NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.5064 8.1776 115.4187 57.9120 64.5116 174.5848 3 E 3.8780 8.5474 120.3827 58.2366 29.4037 177.7529 4 R 3.9074 8.1509 120.2620 59.1212 30.6639 179.1228 5 R 3.9483 7.9313 118.2459 59.7268 30.1028 178.0304 6 D 4.3660 7.8776 118.2351 57.4220 40.8374 178.9371 7 A 3.9138 7.9559 120.9649 55.1356 18.3537 179.3842 8 I 3.5881 8.2773 118.7595 64.8446 37.2327 178.5604 9 L 3.6512 8.1584 119.7339 57.3791 41.4262 179.5554 10 K 3.6330 7.9323 119.6633 59.3694 32.1253 178.6414 11 A 3.9647 7.9620 121.0160 55.2803 18.2263 179.6964 12 S 3.9629 8.2862 113.7146 61.7588 62.8954 176.8501 13 A 4.0829 8.0923 123.6681 55.2570 17.9582 179.8282 14 T 3.8206 7.8377 107.9682 64.8534 69.0029 176.6448 15 A 3.9763 8.3530 124.1680 54.8772 18.4041 179.6536 16 I 3.6171 8.1909 118.3930 64.5972 37.0083 178.5800 17 A 4.0429 7.9265 120.1282 54.6532 18.2163 178.7525 18 Q 4.3702 7.7156 114.8713 56.6572 29.9819 177.3314 19 R 4.4896 7.8958 116.7685 54.1745 32.2076 177.4381 20 G 4.1444 7.6329 102.3100 45.5150 0.0000 173.5038 21 I 3.9660 9.4206 120.4001 63.3673 37.5874 177.2362 22 R 4.0311 8.1065 120.4302 57.4574 30.1497 176.1081 23 G 3.8949 8.8508 111.9572 45.8960 0.0000 172.8611 24 L 4.1046 7.9426 122.2347 54.4570 42.7473 176.6975 25 R 4.7120 9.2177 125.2457 53.8845 34.2618 176.4156 26 V 3.5005 8.2901 121.4797 66.4521 31.3640 178.0576 27 N 4.3138 8.0874 115.4536 56.1294 38.2875 177.0163 28 D 4.2894 7.9791 119.9844 57.3401 40.9451 178.7628 29 V 3.4923 7.8424 118.4038 65.9472 31.6220 177.6907 30 A 3.9258 8.5547 120.8829 55.2400 17.9109 179.2418 31 E 3.8503 7.8869 116.6924 59.5358 29.8399 179.0260 32 V 3.7014 7.4331 116.5782 65.5642 31.6682 177.3263 33 A 4.2214 8.2305 119.5387 52.3798 18.4270 178.2196 34 G 3.8252 7.7725 104.3684 45.9395 0.0000 173.4904 35 V 4.4979 7.3522 111.2046 58.4171 35.2464 175.9887 36 S 4.4571 8.1905 115.9837 57.5432 65.1330 173.3877 37 P 4.2083 0.0000 0.0000 65.5189 30.9527 179.1233 38 G 3.8510 8.1914 104.1949 47.9258 0.0000 175.2909 39 L 4.0633 7.9604 122.9823 57.5895 42.0702 178.7479 40 L 4.0738 8.0172 120.3043 58.6381 42.0197 178.6912 41 Y 4.3595 8.3412 116.9763 61.0125 37.4769 177.9134 42 Y 4.1399 8.1894 120.2705 61.1960 39.0019 177.7354 43 H 3.7518 8.3664 115.8863 57.7247 29.0833 176.2613 44 F 4.8097 8.0553 116.0289 56.2895 40.5488 176.0316 45 K 4.3160 9.9307 127.1487 56.1120 32.1860 175.3280 46 D 5.0206 7.4786 114.4211 51.1795 42.3918 175.5524 47 R 3.9031 8.9435 117.9099 59.9306 29.7699 178.3545 48 I 3.8398 7.8694 119.1959 64.1357 37.0751 178.3862 49 G 4.0465 8.7096 108.3218 47.1344 0.0000 175.4071 50 L 3.4902 8.1468 122.8821 57.8412 42.1350 179.1602 51 L 3.8889 7.9951 118.9482 57.6545 41.5016 179.1619 52 E 3.9540 8.6068 119.5623 59.1305 29.5729 178.6425 53 A 4.0516 8.4051 121.0825 55.1553 18.3605 179.5324 54 A 3.9181 8.1049 119.4057 55.0659 18.3703 179.5208 55 L 4.0358 8.4637 119.2885 58.5716 42.1742 179.0683 56 N 4.4315 8.4795 116.4306 56.3166 38.3222 176.7549 57 Y 4.0386 8.2942 121.0070 60.9021 38.9187 178.3601 58 I 3.9358 8.2053 122.1625 63.7656 37.1440 177.8369 59 N 3.6474 8.5215 118.1144 56.7102 38.8266 176.6289 60 D 4.1503 7.9696 120.0906 57.3756 40.8802 179.0582 61 R 3.3766 7.3156 118.4018 58.7413 29.9584 178.9483 62 A 3.7569 7.5953 120.6047 55.0336 18.0685 179.8415 63 R 3.6300 7.5663 115.3958 59.1128 30.3982 178.6982 64 A 4.0095 7.4451 120.2042 55.5901 18.1384 179.1959 65 Y 4.4664 7.1255 113.4465 61.4735 38.0551 178.8671 66 R 4.3627 7.9863 116.9186 57.3658 30.6755 177.1666 67 S 4.5849 7.8771 112.2361 57.3064 64.1485 173.4048 68 E 4.0256 8.1788 121.1671 58.9272 29.2051 176.9792 69 G 3.9021 9.0061 111.6528 45.3553 0.0000 172.6299 70 E 4.0236 7.6511 118.4555 56.9068 30.1113 176.9430 71 G 4.1995 8.5994 108.9385 43.8799 0.0000 173.2349 72 S 3.9889 8.6918 116.6467 59.0791 63.7291 174.7848 73 G 3.8936 8.6258 114.9957 46.5415 0.0000 