NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5525 8.3049 118.1913 54.8662 32.5872 174.8372 2 R 4.0344 8.3683 120.3412 55.6247 31.0369 175.3603 3 L 4.1271 9.4045 124.6377 57.3855 43.0035 175.5760 4 P 4.6004 0.0000 0.0000 62.8734 31.7512 175.4837 5 I 4.8419 8.6094 123.8702 59.0047 42.0093 173.6182 6 L 5.1271 8.7351 129.5698 53.4540 44.8769 174.8633 7 I 4.7329 8.8503 128.1055 59.6888 39.6674 174.8407 8 I 4.6616 8.9047 129.1674 60.0068 38.3723 174.5450 9 N 4.9527 9.3534 128.3176 52.4630 39.3806 175.9335 10 F 4.7384 9.6090 126.4309 58.2419 40.3172 177.1812 11 K 3.4396 7.9967 120.4821 57.9845 31.0032 175.6075 12 A 4.7044 7.9528 127.4820 52.8872 19.7022 175.9409 13 Y 4.3538 7.5721 118.0005 59.4754 38.5711 178.1920 14 G 3.7035 8.9485 113.3823 48.5998 0.0000 175.2411 15 E 3.9946 8.3298 117.7876 58.2272 29.3238 177.2056 16 A 4.4378 8.1926 120.5266 51.4424 19.9398 175.6483 17 A 4.4889 8.1590 122.1309 52.0038 21.4487 179.6825 18 G 3.9063 8.4844 108.1143 46.4003 0.0000 177.1653 19 K 4.0347 8.6459 120.1228 59.3424 31.7665 178.7674 20 R 3.9568 8.0458 118.0768 58.9387 29.7688 178.8490 21 A 4.2502 7.9584 122.1865 54.7335 18.4441 179.8749 22 V 3.6138 7.8021 116.2881 66.0707 31.6800 177.8996 23 E 3.9735 8.2671 118.4355 59.3451 29.3495 179.1403 24 L 3.8659 8.2708 120.4554 58.0612 42.0436 178.7728 25 A 4.2596 8.4841 120.9733 55.3219 18.2269 179.8214 26 K 4.0037 8.3915 116.7997 59.4406 32.1151 179.5242 27 A 4.0962 8.1986 121.0795 54.9010 18.1740 179.6095 28 A 3.9688 8.1449 119.4688 55.2675 18.4263 179.3328 29 E 3.8901 8.5852 118.2685 59.5555 29.6010 179.2342 30 R 3.9588 8.4574 118.0710 59.3864 30.2145 178.8995 31 A 4.0101 8.3604 120.2687 55.0513 18.3368 179.5615 32 A 3.9312 8.3676 119.5619 55.4557 18.2721 180.1339 33 R 3.9135 8.0803 115.6745 59.4012 30.2082 178.6776 34 E 4.1268 8.5617 118.5814 58.4108 29.7650 177.8255 35 L 4.5536 7.8513 116.5627 53.1834 42.8736 176.3763 36 G 3.8980 8.2242 106.8145 46.8493 0.0000 173.7480 37 V 4.3297 7.6471 116.9141 60.4332 34.5456 174.8095 38 N 4.6306 8.4496 124.2421 53.0149 38.8197 172.4485 39 I 4.8172 8.0371 125.6435 59.5126 38.8931 175.2125 40 V 4.5159 9.1735 127.9450 60.8580 34.5932 174.5281 41 V 4.6656 8.1064 124.4607 59.8840 34.4976 174.4142 42 A 5.5881 8.6294 125.7865 48.2445 19.6958 173.7016 43 P 4.5484 0.0000 0.0000 61.6832 33.1893 176.1941 44 N 4.4999 8.7653 117.3951 52.8644 38.1928 175.4719 45 H 4.1811 8.8655 116.5753 59.5656 28.4970 177.8760 46 L 4.1219 7.8841 118.7019 56.9258 41.5606 178.3812 47 E 4.5903 8.1896 116.4516 55.7326 29.8861 177.3891 48 L 4.0658 7.8557 122.7381 58.1944 42.2026 179.0873 49 G 3.6465 8.0453 104.9743 47.3775 0.0000 174.9743 50 L 3.9556 7.8516 121.3640 57.8797 42.3536 178.7884 51 V 3.7638 8.2480 118.4687 66.1416 31.2518 177.9904 52 S 4.1519 8.2084 114.2568 61.5471 62.7484 175.8482 53 Q 4.4051 7.8765 117.5753 56.1811 28.7282 176.3760 54 S 4.7015 8.2231 115.8915 58.3313 64.8801 174.0416 55 V 4.5991 7.4835 111.4712 59.9312 35.3137 174.7023 56 D 4.8365 9.5543 119.7279 54.0633 41.7019 177.2258 57 I 4.0720 7.4312 112.7268 59.4368 38.8459 173.7570 58 P 4.4219 0.0000 0.0000 62.6949 32.6659 175.5250 59 V 4.6350 8.4597 123.1018 61.4635 34.0515 173.6315 60 Y 5.4441 8.9499 125.8644 56.2635 40.6860 175.1660 61 A 4.6012 8.7315 124.7612 51.7256 19.5223 178.9315 62 Q 3.9817 9.0757 119.5324 57.2686 29.1278 176.1635 63 G 4.4096 7.5568 104.9156 45.5591 0.0000 171.2909 64 A 4.5790 8.0546 120.5080 51.5571 21.5990 175.8969 65 D 4.8512 8.9118 116.1847 53.1623 41.7937 175.4040 66 V 4.3218 7.4560 118.4199 62.0116 34.9340 175.0420 67 E 4.0205 9.0910 126.5075 58.8877 30.0092 176.7225 68 A 4.9581 7.6883 119.6279 49.5891 21.9442 175.8583 69 G 3.8634 8.6258 109.1309 45.0928 0.0000 174.7223 70 G 3.6098 7.9384 104.8176 45.3390 0.0000 173.5895 71 A 4.2910 7.7415 119.6062 51.4970 17.5708 177.6332 72 H 5.0110 7.4929 120.8110 52.9432 29.7417 173.5947 73 T 3.9091 7.8778 115.5409 65.3032 69.1850 174.3448 74 A 3.6887 8.7511 126.3801 53.1509 16.2019 176.3351 75 H 4.9619 7.8928 114.1357 55.1544 32.0455 174.3203 76 V 4.3371 8.9334 120.3680 61.3867 33.4127 174.6004 77 S 5.6209 8.3243 122.7059 