NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 K 4.1447 8.3144 119.9999 60.3161 34.0172 176.5143 4 K 4.4937 6.9876 122.2445 57.2398 30.6896 173.3833 5 D 5.0068 8.0258 130.8354 58.4116 43.0705 180.3116 6 I 3.4321 7.1529 120.4569 63.9824 40.0352 176.6750 7 S 4.2445 8.1343 114.1857 60.5946 62.8822 173.0910 8 N 4.8002 7.7747 119.9285 49.7788 36.8464 172.3615 9 V 4.3373 7.2470 127.3959 61.9356 38.2713 174.1274 10 K 4.0904 8.0456 120.0720 59.3582 32.0091 179.2742 11 S 4.2547 7.7584 114.0012 61.4924 63.5854 176.2714 12 D 4.5552 8.0715 122.9221 56.7480 40.4552 178.3154 13 L 4.0532 8.5961 120.3875 56.7869 41.0971 178.6920 14 L 3.9961 7.9082 119.9151 58.9697 41.9024 179.0241 15 Y 4.0131 8.7427 119.0012 60.6671 38.7843 177.1815 16 A 3.8643 8.4131 121.6203 55.1344 18.6770 179.0112 17 Y 4.4476 7.7180 114.4523 59.9390 39.0552 178.2076 18 T 4.3550 7.2347 115.9625 61.9196 67.1939 173.0535 19 I 4.4094 7.2077 122.9561 59.3130 41.3572 173.9185 20 T 4.3453 8.0746 116.3447 59.4193 69.7890 172.9601 21 P 3.7248 0.0000 0.0000 62.4350 32.6038 175.0822 22 Y 4.2152 7.5234 118.8119 57.0905 39.1266 174.6727 23 D 5.4981 7.4532 123.5640 51.1105 41.3389 171.9845 24 Y 3.8919 7.4417 117.9210 55.7005 39.9478 174.4763 25 K 4.7932 8.1023 123.4438 54.9421 34.3287 175.9833 26 D 4.3155 9.5856 122.1866 55.5729 39.5964 172.8785 27 C 5.0041 8.8585 118.6502 58.3960 31.5274 174.8512 28 R 5.0686 8.6789 117.6231 54.0913 31.7166 175.1918 29 V 4.5961 8.1629 120.7087 60.3733 33.8370 175.3687 30 N 4.6506 8.5995 123.7817 55.2656 40.3704 174.1979 31 F 5.4860 7.6124 111.4600 55.7406 42.4730 173.8254 32 S 4.3180 8.7032 111.3720 57.8888 64.9861 173.8873 33 T 4.8683 8.0008 130.8274 62.5198 68.0559 175.8485 34 T 4.0544 8.8298 115.3056 62.2169 67.6911 174.8430 *35 H 4.6136 9.0820 123.2837 58.2469 29.8354 178.1238 36 T 4.9647 7.8791 104.6063 60.0394 72.4149 172.9405 37 L 4.8587 8.9942 123.7756 53.1698 45.5128 174.7353 38 N 5.2936 8.1887 122.1631 52.0342 41.4953 172.9309 39 I 4.6831 8.7991 127.7341 59.4486 40.4467 174.5420 40 D 4.8797 9.3643 127.2579 53.3830 41.7793 176.1862 41 T 4.6269 8.2238 116.5651 61.3994 69.3058 176.3068 42 Q 4.2638 8.5304 124.8023 59.5411 28.8491 179.0061 43 K 3.9069 7.8031 116.4789 59.8279 32.7220 177.5973 44 Y 4.3646 7.5610 117.2777 59.7371 38.3147 177.0170 45 R 4.0051 8.5004 121.5113 55.6392 31.0481 176.1015 46 G 4.0483 7.4162 104.5839 42.9051 0.0000 172.7985 47 K 4.1330 8.2764 119.5694 57.1624 32.4827 176.1863 48 D 4.5160 9.1652 123.9378 54.9065 39.1913 173.5504 49 Y 4.5646 8.2539 118.7120 58.2898 39.2793 174.4469 50 Y 5.3026 9.2479 120.4666 55.9319 42.6381 173.4166 51 I 4.6408 9.1569 119.8116 59.5182 41.2784 175.1165 52 S 5.5173 7.8998 120.8780 55.3586 63.5936 171.4063 53 S 4.3327 8.3421 120.6582 57.8730 63.5142 172.2660 54 E 5.1789 9.0898 130.3389 55.0578 28.5161 173.7176 55 M 5.3132 8.3390 120.5171 52.7817 32.9721 176.4537 56 S 4.2418 8.9583 118.8164 59.5476 64.0813 174.2038 *57 Y 4.3566 8.3681 123.3826 57.4665 37.4413 176.9405 58 E 3.9799 8.7681 114.0593 58.3369 27.7965 175.2562 59 A 4.4263 7.7914 120.4604 53.2402 20.3956 177.4680 60 S 4.3371 7.1154 110.4737 57.3895 64.4714 175.0106 *63 F 4.6513 8.1794 123.4848 56.7927 39.3946 174.1595 64 K 3.7106 8.3652 121.3405 56.9153 33.7433 176.4752 65 R 3.4800 8.1629 115.8883 54.8761 32.9378 171.8523 66 D 4.7819 8.1928 121.4687 53.7153 40.8483 175.8924 67 D 5.1781 8.8361 124.3339 52.2124 45.4847 173.6211 68 H 5.3428 