15 0.00 1.91 1.80 0.00 1.72 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.35 7.81 110 S 7.71 4.67 0.00 3.93 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 8.29 4.51 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 8.85 4.36 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 0.00 113 S 9.08 4.57 0.00 3.73 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 0.00 114 L 8.49 4.73 0.00 1.65 1.62 0.99 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.81 4.75 0.00 2.71 2.74 0.00 0.00 7.02 7.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 S 8.74 4.33 0.00 4.02 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 8.53 4.15 0.00 1.96 2.01 0.00 3.07 0.00 0.00 3.10 7.38 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 3.93 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 0.00 128 C 8.41 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 8.04 4.44 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 8.06 4.37 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 8.18 4.14 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 0.00 133 G 8.85 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 0.00 0.00 0.00 134 T 7.64 3.92 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 1.13 0.00 0.00 135 Q 8.56 4.83 0.00 2.03 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.82 6.95 0.00 0.00 0.00 0.00 0.00 2.31 2.46 0.00 136 C 9.28 5.27 0.00 2.77 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 8.93 5.22 0.00 1.77 1.55 1.04 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.20 5.25 1.88 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 0.75 1.45 1.04 0.00 0.00 139 S 8.81 4.93 0.00 3.51 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 0.00 140 G 7.29 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 0.00 0.00 0.00 141 W 8.51 4.57 0.00 3.18 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 8.39 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 0.00 143 N 8.32 3.60 0.00 2.08 2.55 0.00 0.00 7.33 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 T 7.95 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 1.26 0.00 0.00 145 K 7.73 4.68 0.00 1.81 1.88 0.00 1.73 0.00 0.00 1.65 0.00 0.00 3.07 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.31 1.34 7.81 146 S 8.61 4.40 0.00 3.98 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 0.00 147 S 7.96 4.51 0.00 3.95 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 0.00 148 G 9.34 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 0.00 149 T 7.68 4.89 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 1.32 0.00 0.00 150 S 9.02 4.41 0.00 3.88 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 0.00 151 Y 8.84 4.84 0.00 2.91 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 0.00 152 P 0.00 4.68 0.00 2.43 2.08 0.00 4.05 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.01 0.00 153 D 8.68 4.69 0.00 2.79 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 7.44 5.49 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 1.06 0.00 0.00 0.97 0.00 0.00 155 L 8.34 3.27 0.00 1.37 1.27 -0.79 0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.22 4.84 0.00 1.68 1.51 0.00 1.60 0.00 0.00 1.55 0.00 0.00 2.81 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.46 7.81 157 C 8.66 5.31 0.00 1.41 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 0.00 0.00 0.00 0.00 158 L 8.68 5.03 0.00 1.71 1.47 1.07 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 159 K 9.01 5.14 0.00 1.81 1.81 0.00 1.81 0.00 0.00 1.76 0.00 0.00 2.80 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.49 1.67 7.81 160 A 9.30 4.90 1.12 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 0.00 161 P 0.00 5.07 0.00 2.02 2.27 0.00 3.12 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.78 0.00 162 I 8.24 4.33 1.71 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.65 0.67 0.00 0.00 163 L 8.76 4.93 0.00 1.52 1.59 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.39 4.38 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 8.65 4.47 0.00 2.76 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 8.00 4.12 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 8.15 4.14 0.00 3.91 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 8.31 4.30 0.00 3.19 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 0.00 169 K 8.38 3.99 0.00 1.88 1.90 0.00 1.76 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.53 1.70 7.81 170 S 8.00 4.22 0.00 4.04 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 7.73 4.07 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 Y 7.79 4.89 0.00 3.05 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 0.00 173 P 0.00 4.57 0.00 2.22 2.11 0.00 3.65 0.00 0.00 4.05 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 9.01 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 8.23 4.59 0.00 2.36 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.71 7.03 0.00 0.00 0.00 0.00 0.00 2.30 2.56 0.00 176 I 7.90 4.42 1.98 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 1.86 1.09 1.00 0.00 0.00 177 T 8.18 4.65 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 8.57 4.39 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 8.25 4.95 0.00 3.09 3.09 0.00 0.00 6.65 7.