56.4154 65.1844 175.3421 78 L 3.9702 8.5488 121.8015 58.0954 41.3919 179.6936 79 E 3.9566 7.9843 118.3442 59.5701 29.4386 179.1776 80 N 4.5421 8.2354 116.4491 56.3119 38.5524 177.4781 81 I 3.7017 7.7112 121.2918 64.1401 37.1320 178.4062 82 K 3.9170 7.9401 120.3366 59.7074 31.9425 178.8072 83 E 3.9651 8.4309 117.3001 58.8904 29.4178 178.4358 84 A 4.3384 7.9748 119.7153 52.3379 18.7025 178.4804 85 G 4.1311 8.0407 105.6214 44.8048 0.0000 174.5311 86 G 3.8136 7.8919 108.5368 45.7098 0.0000 174.0038 87 S 4.6692 9.2583 116.6536 58.7228 65.5385 173.7467 88 G 3.4938 7.7209 105.3520 46.0176 0.0000 172.1029 89 V 4.9229 7.8339 117.8523 60.5484 35.0786 173.2396 90 I 4.8528 8.8493 124.9987 60.0213 39.2449 174.7691 91 L 4.8835 8.8653 125.6992 53.2954 46.0467 176.0669 92 N 4.3219 8.9517 117.3837 54.7046 37.5318 173.9267 93 H 4.2771 8.0733 114.8759 55.4504 30.6897 175.7653 94 S 4.1254 8.4680 121.1570 62.0997 62.6530 176.0289 95 E 4.1668 8.4997 116.3580 57.9392 30.1258 176.5492 96 A 4.7322 8.1543 121.8899 49.7833 19.0887 174.6563 97 P 4.5148 0.0000 0.0000 62.7379 32.3393 176.4760 98 L 4.8049 8.4477 120.6802 52.4681 44.5965 177.1130 99 K 4.1634 8.2304 119.9654 55.8562 33.8692 177.7134 100 L 3.9021 8.5855 125.5049 58.7567 41.6050 179.2132 101 N 4.3172 8.1240 115.4517 56.4958 38.5129 177.0571 102 D 4.3137 7.9741 119.7096 57.1008 41.0466 178.0600 103 L 3.8690 8.2507 121.1168 58.4111 41.9600 179.0427 104 A 3.9792 8.0851 120.3538 55.1289 18.2441 179.9263 105 R 3.8467 7.7141 116.2177 59.2782 30.1900 179.1446 106 L 3.9365 8.4107 119.1252 57.7187 41.5984 179.6460 107 V 3.4607 7.7727 117.7603 65.9617 31.4326 177.6872 108 A 3.9276 7.6674 119.9338 55.1834 18.2342 179.4534 109 K 3.7971 8.4501 118.1343 59.4752 32.2600 178.6919 110 A 3.9285 8.4915 121.2474 55.1894 18.2627 179.6654 111 K 3.8966 8.0848 116.8913 59.8293 31.9443 179.3952 112 S 4.0610 7.9938 112.0127 61.3614 62.3182 175.5932 113 L 4.2866 7.7105 119.2991 55.2603 41.6266 177.8147 114 G 3.9407 8.1344 107.6342 44.9624 0.0000 173.1781 115 L 4.5768 7.5074 119.2410 53.5567 42.7650 176.7495 116 D 4.4153 8.8703 123.7139 54.2922 42.2719 175.8192 117 V 4.6873 8.3682 120.4359 60.0212 34.9898 174.0168 118 V 4.6786 8.8211 125.3132 60.9403 34.2535 174.0174 119 V 4.7427 8.5374 128.1688 61.4956 33.1719 175.0225 120 C 5.0546 9.1478 126.0841 59.7538 29.5574 172.8952 121 A 4.5696 8.5250 120.3005 50.5443 21.8044 176.2321 122 P 4.4873 0.0000 0.0000 64.8230 31.9147 175.8569 123 D 4.6005 7.6672 116.1999 50.3959 43.3128 173.9317 124 P 4.4668 0.0000 0.0000 65.2710 31.1993 178.7371 125 R 3.8871 7.9525 116.4602 59.8871 29.9872 178.5803 126 T 3.9372 8.5966 115.8280 66.5811 68.4219 176.9149 127 S 4.1346 8.5163 117.6591 61.5747 62.8798 176.5122 128 L 4.0838 8.2895 122.9339 57.9768 41.5758 178.9048 129 A 3.9639 7.7388 119.6317 55.1658 18.6020 179.1208 130 A 4.0034 8.2951 119.4633 55.2950 18.4453 179.6235 131 A 3.8357 8.6684 119.3173 55.2458 18.1871 179.6483 132 A 2.5800 7.1836 117.6380 54.2364 18.3959 179.2526 133 L 4.0549 7.6398 116.7746 55.7043 41.7385 177.8567 134 G 3.7339 7.6512 107.0991 44.9976 0.0000 171.9097 135 P 4.4782 0.0000 0.0000 61.9051 32.5709 175.8445 136 H 4.4517 8.4819 115.2751 58.7133 29.6330 175.6298 137 A 5.1823 7.7935 117.4728 50.6897 23.0435 175.1527 138 V 4.8203 8.8844 118.6376 60.9894 35.1582 174.3271 139 A 5.2383 9.0595 129.9794 50.1399 21.0602 175.5800 140 V 4.4223 8.4190 123.2279 61.7515 33.2492 175.2795 141 E 4.9575 9.3215 126.4492 52.5130 32.5469 172.5741 142 P 4.6711 0.0000 0.0000 61.3934 31.7003 175.9770 143 P 4.3074 0.0000 0.0000 65.5658 31.4602 178.6084 144 E 4.0444 8.1722 116.2043 58.4379 29.7057 177.4391 145 L 4.3893 7.8893 117.7857 54.7809 42.6203 176.5913 146 I 3.8174 7.2661 120.5688 62.8969 37.2042 176.3292 147 G 3.9842 8.9307 112.6619 46.2221 0.0000 173.9541 148 T 4.0742 8.0672 109.3970 61.2675 69.4315 176.1164 149 G 3.8622 8.2183 109.3941 45.9779 0.0000 174.2987 150 R 4.2831 7.4816 119.6937 53.0968 29.5776 175.3419 151 A 4.1844 8.4875 123.2380 52.4941 20.0920 178.1869 152 V 3.7891 8.5598 124.2339 65.0065 31.2336 179.0528 153 S 4.1776 8.1263 112.9306 60.2084 63.0565 