8.6386 115.3877 54.4256 31.5638 173.9094 69 V 4.5689 8.9063 121.5779 60.1006 35.5801 173.7275 70 D 5.3870 9.4300 121.2920 52.4794 44.2755 175.3491 71 V 4.8480 9.1583 122.5358 61.1358 34.8333 174.2928 72 F 5.4300 9.3201 130.1643 56.5759 42.0762 173.0725 73 G 4.3654 7.9703 112.2293 44.8718 0.0000 170.3288 74 L 4.0758 8.7813 123.7486 52.4839 42.0665 177.0923 75 F 5.2284 8.1950 118.9438 56.6929 38.3912 174.4234 76 Y 4.9172 7.6698 116.2616 56.1490 38.9510 174.4777 77 I 4.1707 6.9840 112.1465 61.1191 40.1562 171.7350 78 L 4.2323 7.4708 118.6098 55.0939 44.2121 176.2416 79 N 4.1502 8.9558 113.7665 55.8358 38.8390 176.7637 80 S 4.0963 7.9626 109.6261 59.2907 62.3782 173.4376 81 H 4.2809 9.1353 116.4392 57.3254 28.9762 174.5522 82 T 3.4521 7.4948 111.5120 63.4758 75.9492 173.4515 83 G 4.0082 7.9580 107.3998 43.2808 0.0000 171.8251 84 E 4.9322 8.2141 121.1390 54.4822 32.8143 174.4254 85 Y 4.6760 8.6917 121.5746 56.5383 40.8395 174.7902 86 I 4.9743 8.0032 113.9361 60.3531 41.9994 173.4725 87 Y 5.4676 9.0358 118.9991 55.3356 37.7828 177.6621 88 G 4.0746 9.1292 115.5661 43.3245 0.0000 172.1201 89 G 4.5390 8.8878 108.6743 45.6334 0.0000 171.6987 90 I 5.0954 8.0755 120.1894 59.3764 39.2044 175.3956 91 T 4.9177 8.9138 116.8108 58.8293 72.4944 171.6866 92 P 4.0658 0.0000 0.0000 62.9152 32.1493 175.8150 93 A 4.6025 8.1983 123.0667 51.5723 19.7559 177.6446 94 Q 4.0852 10.1427 123.5138 55.5233 28.4956 175.8330 95 N 4.4704 8.8150 124.0029 55.5443 38.9526 175.6412 96 N 4.9102 7.7181 113.9926 50.5439 40.7427 174.4437 97 K 3.8859 8.6811 124.1667 56.8731 32.5576 176.0506 98 V 4.4233 8.0072 123.9126 60.0938 34.5396 173.9945 99 N 4.7961 8.2638 118.8036 52.7744 40.9078 172.5024 100 H 4.9545 8.6135 124.0619 54.0037 30.8680 174.4210 101 K 4.6453 8.6344 123.1890 55.5829 33.3101 176.4081 102 L 4.6791 8.7301 124.5438 53.8044 43.9434 175.7079 103 L 4.7376 8.0922 121.1382 53.1722 44.7302 175.5860 104 G 2.7504 7.1024 107.1904 46.0379 0.0000 171.8727 105 N 5.0310 8.5240 116.3757 51.0011 43.2332 174.0143 106 L 4.4675 7.8989 123.9991 53.4679 44.3618 175.1958 107 F 5.1158 9.4380 127.5129 56.1461 40.6177 175.5887 108 I 5.5454 8.7895 124.2921 58.4143 39.7236 176.1600 109 S 4.7641 8.2405 119.2607 58.0827 60.9807 173.4660 *111 E 4.2683 7.7922 115.3058 56.5909 31.6325 176.8864 112 S 4.8781 8.0262 112.3061 59.1309 66.9299 173.4018 113 Q 3.6034 9.0475 119.2780 56.4551 24.6586 173.0909 114 Q 4.4086 7.9600 120.5042 54.3583 30.9573 174.5446 115 N 3.9662 8.3932 118.3216 53.3831 38.3124 175.5762 116 L 3.7677 8.4566 122.8026 55.1469 40.3317 174.5335 117 N 4.2769 7.6002 116.7452 54.4350 38.9599 174.8537 118 N 4.5943 9.1056 119.8340 53.0402 37.0084 174.5986 119 K 4.5419 7.6481 117.6605 55.6556 32.9806 175.3240 120 I 4.5274 7.5949 117.6216 59.3277 41.0674 173.9590 121 I 4.8537 8.3201 127.6997 59.4655 39.8662 175.6899 122 L 4.3689 8.4248 127.0795 53.3012 44.0131 176.5424 123 E 4.7414 8.0005 116.7346 54.6309 30.8342 175.9953 124 K 4.5595 7.7548 116.8930 54.9208 36.2573 176.4433 125 D 4.5545 8.8938 123.5361 56.6749 42.1938 175.9935 126 I 4.5905 7.6544 119.1665 59.6426 38.5622 175.6584 127 V 4.3781 8.4229 126.9939 61.1011 34.9388 174.9030 128 T 4.6154 8.2900 121.0753 61.4624 68.3451 175.4954 129 F 4.0048 9.2415 125.8923 60.4196 38.9991 177.7378 130 Q 3.2875 7.9476 119.4603 59.2336 28.5501 178.4960 131 E 3.9767 7.9715 119.5316 59.0067 29.6659 178.7594 132 I 3.4760 7.3543 119.4855 64.3671 