173.1008 74 D 4.5614 7.6792 116.8325 53.3891 42.4121 177.9439 75 S 4.3080 8.5996 117.2771 58.1621 64.9047 175.3739 76 A 3.9456 8.2346 123.4418 55.4430 18.0146 179.8699 77 R 3.8164 8.0559 116.5644 59.8880 30.0254 178.1597 78 D 4.3423 8.2469 118.3825 57.4594 40.8877 179.0665 79 R 3.9236 8.1155 118.4738 59.2936 30.0293 179.1498 80 L 4.0266 8.4460 119.0814 58.0601 41.6140 179.7863 81 T 3.8605 8.2518 115.9802 66.7328 68.5462 177.0213 82 R 3.9336 7.9913 119.9948 59.3663 29.8724 179.1331 83 S 4.2715 7.8207 111.4032 61.1430 62.4949 175.7199 84 L 4.4393 8.2171 121.1389 56.8107 41.8740 178.3099 85 L 4.4880 8.0872 117.8768 55.3576 42.1127 178.7894 86 G 3.7048 7.7666 107.2449 48.2169 0.0000 174.0224 87 E 4.3554 7.9381 116.1388 55.9971 29.7400 176.2697 88 I 3.4067 7.3467 120.5470 58.8855 36.4899 174.5091 89 Q 4.5063 7.6287 122.2566 53.9978 32.7858 175.9829 90 D 4.4109 8.6546 119.4268 55.9826 41.4775 177.8770 91 R 3.9642 7.3950 120.2571 55.7913 31.1580 175.4642 92 P 4.2579 0.0000 0.0000 65.8854 31.4443 178.3164 93 E 4.2018 8.1109 116.0619 58.2482 29.5143 179.1687 94 V 3.0924 7.4829 118.4761 65.7380 31.6022 177.8251 95 V 3.6229 7.7111 117.9090 66.1398 31.3741 177.7085 96 E 3.9569 8.2474 118.1617 59.4360 28.9473 178.8642 97 N 4.4210 8.3598 116.9055 57.0995 39.0294 177.1677 98 S 4.4240 8.6083 116.7628 61.3389 62.8738 176.6083 99 L 3.9775 8.4124 122.1473 57.8549 41.3721 179.4774 100 A 4.0356 7.9642 120.1727 54.7820 18.2536 179.4213 101 W 4.0211 8.4027 126.9807 60.6058 30.8051 177.4759 102 N 4.3178 8.7067 117.4042 56.9459 38.3001 176.4060 103 E 3.9425 8.2548 120.4964 59.1107 29.5831 178.6728 104 L 3.8324 7.8556 120.4846 57.0466 41.4047 179.3406 105 R 3.6065 7.5818 117.4282 59.3979 30.3802 177.9537 106 A 4.1251 7.9647 120.6405 55.2871 18.4787 179.7787 107 S 3.5389 8.0757 112.4371 60.9414 62.9156 176.3310 108 A 4.0807 7.2536 123.1254 53.9566 18.0481 179.1511 109 V 3.6471 6.9161 115.7157 65.7232 31.6805 176.2493 110 Y 4.5983 7.0853 113.0422 57.0599 39.6804 175.8497 111 E 4.3881 7.6376 122.3680 54.7071 28.3446 176.2332 112 E 3.9370 8.3079 123.1782 58.8569 29.5953 178.0255 113 A 4.1592 7.8769 119.1002 54.0152 18.8776 178.4359 114 L 4.2064 7.9535 116.7510 55.7167 41.9003 179.1911 115 R 3.8338 7.7012 119.3631 59.0827 29.9660 178.1536 116 D 4.3139 8.0299 117.5354 56.9440 41.3192 176.4112 117 P 4.2658 0.0000 0.0000 65.7593 31.1685 178.0210 118 L 3.9701 7.9589 119.9018 57.7697 41.9878 178.8336 119 A 4.0356 8.4516 121.1431 55.3089 18.4646 179.8937 120 R 3.9422 8.2917 117.0267 59.6634 30.0450 179.5012 121 T 4.0301 8.2780 109.7362 65.1936 68.7685 176.8455 122 T 4.2311 8.6119 118.6900 66.3519 68.3910 176.4508 123 A 4.0462 8.6671 123.0486 55.1664 18.2063 179.5839 124 A 3.9827 8.0646 118.9074 54.8305 18.2287 179.7334 125 W 4.2687 8.1381 127.0383 60.7347 30.8076 178.3534 126 V 3.4384 8.2631 118.6390 66.1019 30.8475 177.9051 127 S 4.1367 8.4079 113.0233 61.1403 62.1487 175.6825 128 E 3.9427 7.9989 122.2427 59.3784 29.4161 179.0052 129 I 3.6738 7.4252 118.1173 64.2813 37.1389 178.2710 130 A 3.9618 8.3222 122.0798 55.0762 18.1549 179.1399 131 D 4.2021 8.4711 116.6417 57.4439 41.4136 178.0329 132 A 3.9852 7.9226 121.2572 55.4358 18.3005 179.6187 133 I 3.5898 7.7493 117.8871 64.5466 37.3056 178.6969 134 V 3.5723 7.8721 118.9798 66.2051 31.2145 177.9428 135 Q 3.9710 8.2515 117.4346 59.0931 28.6110 178.9022 136 A 4.1072 7.9585 121.5040 55.2329 18.1623 179.7201 137 Q 4.1214 8.4390 116.0457 58.9489 28.7764 177.9532 138 A 4.1412 7.7636 122.5088 55.1808 18.5547 178.7336 139 T 4.0298 7.4239 103.4932 62.8094 69.0118 175.9851 140 G 3.9849 8.1992 111.1566 45.0801 0.0000 174.9387 141 E 3.6878 7.5231 118.8092 58.1719 29.8395 176.7398 142 I 4.6053 6.9449 117.9100 58.7261 40.9107 175.0754 143 S 4.0597 8.6950 117.6239 59.2485 62.3748 175.4619 144 R 4.2308 8.5466 125.8886 58.0840 30.2160 177.6650 145 S 4.3239 7.6382 