175.4440 154 R 4.2127 7.7673 120.1666 57.6878 31.2196 177.0577 155 Y 4.3732 8.3908 114.5300 58.2826 39.4700 176.0338 156 K 5.2354 8.6121 121.9022 52.5727 32.8456 175.4271 157 P 4.2775 0.0000 0.0000 66.3586 31.2646 177.1973 158 E 3.9432 8.2652 117.3441 59.3821 29.5437 178.9668 159 A 4.0623 8.0538 120.5723 55.2412 18.3131 179.6765 160 I 3.6666 7.5803 117.9808 64.3621 37.3294 178.1797 161 V 3.5723 7.8961 118.8877 66.3561 31.2888 177.8235 162 E 3.9402 8.5386 119.0030 59.5395 29.3852 178.9483 163 T 3.8563 7.8075 115.3176 66.6295 68.5538 176.7241 164 V 3.7020 8.2735 120.7168 65.9673 31.6244 178.1344 165 G 3.6342 8.4305 105.6039 48.0068 0.0000 175.6121 166 L 4.0666 8.3219 122.6845 57.2000 41.6464 179.9724 167 V 3.7209 8.2315 118.7993 66.0574 31.3315 178.2933 168 S 4.3165 8.0375 112.8643 61.3406 62.7675 176.2222 169 R 3.9080 7.7035 121.2662 59.1175 29.9132 177.4176 170 H 4.1744 7.8126 114.0703 56.3954 30.9466 175.9992 171 F 5.4394 8.4772 118.4914 53.9203 39.3864 173.5598 172 P 4.3920 0.0000 0.0000 65.0204 31.9480 178.4753 173 E 4.0664 8.2775 118.2845 58.0918 29.7311 175.8591 174 V 4.4746 7.7146 119.8840 61.6033 32.3202 176.0264 175 S 4.5957 8.9132 124.3858 58.2210 64.7793 173.2026 176 V 4.9297 8.3333 121.5662 61.2137 34.1467 174.4036 177 I 5.0109 8.7622 120.2734 59.5324 41.7462 173.4675 178 T 5.0300 8.1719 115.8904 61.0884 71.5980 171.7888 179 G 4.5124 8.9161 109.2457 46.3819 0.0000 172.9819 180 A 4.0605 8.7252 121.5060 53.7672 17.4427 179.2160 181 G 3.9209 8.8518 110.2051 45.7925 0.0000 173.1467 182 I 3.8253 7.7234 121.0995 61.5775 37.1169 175.3949 183 E 4.6779 9.5035 122.9076 55.5556 31.2549 175.7139 184 S 4.8960 7.9073 113.2408 55.3219 66.5360 174.8219 185 G 3.7152 9.4328 108.5708 48.2758 0.0000 175.7958 186 D 4.3962 7.7093 120.6334 57.3553 40.8934 178.5341 187 D 4.4703 8.0637 119.4527 57.2260 40.7457 179.1673 188 V 3.5498 7.6242 118.0473 65.8277 31.7104 177.5802 189 A 3.9590 8.3317 120.7398 55.3221 18.2259 179.3178 190 A 3.9374 8.5282 119.1974 55.2278 18.2529 179.6189 191 A 3.9153 7.8438 118.5707 55.3985 18.4950 179.8050 192 L 4.1291 8.0123 117.3626 58.2242 41.5326 180.1346 193 R 3.9964 8.2530 116.8146 58.7796 30.0029 178.1605 194 L 4.3799 7.4997 116.6625 54.7962 41.7993 177.4527 195 G 4.0879 7.9701 107.3084 45.4300 0.0000 174.5543 196 T 4.3706 7.3771 116.1945 63.5865 69.4061 174.5466 197 R 4.5600 10.0271 122.2637 54.1196 30.5775 176.6403 198 G 4.4507 6.9570 107.1075 45.7204 0.0000 171.4707 199 V 4.7079 8.1626 118.2528 61.1488 35.3359 173.6201 200 L 5.3681 8.9262 127.0319 53.2039 45.0155 175.2303 201 L 4.3777 9.1171 125.0437 55.0669 44.1457 174.3514 202 A 4.8358 8.5990 118.2408 50.5878 21.7166 178.5210 203 S 3.8034 8.0513 108.7776 61.1964 63.1991 176.6766 204 A 3.9170 8.0059 122.0204 55.3748 18.2966 179.1515 205 A 4.0605 7.7937 118.1665 55.2673 18.7490 179.7707 206 V 3.3971 7.7983 115.5890 65.3515 31.5398 177.3593 207 K 4.2527 7.9908 115.1685 54.9617 32.6137 176.4774 208 A 4.1637 7.0291 122.7457 51.8435 18.9225 178.7543 209 K 4.1036 8.6060 120.9060 58.6796 32.5767 176.9974 210 D 4.7880 7.5827 118.3003 50.3554 41.4235 173.4864 211 P 4.1965 0.0000 0.0000 65.4439 31.5241 176.6549 212 Y 4.0461 8.1408 117.0093 60.8633 38.6905 177.9239 213 A 3.7527 8.2420 121.1643 54.9931 18.4156 179.5215 214 K 3.8264 8.3549 118.4217 59.7721 32.3287 179.1445 215 I 3.6346 8.2971 120.4474 64.2171 36.9695 178.5819 216 V 3.4127 7.7239 119.4769 65.8023 31.0623 177.6500 217 E 3.8831 7.8336 117.9582 59.3452 29.5462 178.5674 218 L 4.0985 7.9269 117.8280 57.6511 41.9546 178.9300 219 A 4.1681 8.5697 120.4928 53.8866 18.4945 179.1726 220 K 3.7116 8.0037 118.8941 59.5888 32.2456 176.9257 221 P 4.3513 0.0000 0.0000 65.1531 30.9606 178.4297 222 L 4.1182 7.9236 117.9885 57.2724 41.5594 178.8729 223 S 4.3735 7.8543 113.5015 60.1452 64.1092 174.4089 224 E 4.3364 7.6706 122.0167 54.3126 29.2520 176.1329 225 L 5.1950 7.6301 132.9962 56.3307 44.3375 173.6694 *226 R 4.1530 7.4649 122.0134 56.5665 30.0397 177.3079 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 1 M 8.30 4.55 0.00 2.46 2.24 0.00 0.00 0.00 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.58 