37.4494 177.9081 133 D 4.3977 9.1523 119.3627 56.4272 40.9206 177.7373 134 F 4.4691 7.8743 120.9813 61.1627 39.6407 177.4129 135 K 3.5756 8.1836 118.2197 59.5431 31.5653 179.4462 136 I 3.4950 7.3895 119.2193 64.0956 37.2940 178.3034 137 R 3.7750 7.2525 117.7575 58.8540 29.7236 178.7258 138 K 3.7419 7.8078 119.8664 58.2577 31.8206 175.6175 139 Y 4.2743 7.4577 120.4044 57.9269 39.0959 172.6340 140 L 4.2329 8.4648 131.3870 55.8266 38.3124 175.8179 141 M 3.9309 7.6814 119.5896 58.0101 31.6084 178.2299 142 D 4.3558 8.2739 121.8234 58.3280 41.3205 179.1762 143 N 4.4834 7.7357 116.6427 55.3994 38.2171 176.7993 144 Y 4.5828 7.8434 113.6549 56.8945 39.5174 176.0716 145 K 3.7645 7.9437 114.0421 57.5680 29.2077 174.1577 146 I 4.6675 7.7088 113.1628 60.8445 38.5238 176.3682 147 Y 5.1410 7.6202 116.9748 57.9236 38.9078 175.1827 148 D 4.5442 8.1860 120.7230 53.7613 41.1171 175.5272 149 A 3.9028 8.5834 127.2203 56.2556 18.5780 178.0451 150 T 3.9983 7.6100 113.6871 62.1321 67.5427 173.2544 151 S 4.4548 7.8382 119.9104 57.3487 65.1937 173.2717 152 P 4.2738 0.0000 0.0000 64.5884 31.9225 175.1924 153 Y 4.2975 6.1975 116.5798 58.6392 37.7020 176.3626 154 V 3.9953 7.5797 123.7193 61.7927 33.3884 175.7203 155 S 4.2354 6.2194 114.2610 57.2941 67.3864 174.5235 156 G 4.5360 8.3217 108.8199 47.3405 0.0000 171.0925 157 R 5.1017 8.0538 113.9048 55.6450 32.8912 173.8999 158 I 4.5484 8.6616 121.9337 60.1093 39.0136 174.5420 159 E 5.1373 9.0567 127.5656 54.8964 31.7717 175.0531 160 I 4.4538 9.0335 126.4653 59.5986 39.3002 175.2002 161 G 4.0560 8.5081 115.4503 45.3164 0.0000 172.7505 162 T 5.1645 8.0444 112.2441 59.5652 71.6040 173.8520 163 K 4.2799 8.7988 119.5808 57.3199 32.8044 177.3527 164 D 4.8698 7.8603 120.0430 53.5087 39.6173 177.2169 165 G 3.8796 8.1716 104.9103 47.2777 0.0000 173.4138 166 K 4.4211 7.6137 120.1041 54.4682 32.5537 175.4028 167 H 4.5380 8.9409 123.6060 56.5655 29.8512 174.8147 168 E 4.7279 9.4038 120.0405 54.9117 32.2763 175.4280 169 Q 5.0115 8.8189 123.5851 55.2524 30.8957 175.8042 170 I 4.5826 8.1317 121.7572 59.9751 41.6849 173.8678 171 D 4.7942 8.8923 128.0493 54.4320 41.0658 176.0395 172 L 4.2110 9.1327 126.5935 56.1686 42.4617 177.3083 173 F 4.9138 8.5669 117.0703 55.1333 38.2196 173.9239 174 D 4.8306 7.8519 118.5553 52.8620 44.9292 174.3212 175 S 4.4616 8.0579 113.7233 57.1064 65.4014 174.3847 176 P 4.6644 0.0000 0.0000 63.4230 32.6765 176.0762 177 N 3.9068 7.5412 114.2264 56.4367 39.0728 175.0756 178 E 4.1908 8.3110 117.8316 59.0926 30.6491 176.2423 179 G 3.9743 8.6399 104.4447 45.6358 0.0000 173.8317 180 T 4.2193 8.7761 111.6726 60.5547 69.9725 175.8805 181 R 3.2939 8.4597 121.3251 59.3564 29.9161 179.2912 182 S 4.0205 7.4906 112.6764 61.3016 62.1639 175.8226 183 D 4.3849 7.7091 120.4254 56.3278 40.6108 177.4686 184 I 4.2623 6.7326 117.8997 62.9571 38.7784 177.7418 185 F 4.1836 7.5030 114.1795 58.4093 38.3303 177.1408 186 A 3.4623 8.2024 124.2508 54.8801 17.9791 180.3831 187 K 3.8210 7.8111 115.3674 59.9437 32.6601 177.8409 188 Y 4.6738 7.4443 116.3798 58.8975 38.0201 176.8614 189 K 3.8639 8.1841 122.5550 59.7909 31.9412 177.5811 190 D 4.3775 8.2697 116.8781 54.4415 40.3944 175.6143 191 N 4.0990 8.4381 119.1772 54.3193 37.8757 173.5274 192 R 4.5679 8.6040 122.2309 55.8025 32.1231 176.0155 193 I 5.4925 8.3876 118.0795 59.4508 41.6901 173.9018 194 I 4.8199 8.8455 121.6232 59.3558 41.5653 173.2360 195 N 5.0749 8.8225 127.3951 53.3116 