112.0979 59.7388 63.5887 174.9119 146 L 3.8958 7.2545 120.6564 54.9832 41.8876 176.5520 147 D 4.6389 8.5195 122.4741 52.4678 42.0466 175.1177 148 P 4.2018 0.0000 0.0000 65.6413 31.4018 178.4541 149 Q 3.8702 7.9248 117.6708 58.8754 29.1923 176.0405 150 P 4.2081 0.0000 0.0000 66.0341 31.0894 178.7596 151 T 3.8332 7.8707 113.3693 66.5802 68.4621 176.4586 152 A 4.0034 7.9725 121.8310 54.9532 18.6512 179.5830 153 V 3.6197 8.0449 117.3159 66.1717 31.5014 178.3820 154 T 3.9040 7.6676 113.0727 64.4625 68.0797 176.2548 *156 T 3.5255 7.9380 113.7105 61.3279 70.6315 175.8982 157 A 4.0011 7.8170 123.8980 54.5981 18.1867 179.2751 158 L 3.8682 8.0192 119.1099 58.2798 42.1924 179.1562 159 V 3.6733 7.8496 117.6029 66.3201 31.4275 177.4689 160 E 4.3045 8.6123 118.1829 59.5370 29.2916 179.6946 161 G 3.6817 8.4053 105.6469 47.9260 0.0000 175.7746 162 L 4.1018 8.4038 122.4093 57.4728 41.6173 179.4575 163 S 4.5286 8.9074 113.6620 61.5563 61.7929 176.4990 164 G 3.7109 8.5072 108.4626 47.9115 0.0000 175.9601 165 R 4.0457 8.0500 120.1705 58.6152 30.0423 178.8189 166 W 4.5730 8.5190 129.7803 60.1134 30.5590 178.0359 167 L 3.6241 8.0446 116.9621 56.9674 41.1205 178.2503 168 C 4.3197 7.4846 114.1154 59.0633 28.3197 173.5826 169 K 3.9089 7.6580 118.9179 57.3830 29.7669 176.2293 170 E 4.2411 8.3822 121.6680 57.5713 29.7910 176.2795 171 I 4.7252 7.4515 117.7803 58.0064 41.3639 174.4805 172 S 4.5306 8.4792 121.2608 58.1839 65.1625 175.3157 173 T 3.6214 8.7617 119.5840 67.1361 68.1843 176.5684 174 E 3.9280 8.1013 119.5867 59.5250 29.4834 179.0650 175 D 4.1979 8.2160 118.7039 57.1110 40.9805 178.5629 176 A 3.9201 8.1354 121.5232 55.3510 18.2769 179.9780 177 R 3.7896 7.8440 116.4932 59.2486 30.0365 179.3037 178 S 4.0359 8.1761 113.1107 61.5703 62.3433 175.6895 179 H 4.2274 8.2620 119.2059 59.0401 28.4151 177.6965 180 L 3.9714 7.8136 120.1301 57.8183 41.4602 179.3908 181 L 4.0685 8.2509 119.3606 57.8761 41.5584 179.8630 182 G 3.6293 8.5500 105.6365 47.6853 0.0000 175.4332 183 A 3.9949 8.1741 123.4332 55.0288 18.2112 179.6594 184 I 3.6221 7.8110 117.1526 64.7029 37.2532 178.0099 185 D 4.4907 8.2533 118.8109 57.3796 40.7413 178.5926 186 V 3.7786 7.6373 117.4547 65.9368 31.5590 179.0900 187 V 3.7848 7.4007 115.9808 62.9972 31.5965 175.8110 *189 S 4.2256 8.1415 117.1788 58.0721 63.2226 173.1948 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 2 S 8.18 4.51 0.00 4.06 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 E 8.55 3.88 0.00 2.29 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 2.38 2.39 0.00 4 R 8.15 3.91 0.00 1.93 2.02 0.00 3.24 0.00 0.00 3.28 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.69 0.00 5 R 7.93 3.95 0.00 2.04 2.16 0.00 3.18 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.82 0.00 6 D 7.88 4.37 0.00 2.95 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 7 A 7.96 3.91 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 8 I 8.28 3.59 2.14 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 1.52 0.89 0.95 0.00 0.00 9 L 8.16 3.65 0.00 1.53 0.73 0.43 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 10 K 7.93 3.63 0.00 1.77 1.84 0.00 1.78 0.00 0.00 1.79 0.00 0.00 3.09 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.50 1.52 7.81 11 A 7.96 3.96 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 S 8.29 3.96 0.00 3.87 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 13 A 8.09 4.08 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 T 7.84 3.82 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 1.29 0.00 0.00 15 A 8.35 3.98 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 I 8.19 3.62 2.01 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.00 0.90 0.00 0.00 17 A 7.93 4.04 1.38 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 18 Q 7.72 4.37 0.00 2.06 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.72 