0.00 2 R 8.37 4.03 0.00 1.92 1.91 0.00 3.21 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.73 0.00 3 L 9.40 4.13 0.00 1.65 1.74 0.95 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 4 P 0.00 4.60 0.00 1.94 2.01 0.00 3.62 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 5 I 8.61 4.84 2.12 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 1.08 1.72 1.03 0.00 0.00 6 L 8.74 5.13 0.00 1.77 1.45 0.92 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 7 I 8.85 4.73 1.89 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.58 0.88 0.00 0.00 8 I 8.90 4.66 2.14 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 1.33 1.16 1.15 0.00 0.00 9 N 9.35 4.95 0.00 2.86 2.80 0.00 0.00 6.84 7.73 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 10 F 9.61 4.74 0.00 3.17 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 11 K 8.00 3.44 0.00 1.49 1.28 0.00 1.60 0.00 0.00 1.67 0.00 0.00 2.94 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.31 1.58 7.81 12 A 7.95 4.70 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 13 Y 7.57 4.35 0.00 3.14 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 14 G 8.95 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 15 E 8.33 3.99 0.00 1.85 1.94 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 2.22 2.33 0.00 16 A 8.19 4.44 1.01 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 17 A 8.16 4.49 1.34 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 0.00 0.00 18 G 8.48 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 K 8.65 4.03 0.00 1.86 1.89 0.00 1.59 0.00 0.00 1.83 0.00 0.00 3.15 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.54 1.61 7.81 20 R 8.05 3.96 0.00 2.25 2.08 0.00 3.10 0.00 0.00 3.19 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 21 A 7.96 4.25 1.57 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 0.00 0.00 22 V 7.80 3.61 2.25 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 1.09 0.00 0.00 0.97 0.00 0.00 23 E 8.27 3.97 0.00 2.22 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 2.33 2.44 0.00 24 L 8.27 3.87 0.00 1.54 1.43 0.77 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 25 A 8.48 4.26 1.53 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 0.00 0.00 26 K 8.39 4.00 0.00 2.05 1.89 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.60 7.81 27 A 8.20 4.10 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 28 A 8.14 3.97 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 E 8.59 3.89 0.00 2.15 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 0.00 2.34 2.38 0.00 30 R 8.46 3.96 0.00 2.28 2.08 0.00 3.05 0.00 0.00 3.04 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.84 0.00 31 A 8.36 4.01 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.37 3.93 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 R 8.08 3.91 0.00 1.99 2.03 0.00 3.19 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.79 0.00 34 E 8.56 4.13 0.00 2.06 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 2.45 2.43 0.00 35 L 7.85 4.55 0.00 1.66 1.67 0.93 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 36 G 8.22 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 37 V 7.65 4.33 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.92 0.00 0.00 38 N 8.45 4.63 0.00 2.89 2.91 0.00 0.00 6.97 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 39 I 8.04 4.82 1.86 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 1.21 0.71 0.91 0.00 0.00 40 V 9.17 4.52 1.68 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 -0.28 0.00 0.00 0.61 0.00 0.00 41 V 8.11 4.67 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 0.58 0.00 0.00 1.09 0.00 0.00 42 A 8.63 5.59 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 43 P 0.00 4.55 0.00 2.09 1.82 0.00 3.77 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.84 0.00 44 N 8.77 4.50 0.00 2.95 3.23 0.00 0.00 5.90 7.90 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 45 H 8.87 4.18 0.00 3.21 3.39 0.00 5.65 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 46 L 7.88 4.12 0.00 1.83 1.76 0.94 0.76 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 