39.8736 175.5957 196 M 4.1682 9.6194 126.9916 57.2886 33.2954 177.1461 197 K 4.3790 7.3372 117.4953 57.0457 33.3819 176.9791 198 N 4.9841 8.2997 114.4391 54.4507 42.5392 172.6960 199 F 4.4953 8.1608 120.7045 58.1790 39.9849 174.1638 200 S 4.5634 8.5772 122.9283 59.3017 62.3328 174.4960 201 H 4.8513 6.7963 112.2951 54.5256 32.5395 171.0353 202 F 5.1853 8.1379 112.6822 55.1778 40.9101 173.7270 203 D 5.1362 9.1643 123.1427 52.7672 42.4381 175.2759 204 I 4.6844 9.2985 126.1574 60.2260 39.3914 174.5750 205 Y 5.1583 8.6935 124.3853 56.2638 40.7722 174.7066 206 L 4.6474 9.3650 125.2677 53.1179 44.5420 175.9220 207 E 4.6734 9.2096 126.1053 54.3961 30.6011 177.2205 208 K 4.3120 9.0526 124.2776 56.6769 32.0501 177.3493 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 3 K 8.31 4.14 0.00 1.89 1.99 0.00 1.58 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.31 1.45 7.81 4 K 6.99 4.49 0.00 1.83 1.76 0.00 1.62 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.60 7.81 5 D 8.03 5.01 0.00 2.77 2.63 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 6 I 7.15 3.43 1.89 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 1.28 1.26 0.94 0.00 0.00 7 S 8.13 4.24 0.00 3.94 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 8 N 7.77 4.80 0.00 2.75 2.75 0.00 0.00 6.94 7.26 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 9 V 7.25 4.34 2.38 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 1.00 0.00 0.00 0.99 0.00 0.00 10 K 8.05 4.09 0.00 2.00 2.25 0.00 2.52 0.00 0.00 2.25 0.00 0.00 3.28 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.94 1.91 7.81 11 S 7.76 4.25 0.00 4.23 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 D 8.07 4.56 0.00 2.69 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 13 L 8.60 4.05 0.00 0.83 0.52 0.60 0.73 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 14 L 7.91 4.00 0.00 2.13 1.92 1.10 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 15 Y 8.74 4.01 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 16 A 8.41 3.86 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 17 Y 7.72 4.45 0.00 3.17 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 18 T 7.23 4.35 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 1.23 0.00 0.00 19 I 7.21 4.41 1.69 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 0.90 0.17 0.67 0.00 0.00 20 T 8.07 4.35 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 1.21 0.00 0.00 21 P 0.00 3.72 0.00 0.51 0.88 0.00 3.67 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 1.66 2.04 0.00 22 Y 7.52 4.22 0.00 2.77 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 23 D 7.45 5.50 0.00 2.40 2.30 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 24 Y 7.44 3.89 0.00 2.83 2.46 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 25 K 8.10 4.79 0.00 1.74 1.88 0.00 1.87 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.58 1.38 7.81 26 D 9.59 4.32 0.00 2.75 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 27 C 8.86 5.00 0.00 2.95 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 R 8.68 5.07 0.00 1.82 2.02 0.00 3.25 0.00 0.00 3.37 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.40 0.00 29 V 8.16 4.60 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 1.01 0.00 0.00 0.96 0.00 0.00 30 N 8.60 4.65 0.00 2.78 2.93 0.00 0.00 6.30 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 31 F 7.61 5.49 0.00 3.10 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 