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 19 R 7.90 4.49 0.00 2.01 1.93 0.00 3.34 0.00 0.00 3.21 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 20 G 7.63 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 21 I 9.42 3.97 2.04 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 1.17 0.82 0.98 0.00 0.00 22 R 8.11 4.03 0.00 1.66 1.76 0.00 3.16 0.00 0.00 2.92 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.13 0.00 23 G 8.85 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 24 L 7.94 4.10 0.00 1.82 1.70 0.90 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 25 R 9.22 4.71 0.00 1.87 1.72 0.00 3.24 0.00 0.00 3.13 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.66 0.00 26 V 8.29 3.50 2.01 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 0.42 0.00 0.00 0.86 0.00 0.00 27 N 8.09 4.31 0.00 2.77 2.85 0.00 0.00 7.13 8.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 D 7.98 4.29 0.00 2.85 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 29 V 7.84 3.49 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 0.99 0.00 0.00 0.86 0.00 0.00 30 A 8.55 3.93 1.38 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 31 E 7.89 3.85 0.00 1.96 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 0.00 2.31 2.35 0.00 32 V 7.43 3.70 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 0.89 0.00 0.00 0.96 0.00 0.00 33 A 8.23 4.22 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 34 G 7.77 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 0.00 0.00 0.00 35 V 7.35 4.50 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.93 0.00 0.00 36 S 8.19 4.46 0.00 4.06 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 37 P 0.00 4.21 0.00 2.28 2.18 0.00 3.63 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.20 0.00 38 G 8.19 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 0.00 0.00 0.00 39 L 7.96 4.06 0.00 1.83 1.73 0.83 0.58 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 40 L 8.02 4.07 0.00 1.92 1.63 0.83 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 41 Y 8.34 4.36 0.00 3.30 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 42 Y 8.19 4.14 0.00 2.98 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 43 H 8.37 3.75 0.00 2.39 1.48 0.00 5.84 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 F 8.06 4.81 0.00 3.18 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 45 K 9.93 4.32 0.00 1.92 2.07 0.00 1.83 0.00 0.00 1.78 0.00 0.00 3.03 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.37 1.39 7.81 46 D 7.48 5.02 0.00 3.00 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 R 8.94 3.90 0.00 1.98 2.04 0.00 3.22 0.00 0.00 3.37 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.74 0.00 48 I 7.87 3.84 1.90 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 1.59 0.82 0.92 0.00 0.00 49 G 8.71 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 50 L 8.15 3.49 0.00 1.65 1.79 0.23 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 51 L 8.00 3.89 0.00 1.69 1.63 0.89 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 52 E 8.61 3.95 0.00 2.05 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 2.34 2.35 0.00 53 A 8.41 4.05 1.36 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 0.00 0.00 54 A 8.10 3.92 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 55 L 8.46 4.04 0.00 1.73 1.88 0.75 0.91 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 56 N 8.48 4.43 0.00 2.99 2.92 0.00 0.00 6.68 7.09 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 57 Y 8.29 4.04 0.00 3.08 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 I 8.21 3.94 2.40 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 1.61 1.26 1.27 0.00 0.00 59 N 8.52 3.65 0.00 2.94 2.99 0.00 0.00 7.23 8.83 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 60 D 7.97 4.15 0.00 2.68 2.49 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 61 R 7.32 