E 8.19 4.59 0.00 2.04 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 2.51 2.51 0.00 48 L 7.86 4.07 0.00 1.76 1.68 0.94 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 49 G 8.05 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 0.00 0.00 0.00 50 L 7.85 3.96 0.00 1.65 1.89 0.94 1.00 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 51 V 8.25 3.76 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 1.07 0.00 0.00 1.03 0.00 0.00 52 S 8.21 4.15 0.00 4.15 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 53 Q 7.88 4.41 0.00 2.05 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.74 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 54 S 8.22 4.70 0.00 3.92 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 55 V 7.48 4.60 2.21 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 0.82 0.00 0.00 0.99 0.00 0.00 56 D 9.55 4.84 0.00 2.69 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 57 I 7.43 4.07 2.02 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 1.42 0.50 0.91 0.00 0.00 58 P 0.00 4.42 0.00 1.88 2.06 0.00 3.60 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.08 0.00 59 V 8.46 4.64 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 0.98 0.00 0.00 0.95 0.00 0.00 60 Y 8.95 5.44 0.00 2.82 2.71 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 61 A 8.73 4.60 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 62 Q 9.08 3.98 0.00 1.93 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.95 0.00 0.00 0.00 0.00 0.00 2.43 2.43 0.00 63 G 7.56 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 A 8.05 4.58 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 65 D 8.91 4.85 0.00 2.61 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 66 V 7.46 4.32 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.68 0.00 0.00 67 E 9.09 4.02 0.00 1.93 1.94 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 2.36 2.27 0.00 68 A 7.69 4.96 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 69 G 8.63 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 G 7.94 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 A 7.74 4.29 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 72 H 7.49 5.01 0.00 3.18 3.21 0.00 5.65 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 T 7.88 3.91 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 74 A 8.75 3.69 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 75 H 7.89 4.96 0.00 3.27 3.33 0.00 5.61 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 V 8.93 4.34 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 1.00 0.00 0.00 0.65 0.00 0.00 77 S 8.32 5.62 0.00 4.03 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 78 L 8.55 3.97 0.00 1.84 1.73 0.94 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 79 E 7.98 3.96 0.00 1.96 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 2.56 0.00 80 N 8.24 4.54 0.00 2.94 2.86 0.00 0.00 7.06 7.11 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 81 I 7.71 3.70 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 1.39 0.92 0.90 0.00 0.00 82 K 7.94 3.92 0.00 1.83 1.93 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.94 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.43 1.47 7.81 83 E 8.43 3.97 0.00 2.06 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 0.00 2.35 2.49 0.00 84 A 7.97 4.34 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 85 G 8.04 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 G 7.89 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 0.00 0.00 0.00 87 S 9.26 4.67 0.00 3.93 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 88 G 7.72 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 0.00 0.00 0.00 89 V 7.83 4.92 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 0.72 0.00 0.00 0.96 0.00 0.00 90 I 8.85 4.85 2.06 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.83 0.97 0.00 0.00 91 L 8.87 4.88 0.00 1.48 1.49 0.88 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 92 N 8.95 4.32 0.00 2.82 3.02 0.00 0.00 6.97 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 93 H 8.07 4.28 0.00 3.28 3.16 0.00 5.96 