32 S 8.70 4.32 0.00 3.75 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 T 8.00 4.87 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 34 T 8.83 4.05 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 1.21 0.00 0.00 *35 H 9.08 4.61 0.00 2.59 3.14 0.00 7.09 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.88 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 R 8.50 4.01 0.00 1.34 1.13 0.00 3.10 0.00 0.00 3.26 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.33 0.00 46 G 7.42 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 47 K 8.28 4.13 0.00 1.77 1.83 0.00 1.81 0.00 0.00 1.72 0.00 0.00 3.15 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.61 7.81 48 D 9.17 4.52 0.00 2.79 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 Y 8.25 4.56 0.00 3.06 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 50 Y 9.25 5.30 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 51 I 9.16 4.64 1.81 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.88 0.88 0.00 0.00 52 S 7.90 5.52 0.00 3.40 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 53 S 8.34 4.33 0.00 4.01 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 54 E 9.09 5.18 0.00 2.31 2.43 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 2.59 2.45 0.00 55 M 8.34 5.31 0.00 2.19 2.09 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.39 0.00 56 S 8.96 4.24 0.00 3.90 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 *57 Y 8.37 4.36 0.00 2.28 2.20 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 58 E 8.77 3.98 0.00 2.13 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 0.00 2.20 2.30 0.00 59 A 7.79 4.43 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 60 S 7.12 4.34 0.00 4.03 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 *63 F 8.18 4.65 0.00 3.07 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 64 K 8.37 3.71 0.00 1.78 1.85 0.00 1.76 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.49 7.81 65 R 8.16 3.48 0.00 1.97 2.25 0.00 3.29 0.00 0.00 3.27 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 2.00 0.00 66 D 8.19 4.78 0.00 2.71 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 D 8.84 5.18 0.00 2.74 2.55 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 68 H 8.64 5.34 0.00 2.96 3.13 0.00 5.64 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 V 8.91 4.57 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.81 0.00 0.00 70 D 9.43 5.39 0.00 2.50 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 V 9.16 4.85 2.26 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 S 7.96 4.10 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 81 H 9.14 4.28 0.00 3.09 3.31 0.00 6.04 0.00 0.00 0.00 0.00 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 T 7.49 3.45 4.40 0.00 0.00 0.00 0.00 0.00 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 83 G 7.96 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 84 E 8.21 4.93 0.00 1.53 1.84 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 2.24 2.17 0.00 85 Y 8.69 4.68 0.00 2.19 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 86 I 8.00 4.97 2.