3.38 0.00 1.65 1.36 0.00 2.62 0.00 0.00 2.67 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.95 0.00 62 A 7.60 3.76 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 R 7.57 3.63 0.00 1.77 1.86 0.00 3.08 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.66 0.00 64 A 7.45 4.01 1.07 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 0.00 0.00 65 Y 7.13 4.47 0.00 3.01 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 R 7.99 4.36 0.00 1.83 1.96 0.00 3.18 0.00 0.00 2.75 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.64 0.00 67 S 7.88 4.58 0.00 3.95 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 68 E 8.18 4.03 0.00 2.18 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 69 G 9.01 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 E 7.65 4.02 0.00 2.03 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 71 G 8.60 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 72 S 8.69 3.99 0.00 3.99 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 73 G 8.63 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 74 D 7.68 4.56 0.00 2.68 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 S 8.60 4.31 0.00 4.04 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 76 A 8.23 3.95 1.37 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 0.00 0.00 0.00 77 R 8.06 3.82 0.00 1.88 1.95 0.00 3.18 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.74 0.00 78 D 8.25 4.34 0.00 2.91 2.70 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 79 R 8.12 3.92 0.00 1.98 2.12 0.00 3.13 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.86 0.00 80 L 8.45 4.03 0.00 1.80 1.71 0.94 0.71 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 81 T 8.25 3.86 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 1.20 0.00 0.00 82 R 7.99 3.93 0.00 1.88 2.21 0.00 3.31 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.63 0.00 83 S 7.82 4.27 0.00 3.98 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 L 8.22 4.44 0.00 1.74 1.75 0.90 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 85 L 8.09 4.49 0.00 1.93 1.63 0.90 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 86 G 7.77 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 0.00 0.00 0.00 87 E 7.94 4.36 0.00 1.83 1.91 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 2.17 2.08 0.00 88 I 7.35 3.41 1.40 0.00 0.00 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 0.75 0.36 -0.40 0.00 0.00 89 Q 7.63 4.51 0.00 1.94 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.51 6.95 0.00 0.00 0.00 0.00 0.00 2.21 2.33 0.00 90 D 8.65 4.41 0.00 2.70 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 91 R 7.40 3.96 0.00 1.86 1.82 0.00 3.08 0.00 0.00 3.22 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 92 P 0.00 4.26 0.00 2.16 2.11 0.00 3.58 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.19 0.00 93 E 8.11 4.20 0.00 2.07 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 2.63 2.40 0.00 94 V 7.48 3.09 2.05 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 0.98 0.00 0.00 -0.03 0.00 0.00 95 V 7.71 3.62 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 0.81 0.00 0.00 1.03 0.00 0.00 96 E 8.25 3.96 0.00 2.12 2.04 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 2.34 2.45 0.00 97 N 8.36 4.42 0.00 3.26 3.18 0.00 0.00 7.28 7.06 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 98 S 8.61 4.42 0.00 4.14 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 99 L 8.41 3.98 0.00 1.86 1.72 0.88 0.59 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 0.00 100 A 7.96 4.04 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 W 8.40 4.02 0.00 3.44 3.13 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 0.00 102 N 8.71 4.32 0.00 3.10 3.07 0.00 0.00 6.90 7.32 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 0.00 103 E 8.25 3.94 0.00 2.14 2.05 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 