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 S 8.47 4.13 0.00 3.73 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 95 E 8.50 4.17 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 2.33 2.41 0.00 96 A 8.15 4.73 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 P 0.00 4.51 0.00 2.19 2.08 0.00 3.68 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.00 0.00 98 L 8.45 4.80 0.00 1.62 1.58 0.91 0.75 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 99 K 8.23 4.16 0.00 1.94 1.71 0.00 1.90 0.00 0.00 1.73 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.52 1.48 7.81 100 L 8.59 3.90 0.00 1.73 1.67 0.89 0.66 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 0.00 101 N 8.12 4.32 0.00 2.83 2.84 0.00 0.00 7.05 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 0.00 102 D 7.97 4.31 0.00 2.79 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 0.00 103 L 8.25 3.87 0.00 1.93 1.84 0.90 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 104 A 8.09 3.98 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 0.00 105 R 7.71 3.85 0.00 1.99 2.15 0.00 3.11 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.74 0.00 106 L 8.41 3.94 0.00 1.60 1.68 0.89 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 0.00 107 V 7.77 3.46 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 0.99 0.00 0.00 0.90 0.00 0.00 108 A 7.67 3.93 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 0.00 109 K 8.45 3.80 0.00 1.86 1.97 0.00 1.51 0.00 0.00 1.79 0.00 0.00 3.22 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.48 7.81 110 A 8.49 3.93 1.34 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 0.00 0.00 111 K 8.08 3.90 0.00 1.91 1.85 0.00 1.65 0.00 0.00 1.48 0.00 0.00 2.83 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.31 1.37 7.81 112 S 7.99 4.06 0.00 3.84 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 0.00 113 L 7.71 4.29 0.00 1.81 1.68 0.90 1.01 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 0.00 114 G 8.13 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 0.00 115 L 7.51 4.58 0.00 1.63 1.49 0.92 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 116 D 8.87 4.42 0.00 2.05 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 0.00 117 V 8.37 4.69 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 0.81 0.00 0.00 0.88 0.00 0.00 118 V 8.82 4.68 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 0.98 0.00 0.00 1.03 0.00 0.00 119 V 8.54 4.74 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 0.98 0.00 0.00 0.90 0.00 0.00 120 C 9.15 5.05 0.00 2.94 2.82 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 0.00 121 A 8.53 4.57 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 0.00 122 P 0.00 4.49 0.00 2.19 2.10 0.00 3.89 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 2.10 2.02 0.00 123 D 7.67 4.60 0.00 2.90 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 P 0.00 4.47 0.00 2.27 2.18 0.00 3.89 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.23 0.00 125 R 7.95 3.89 0.00 1.88 1.93 0.00 3.18 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.73 0.00 126 T 8.60 3.94 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 127 S 8.52 4.13 0.00 4.05 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 L 8.29 4.08 0.00 1.88 1.91 1.02 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 129 A 7.74 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 0.00 130 A 8.30 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 0.00 131 A 8.67 3.84 1.49 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 0.00 132 A 7.18 2.58 1.10 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 0.00 0.00 133 L 7.64 4.05 0.00 1.66 1.65 0.87 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 134 G 7.65 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 0.00 0.00 0.00 135 P 0.00 4.48 0.00 2.42 2.03 0.00 3.66 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.93 0.00 136 H 8.48 4.45 0.00 3.19 3.40 0.00 5.62 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 0.00 137 A 7.79 5.18 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 0.00 138 V 8.88 4.82 