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.79 1.17 0.00 0.00 87 Y 9.04 5.47 0.00 3.28 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 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6.82 7.61 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 97 K 8.68 3.89 0.00 1.67 1.72 0.00 1.57 0.00 0.00 1.74 0.00 0.00 3.13 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.41 1.48 7.81 98 V 8.01 4.42 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 0.64 0.00 0.00 0.81 0.00 0.00 99 N 8.26 4.80 0.00 2.64 2.68 0.00 0.00 6.93 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 0.00 100 H 8.61 4.95 0.00 3.05 3.10 0.00 5.66 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 K 8.63 4.65 0.00 1.62 1.71 0.00 1.72 0.00 0.00 1.94 0.00 0.00 2.94 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.38 1.44 7.81 102 L 8.73 4.68 0.00 1.87 1.89 0.81 0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 103 L 8.09 4.74 0.00 1.44 1.38 0.88 0.80 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 0.00 104 G 7.10 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 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2.54 2.46 0.00 114 Q 7.96 4.41 0.00 2.18 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.39 6.68 0.00 0.00 0.00 0.00 0.00 2.43 2.42 0.00 115 N 8.39 3.97 0.00 2.72 2.63 0.00 0.00 7.08 7.85 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 0.00 116 L 8.46 3.77 0.00 1.77 1.74 0.88 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 117 N 7.60 4.28 0.00 2.63 2.67 0.00 0.00 7.28 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 N 9.11 4.59 0.00 2.78 3.18 0.00 0.00 6.75 7.15 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 0.00 119 K 7.65 4.54 0.00 1.65 1.63 0.00 1.83 0.00 0.00 1.93 0.00 0.00 3.26 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.33 1.44 7.81 120 I 7.59 4.53 1.85 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.15 0.75 0.00 0.00 121 I 8.32 4.85 1.81 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 1.30 0.57 0.98 0.00 0.00 122 L 8.42 4.37 0.00 1.43 1.38 0.47 0.43 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 0.00 123 E 8.00 4.74 0.00 1.80 1.87 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 2.11 2.17 0.00 124 K 7.75 4.56 0.00 1.56 1.83 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.78 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.28 1.35 7.81 125 D 8.89 4.55 0.00 2.61 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 I 7.65 4.59 1.88 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.56 0.97 0.00 0.00 127 V 8.42 4.38 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 0.75 0.00 0.00 0.81 0.00 0.00 128 T 8.29 4.62 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 1.20 0.00 0.00 129 F 9.24 4.00 0.00 3.21 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 Q 7.95 3.29 0.00 1.60 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.81 0.00 0.00 0.00 0.00 0.00 1.78 1.16 0.00 131 E 7.97 3.98 0.00 1.76 1.81 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 1.84 1.47 0.00 132 I 7.35 3.48 1.79 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 1.07 0.49 0.78 0.00 0.00 133 D 9.15 4.40 0.00 2.83 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 0.00 134 F 7.87 4.47 0.00 3.35 3.32 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 0.00 135 K 8.18 3.58 0.00 1.72 1.66 0.00 1.39 0.00 0.00 1.47 0.00 0.00 2.90 0.00 0.00 2.54 0.00 0.00 0.00 0.00 1.40 1.56 7.81 136 I 7.39 3.49 1.68 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.11 0.53 0.00 0.00 137 R 7.25 3.78 0.00 1.68 1.60 0.00 2.56 0.00 0.00 2.25 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.47 0.00 138 K 7.81 3.74 0.00 1.09 1.64 0.00 