2.46 2.37 0.00 104 L 7.86 3.83 0.00 1.38 1.24 0.83 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 105 R 7.58 3.61 0.00 1.53 2.08 0.00 3.33 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.68 0.00 106 A 7.96 4.13 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 0.00 107 S 8.08 3.54 0.00 3.72 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 0.00 108 A 7.25 4.08 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 V 6.92 3.65 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 0.95 0.00 0.00 0.97 0.00 0.00 110 Y 7.09 4.60 0.00 3.12 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 E 7.64 4.39 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 1.97 2.27 0.00 112 E 8.31 3.94 0.00 2.00 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 2.39 2.39 0.00 113 A 7.88 4.16 1.29 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 0.00 114 L 7.95 4.21 0.00 1.70 1.57 0.78 0.66 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 0.00 115 R 7.70 3.83 0.00 1.95 1.95 0.00 3.19 0.00 0.00 3.07 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.64 0.00 116 D 8.03 4.31 0.00 2.79 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 0.00 117 P 0.00 4.27 0.00 2.33 2.33 0.00 3.72 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.02 0.00 118 L 7.96 3.97 0.00 1.76 1.90 0.44 0.88 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 0.00 119 A 8.45 4.04 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 R 8.29 3.94 0.00 1.92 2.04 0.00 3.16 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.80 0.00 121 T 8.28 4.03 4.58 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 1.41 0.00 0.00 122 T 8.61 4.23 4.58 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 1.46 0.00 0.00 123 A 8.67 4.05 1.40 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 0.00 0.00 0.00 124 A 8.06 3.98 1.43 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 0.00 0.00 125 W 8.14 4.27 0.00 3.18 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 0.00 126 V 8.26 3.44 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 0.92 0.00 0.00 0.87 0.00 0.00 127 S 8.41 4.14 0.00 4.01 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 0.00 128 E 8.00 3.94 0.00 2.15 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 2.38 2.46 0.00 129 I 7.43 3.67 1.84 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 1.46 0.71 0.83 0.00 0.00 130 A 8.32 3.96 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 D 8.47 4.20 0.00 2.84 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 0.00 132 A 7.92 3.99 1.38 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 0.00 133 I 7.75 3.59 2.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.64 0.89 0.00 0.00 134 V 7.87 3.57 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 1.03 0.00 0.00 0.97 0.00 0.00 135 Q 8.25 3.97 0.00 2.10 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.67 2.53 0.00 136 A 7.96 4.11 1.36 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 0.00 0.00 137 Q 8.44 4.12 0.00 2.12 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.91 0.00 0.00 0.00 0.00 0.00 2.51 2.60 0.00 138 A 7.76 4.14 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 T 7.42 4.03 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 0.00 140 G 8.20 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 E 7.52 3.69 0.00 1.97 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 2.32 2.28 0.00 142 I 6.94 4.61 1.86 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 1.17 0.78 0.90 0.00 0.00 143 S 8.70 4.06 0.00 3.84 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 0.00 144 R 8.55 4.23 0.00 1.84 1.96 0.00 3.25 0.00 0.00 3.27 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.75 0.00 145 S 7.64 4.32 0.00 3.92 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 0.00 146 L 7.25 3.90 0.00 1.81 1.64 0.90 0.96 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 0.00 147 D 8.52 4.64 0.00 2.69 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 0.00 148 P 0.00 4.20 0.00 2.18 2.06 0.00 3.64 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.32 0.00 149 Q 7.92 3.87 0.00 2.14 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.85 0.00 0.00 0.00 0.00 0.00 2.41 2.49 0.00 150 P 0.00 4.21 0.00 2.27 2.07 0.00 3.69 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.17 0.00 151 T 7.87 3.83 4.34 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 1.17 0.00 0.00 152 A 7.97 4.