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.95 0.00 0.00 139 A 9.06 5.24 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 0.00 140 V 8.42 4.42 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 0.82 0.00 0.00 0.95 0.00 0.00 141 E 9.32 4.96 0.00 1.97 1.79 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 2.18 2.21 0.00 142 P 0.00 4.67 0.00 2.24 2.07 0.00 4.07 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 2.14 2.08 0.00 143 P 0.00 4.31 0.00 2.17 2.10 0.00 3.60 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.10 0.00 144 E 8.17 4.04 0.00 1.93 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 0.00 2.32 2.39 0.00 145 L 7.89 4.39 0.00 1.73 1.82 1.05 0.63 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 0.00 146 I 7.27 3.82 1.99 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 1.26 0.64 0.98 0.00 0.00 147 G 8.93 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 0.00 148 T 8.07 4.07 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 149 G 8.22 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 R 7.48 4.28 0.00 1.47 0.79 0.00 2.93 0.00 0.00 2.98 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 1.25 0.00 151 A 8.49 4.18 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 0.00 152 V 8.56 3.79 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 0.87 0.00 0.00 0.97 0.00 0.00 153 S 8.13 4.18 0.00 4.05 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 0.00 154 R 7.77 4.21 0.00 1.61 1.42 0.00 3.23 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.65 0.00 155 Y 8.39 4.37 0.00 3.01 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.61 5.24 0.00 1.79 1.70 0.00 1.74 0.00 0.00 1.83 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.36 1.37 7.81 157 P 0.00 4.28 0.00 2.29 2.46 0.00 3.73 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.05 0.00 158 E 8.27 3.94 0.00 2.08 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 2.41 2.45 0.00 159 A 8.05 4.06 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 0.00 160 I 7.58 3.67 2.08 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 1.54 0.57 0.92 0.00 0.00 161 V 7.90 3.57 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 1.06 0.00 0.00 0.96 0.00 0.00 162 E 8.54 3.94 0.00 2.27 1.94 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 2.32 2.36 0.00 163 T 7.81 3.86 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 1.24 0.00 0.00 164 V 8.27 3.70 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 1.02 0.00 0.00 1.01 0.00 0.00 165 G 8.43 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 0.00 166 L 8.32 4.07 0.00 1.70 1.77 0.94 0.76 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 0.00 167 V 8.23 3.72 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 1.16 0.00 0.00 1.03 0.00 0.00 168 S 8.04 4.32 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 0.00 169 R 7.70 3.91 0.00 2.05 1.80 0.00 3.20 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.59 0.00 170 H 7.81 4.17 0.00 2.50 1.54 0.00 5.65 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 F 8.48 5.44 0.00 3.08 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 0.00 172 P 0.00 4.39 0.00 2.19 2.35 0.00 3.79 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 2.02 1.99 0.00 173 E 8.28 4.07 0.00 2.13 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 2.44 2.40 0.00 174 V 7.71 4.47 2.31 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 0.82 0.00 0.00 1.06 0.00 0.00 175 S 8.91 4.60 0.00 3.87 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 0.00 176 V 8.33 4.93 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.97 0.00 0.00 177 I 8.76 5.01 1.95 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.66 0.95 0.00 0.00 178 T 8.17 5.03 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 179 G 8.92 4.51 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 0.00 180 A 8.73 4.06 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 G 8.85 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 0.00 182 I 7.72 3.83 1.90 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 1.50 0.87 0.93 0.00 0.00 183 E 9.50 4.68 0.00 