1.41 0.00 0.00 1.45 0.00 0.00 2.91 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.45 1.30 7.81 139 Y 7.46 4.27 0.00 2.83 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 L 8.46 4.23 0.00 1.86 1.65 0.67 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.00 0.00 141 M 7.68 3.93 0.00 2.04 2.19 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.57 0.00 142 D 8.27 4.36 0.00 2.44 2.63 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 0.00 143 N 7.74 4.48 0.00 2.82 2.72 0.00 0.00 6.44 7.55 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 0.00 144 Y 7.84 4.58 0.00 2.81 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 0.00 145 K 7.94 3.76 0.00 1.87 1.87 0.00 1.79 0.00 0.00 1.74 0.00 0.00 3.11 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.58 1.42 7.81 146 I 7.71 4.67 1.81 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 -0.36 0.60 0.00 0.00 147 Y 7.62 5.14 0.00 3.06 3.21 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 0.00 148 D 8.19 4.54 0.00 2.77 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 A 8.58 3.90 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 0.00 150 T 7.61 4.00 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 1.23 0.00 0.00 151 S 7.84 4.45 0.00 3.83 4.07 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 0.00 152 P 0.00 4.27 0.00 1.97 1.95 0.00 3.27 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 0.66 1.51 0.00 153 Y 6.20 4.30 0.00 3.25 3.15 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 0.00 154 V 7.58 4.00 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 0.75 0.00 0.00 0.86 0.00 0.00 155 S 6.22 4.24 0.00 3.69 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 0.00 156 G 8.32 4.54 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 0.00 0.00 0.00 157 R 8.05 5.10 0.00 2.16 2.10 0.00 3.00 0.00 0.00 3.34 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.96 0.00 158 I 8.66 4.55 1.91 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 1.12 1.01 0.88 0.00 0.00 159 E 9.06 5.14 0.00 2.40 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.51 0.00 160 I 9.03 4.45 2.01 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.04 0.73 0.00 0.00 161 G 8.51 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 0.00 162 T 8.04 5.16 4.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 163 K 8.80 4.28 0.00 1.95 1.90 0.00 1.66 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.48 1.52 7.81 164 D 7.86 4.87 0.00 2.84 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 0.00 165 G 8.17 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 0.00 166 K 7.61 4.42 0.00 1.77 1.76 0.00 1.89 0.00 0.00 1.78 0.00 0.00 3.07 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.55 7.81 167 H 8.94 4.54 0.00 3.07 3.32 0.00 5.89 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 0.00 168 E 9.40 4.73 0.00 2.15 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.59 0.00 169 Q 8.82 5.01 0.00 1.98 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.71 0.00 0.00 0.00 0.00 0.00 2.40 2.44 0.00 170 I 8.13 4.58 1.98 0.00 0.00 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 1.27 0.87 1.12 0.00 0.00 171 D 8.89 4.79 0.00 2.76 2.66 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 0.00 172 L 9.13 4.21 0.00 1.87 1.60 0.84 0.53 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 0.00 173 F 8.57 4.91 0.00 2.98 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 