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 M 7.89 5.61 0.00 1.85 1.99 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 2.59 0.00 181 F 8.88 5.13 0.00 2.94 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 9.07 5.59 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 9.29 5.01 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 0.00 184 G 6.97 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 184A Y 8.22 4.65 0.00 2.99 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 0.00 185 L 8.65 4.14 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 1.62 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.21 4.19 0.00 2.10 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 0.00 2.36 2.26 0.00 187 G 7.78 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 0.00 0.00 0.00 188 G 9.05 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 188A K 7.29 4.86 0.00 1.57 1.73 0.00 1.01 0.00 0.00 1.47 0.00 0.00 2.44 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.22 1.13 7.81 189 D 8.82 4.65 0.00 2.80 2.53 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 0.00 190 S 8.73 4.87 0.00 3.99 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 9.26 4.70 0.00 2.92 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 0.00 192 Q 8.65 4.24 0.00 2.22 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.13 5.56 0.00 0.00 0.00 0.00 0.00 2.68 2.53 0.00 193 G 9.27 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 D 8.52 4.71 0.00 2.94 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 0.00 195 S 8.09 4.42 0.00 3.96 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 0.00 196 G 8.91 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 0.00 197 G 7.81 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 0.00 198 P 0.00 5.23 0.00 2.31 2.34 0.00 3.85 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 2.23 2.22 0.00 199 V 8.27 4.61 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 0.86 0.00 0.00 0.69 0.00 0.00 200 V 8.80 4.89 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 0.92 0.00 0.00 0.60 0.00 0.00 201 C 8.73 5.06 0.00 2.81 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 0.00 202 S 9.75 3.73 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 8.37 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 7.55 4.68 0.00 1.74 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 1.47 1.41 7.81 *209 L 8.31 4.29 0.00 1.51 1.64 1.01 0.75 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 8.84 4.58 0.00 2.03 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.50 0.00 0.00 0.00 0.00 0.00 2.42 2.36 0.00 211 G 8.09 5.28 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 0.00 212 I 8.14 5.02 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 1.30 1.12 0.98 0.00 0.00 213 V 8.91 3.76 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 0.92 0.00 0.00 1.19 0.00 0.00 214 S 8.45 4.81 0.00 3.88 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 0.00 215 W 7.66 5.04 0.00 3.31 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 0.00 216 G 8.48 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 0.00 0.00 0.00 217 S 8.49 4.74 0.00 4.14 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 *219 G 8.03 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 0.00 220 C 8.30 4.97 0.00 2.95 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 0.00 221 A 9.15 4.04 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 7.32 4.61 0.00 2.14 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.98 7.24 0.00 0.00 0.00 0.00 0.00 2.39 2.47 0.00 222 K 8.42 4.19 0.00 1.72 1.71 0.00 1.93 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.42 1.56 7.81 223 N 9.20 4.25 0.00 2.80 2.80 0.00 0.00 6.76 7.53 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 0.00 224 K 7.55 4.27 0.00 1.70 1.81 0.00 1.74 0.00 0.00 1.21 0.00 0.00 2.97 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.28 1.50 7.81 225 P 0.00 4.61 0.00 2.14 2.11 0.00 3.56 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.99 0.00 226 G 8.48 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 V 7.59 4.51 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 0.38 0.00 0.00 -0.49 0.00 0.00 228 Y 8.44 4.93 0.00 1.43 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 T 8.50 4.36 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 9.22 5.03 0.00 2.12 1.92 0.00 1.81 0.00 0.00 1.81 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.53 1.66 7.81 231 V 8.75 3.97 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 1.15 0.00 0.00 232 C 8.37 4.38 0.00 3.17 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 0.00 233 N 7.88 4.30 0.00 2.26 2.39 0.00 0.00 6.99 7.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 234 Y 7.97 4.85 0.00 3.24 3.27 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 0.00 235 V 8.00 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 1.11 0.00 0.00 1.11 0.00 0.00 236 S 8.09 4.13 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 8.28 4.16 0.00 3.47 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 I 8.25 3.00 1.98 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 1.50 1.02 0.72 0.00 0.00 239 K 8.07 3.77 0.00 1.72 1.77 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.56 7.81 240 Q 7.86 3.92 0.00 2.15 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.87 0.00 0.00 0.00 0.00 0.00 2.52 2.36 0.00 241 T 7.46 3.72 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 0.81 0.00 0.00 242 I 7.19 2.56 1.45 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.21 0.54 0.00 0.00 243 A 7.55 4.10 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 244 S 7.39 4.69 0.00 3.74 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 0.00 245 N 7.94 4.68 0.00 3.10 2.95 0.00 0.00 6.75 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 * Residues marked with a * may have inaccurate shift predictions.