2.00 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 0.00 2.38 2.22 0.00 184 S 7.91 4.90 0.00 4.05 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 0.00 185 G 9.43 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 0.00 0.00 0.00 186 D 7.71 4.40 0.00 2.66 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 0.00 187 D 8.06 4.47 0.00 2.88 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 V 7.62 3.55 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.96 0.00 0.00 189 A 8.33 3.96 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 0.00 190 A 8.53 3.94 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 0.00 191 A 7.84 3.92 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 0.00 192 L 8.01 4.13 0.00 1.87 1.74 0.92 0.83 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 0.00 193 R 8.25 4.00 0.00 1.89 2.00 0.00 3.15 0.00 0.00 3.22 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.77 0.00 194 L 7.50 4.38 0.00 1.81 1.70 0.92 1.05 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 0.00 195 G 7.97 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 T 7.38 4.37 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 197 R 10.03 4.56 0.00 1.79 1.90 0.00 3.45 0.00 0.00 3.19 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.70 0.00 198 G 6.96 4.45 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 0.00 199 V 8.16 4.71 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 1.00 0.00 0.00 0.95 0.00 0.00 200 L 8.93 5.37 0.00 1.80 1.50 1.01 0.63 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 0.00 201 L 9.12 4.38 0.00 1.77 1.73 0.95 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 202 A 8.60 4.84 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 0.00 203 S 8.05 3.80 0.00 3.87 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 0.00 204 A 8.01 3.92 1.34 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 0.00 0.00 205 A 7.79 4.06 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 0.00 206 V 7.80 3.40 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 0.60 0.00 0.00 0.90 0.00 0.00 207 K 7.99 4.25 0.00 1.66 1.66 0.00 1.46 0.00 0.00 1.53 0.00 0.00 3.05 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.25 0.97 7.81 208 A 7.03 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 0.00 209 K 8.61 4.10 0.00 1.74 1.87 0.00 1.68 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.42 1.40 7.81 210 D 7.58 4.79 0.00 2.63 2.51 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 0.00 211 P 0.00 4.20 0.00 2.21 2.08 0.00 3.68 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.25 0.00 212 Y 8.14 4.05 0.00 3.09 3.16 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 0.00 213 A 8.24 3.75 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 214 K 8.35 3.83 0.00 1.90 1.91 0.00 1.60 0.00 0.00 1.62 0.00 0.00 3.01 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.60 1.49 7.81 215 I 8.30 3.63 1.92 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.49 0.87 0.00 0.00 216 V 7.72 3.41 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 0.87 0.00 0.00 0.17 0.00 0.00 217 E 7.83 3.88 0.00 1.95 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.33 0.00 218 L 7.93 4.10 0.00 1.76 1.70 0.90 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 219 A 8.57 4.17 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 0.00 220 K 8.00 3.71 0.00 2.05 1.82 0.00 1.62 0.00 0.00 1.62 0.00 0.00 3.10 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.49 7.81 221 P 0.00 4.35 0.00 2.19 2.08 0.00 3.72 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.17 0.00 222 L 7.92 4.12 0.00 1.73 1.72 0.96 1.18 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 0.00 223 S 7.85 4.37 0.00 4.04 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 E 7.67 4.34 0.00 2.11 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.23 0.00 225 L 7.63 5.20 0.00 1.71 1.72 0.92 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 *226 R 7.46 4.15 0.00 1.62 1.73 0.00 3.28 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.69 0.00 * Residues marked with a * may have inaccurate shift predictions.