0.00 174 D 7.85 4.83 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 0.00 175 S 8.06 4.46 0.00 3.83 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 P 0.00 4.66 0.00 2.04 1.99 0.00 3.73 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.08 0.00 177 N 7.54 3.91 0.00 2.70 2.77 0.00 0.00 6.63 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 0.00 178 E 8.31 4.19 0.00 1.89 2.22 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 2.17 2.25 0.00 179 G 8.64 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 0.00 180 T 8.78 4.22 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 1.24 0.00 0.00 181 R 8.46 3.29 0.00 1.76 1.45 0.00 3.23 0.00 0.00 3.15 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.53 0.00 182 S 7.49 4.02 0.00 3.55 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 0.00 183 D 7.71 4.38 0.00 2.89 2.66 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 0.00 184 I 6.73 4.26 1.67 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.84 1.01 0.00 0.00 185 F 7.50 4.18 0.00 3.33 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 0.00 186 A 8.20 3.46 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 0.00 187 K 7.81 3.82 0.00 1.86 1.88 0.00 1.56 0.00 0.00 1.66 0.00 0.00 3.07 0.00 0.00 2.54 0.00 0.00 0.00 0.00 1.41 0.92 7.81 188 Y 7.44 4.67 0.00 3.44 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 0.00 189 K 8.18 3.86 0.00 1.71 1.72 0.00 1.35 0.00 0.00 1.59 0.00 0.00 3.06 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.47 1.58 7.81 190 D 8.27 4.38 0.00 2.85 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 0.00 191 N 8.44 4.10 0.00 2.84 2.99 0.00 0.00 7.06 7.98 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 0.00 192 R 8.60 4.57 0.00 2.22 1.64 0.00 2.89 0.00 0.00 2.66 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.50 0.00 193 I 8.39 5.49 2.10 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 1.35 0.96 1.05 0.00 0.00 194 I 8.85 4.82 2.14 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.52 0.66 0.00 0.00 195 N 8.82 5.07 0.00 2.90 2.70 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 0.00 196 M 9.62 4.17 0.00 1.80 2.16 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.56 0.00 197 K 7.34 4.38 0.00 1.85 1.88 0.00 1.59 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.42 1.38 7.81 198 N 8.30 4.98 0.00 2.89 2.97 0.00 0.00 6.83 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 0.00 199 F 8.16 4.50 0.00 2.99 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 0.00 200 S 8.58 4.56 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 0.00 201 H 6.80 4.85 0.00 3.02 3.22 0.00 5.45 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 F 8.14 5.19 0.00 3.03 3.17 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 0.00 203 D 9.16 5.14 0.00 2.82 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 0.00 204 I 9.30 4.68 1.80 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.92 0.75 0.00 0.00 205 Y 8.69 5.16 0.00 3.03 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 0.00 206 L 9.37 4.65 0.00 1.51 1.60 0.13 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 207 E 9.21 4.67 0.00 2.11 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 208 K 9.05 4.31 0.00 1.73 1.71 0.00 1.88 0.00 0.00 1.72 0.00 0.00 3.12 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.44 1.53 7.81 * Residues marked with a * may have inaccurate shift predictions.