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 V 8.04 3.62 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 0.98 0.00 0.00 0.96 0.00 0.00 154 T 7.67 3.90 4.32 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 1.18 0.00 0.00 *156 T 7.94 3.53 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 -0.27 0.00 0.00 157 A 7.82 4.00 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 0.00 158 L 8.02 3.87 0.00 1.75 1.65 0.94 0.70 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 0.00 159 V 7.85 3.67 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 1.14 0.00 0.00 160 E 8.61 4.30 0.00 2.35 2.19 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 2.84 2.92 0.00 161 G 8.41 3.68 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 0.00 0.00 0.00 162 L 8.40 4.10 0.00 1.74 1.79 0.96 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 163 S 8.91 4.53 0.00 4.04 4.23 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 0.00 164 G 8.51 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 R 8.05 4.05 0.00 2.10 2.08 0.00 3.21 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.87 0.00 166 W 8.52 4.57 0.00 3.45 3.49 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 0.00 167 L 8.04 3.62 0.00 1.63 1.58 1.05 0.26 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 0.00 168 C 7.48 4.32 0.00 3.20 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 0.00 169 K 7.66 3.91 0.00 1.87 1.86 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.26 1.23 7.81 170 E 8.38 4.24 0.00 1.95 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.26 0.00 171 I 7.45 4.73 1.96 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 1.52 1.37 1.08 0.00 0.00 172 S 8.48 4.53 0.00 4.35 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 0.00 173 T 8.76 3.62 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 1.06 0.00 0.00 174 E 8.10 3.93 0.00 2.04 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 0.00 2.40 2.45 0.00 175 D 8.22 4.20 0.00 2.68 2.59 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 0.00 176 A 8.14 3.92 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 0.00 177 R 7.84 3.79 0.00 1.96 1.90 0.00 3.14 0.00 0.00 2.96 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.47 0.00 178 S 8.18 4.04 0.00 3.90 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 0.00 179 H 8.26 4.23 0.00 3.36 3.34 0.00 5.69 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 L 7.81 3.97 0.00 1.84 1.71 0.97 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 181 L 8.25 4.07 0.00 1.84 1.72 0.90 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 182 G 8.55 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 0.00 183 A 8.17 3.99 1.37 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 0.00 0.00 0.00 184 I 7.81 3.62 2.01 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.68 0.90 0.00 0.00 185 D 8.25 4.49 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 0.00 186 V 7.64 3.78 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 0.78 0.00 0.00 1.02 0.00 0.00 187 V 7.40 3.78 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 0.89 0.00 0.00 0.91 0.00 0.00 *189 S 8.14 4.23 0.00 4.04 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 * Residues marked with a * may have inaccurate shift predictions.