NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 V 4.5187 8.0544 120.6688 62.8476 32.8026 174.2393 3 K 4.6082 9.1206 128.1993 54.5844 35.8784 172.9876 4 L 5.2815 8.8246 125.3325 52.9518 45.9584 174.9467 5 V 4.6744 8.9089 123.9056 61.0766 34.1337 174.1310 6 E 5.3273 8.8499 126.3441 55.4974 32.2847 174.9448 7 S 4.5878 9.5315 115.5544 57.5312 66.7969 174.5221 8 G 3.9699 9.2772 107.4081 45.3998 0.0000 174.6337 9 G 4.0850 7.1610 107.3795 44.5537 0.0000 173.9449 10 G 3.8290 7.6226 105.1470 45.7682 0.0000 170.1437 11 L 5.0490 8.2053 121.6659 53.9431 43.2326 177.1992 12 V 4.5904 8.7980 125.3285 60.9748 35.5028 174.6343 13 K 4.6965 8.5130 124.7098 55.0057 33.6812 174.7949 14 P 4.2815 0.0000 0.0000 64.5978 31.6180 177.1593 15 G 3.8814 9.6424 111.8881 45.2418 0.0000 173.6082 16 G 4.1381 8.0101 108.0738 45.3144 0.0000 172.7050 17 S 5.2630 8.2344 112.9785 56.7220 66.2678 173.2859 18 L 4.4352 8.6079 121.4455 53.8611 45.8850 173.5632 19 K 4.7801 8.4688 126.1752 54.6443 34.3846 175.1385 20 L 4.8036 8.5954 127.5862 53.6761 44.0896 175.7489 21 S 5.2864 9.1086 116.6887 57.0506 67.4567 172.6187 22 C 5.2748 9.1259 122.1277 54.9725 46.6771 172.3773 23 A 4.8729 9.0660 129.4926 50.6350 20.0596 175.5627 24 A 5.2892 8.2491 125.1131 50.4791 21.6004 176.1532 25 S 4.3178 8.8756 113.8681 58.0497 66.7112 175.2622 26 G 4.0682 10.7412 110.1122 45.3406 0.0000 172.8206 27 F 4.8707 7.0540 111.6744 55.6589 40.3433 174.8288 28 T 4.0935 8.6566 119.0288 63.3413 67.1987 174.8518 29 F 3.9649 8.7397 129.2082 61.1920 39.3480 177.8834 30 S 4.1379 8.2717 112.5949 60.7924 62.7003 174.1523 31 N 4.6797 8.3183 118.2116 53.6610 38.7032 173.7526 32 Y 4.9409 7.7205 112.9931 56.3676 41.8889 174.9724 33 A 4.6116 8.6289 123.9719 52.1553 20.3690 176.4311 34 M 5.2476 8.8884 118.2918 53.9224 36.8667 174.4852 35 S 5.1869 8.9634 114.0054 56.9938 66.9675 172.5218 36 W 5.2613 8.8511 123.5166 54.8774 32.1601 174.8723 37 V 5.0678 9.3671 124.1909 61.0581 34.5215 174.3240 38 R 5.0429 9.2111 123.6638 54.3623 32.7991 174.4695 39 Q 5.1133 8.8988 122.0916 54.4884 31.8919 175.3881 40 T 4.5026 8.6997 117.1079 60.4051 69.8498 173.6711 41 P 4.2571 0.0000 0.0000 65.9319 31.2872 177.7321 42 E 4.1082 8.0462 114.5544 57.0401 29.4686 177.5423 43 K 4.1082 8.6867 118.1510 56.3252 30.5151 176.2906 44 R 4.1781 7.7376 120.0864 56.0728 30.6542 174.8864 45 L 5.2747 8.3513 124.2303 53.4476 43.6686 175.6099 46 E 4.7933 9.2732 123.9179 54.2002 33.1087 174.0826 47 W 4.6481 9.3198 135.0000 57.8720 31.2877 175.1601 48 V 4.0935 7.9436 126.6498 64.0795 33.2622 175.6694 49 V 4.0187 6.0102 115.9557 60.7646 34.2042 171.9716 50 S 5.3298 9.2769 118.0879 56.9747 67.4407 172.8170 51 I 5.1009 8.6185 123.5603 59.1304 40.8422 175.2221 52 S 4.8412 9.5295 125.0240 57.6668 64.2241 175.4971 52A S 4.1903 8.8762 115.2338 61.5164 62.6025 176.0285 53 G 4.2557 7.2349 107.3623 45.6570 0.0000 174.1589 54 G 3.9773 8.0203 108.2731 45.5391 0.0000 173.2216 *56 S 4.4681 7.7683 115.0104 58.3460 64.6279 172.6392 57 I 4.8509 7.9479 123.6425 59.6189 39.8643 174.4814 58 Y 4.7872 9.2049 123.9579 56.4668 41.2291 174.3304 59 Y 5.1765 8.8817 120.6407 55.7664 41.8591 175.0537 60 L 4.5419 8.3602 123.5743 55.0090 42.9770 177.4848 61 D 4.4483 9.2691 125.8519 57.7645 40.9020 178.6853 62 S 4.3368 8.0700 110.1301 59.6144 63.2192 174.5916 63 V 3.7804 7.5372 113.5379 60.5243 33.1612 175.7319 64 K 3.6138 7.2933 120.3981 57.9477 32.0821 177.2963 65 G 3.9335 8.7307 112.3512 44.9903 0.0000 173.7081 66 R 4.4872 8.1991 117.9989 56.9561 32.8805 176.0281 67 F 5.3414 7.9376 115.8452 56.1868 41.1721 175.7362 68 T 4.9166 8.8527 119.3597 61.8383 71.6052 173.5846 69 V 5.0048 9.1285 127.0346 60.9919 33.6355 175.3724 70 S 4.9608 8.6700 114.8804 57.7458 66.5366 173.5424 71 R 5.1806 8.6853 116.5150 54.7850 32.8653 174.5184 72 D 4.9018 9.2188 121.9105 52.4562 41.5277 176.1722 73 N 4.6789 8.9664 122.8467 55.7468 39.0357 176.8164 74 A 4.1409 7.9545 120.5624 54.2133 18.5467 178.2425 75 R 4.3585 7.7905 111.6809 55.2315 31.0436 175.5506 76 N 3.1400 7.7718 114.4828 54.2463 36.0928 173.4808 77 I 4.5448 6.6697 116.4719 59.1491 41.4706 174.8202 78 L 5.2138 8.6147 128.2760 53.5921 44.6861 174.7257 79 Y 5.6041 9.5025 122.7992 56.3986 42.3833 174.8908 80 L 4.5795 8.6475 122.7608 53.6569 44.9946 174.7870 81 Q 4.4016 9.1988 129.8953 55.5421 30.1019 174.1792 82 M 4.5175 9.0331 127.6675 53.8504 34.2215 175.4613 82A T 4.9439 8.1914 111.3241 59.8151 72.6793 173.1452 82B S 3.7133 8.6462 114.9904 59.4202 60.6944 173.1806 82C L 4.4667 7.7621 119.1074 55.0138 42.5020 177.1153 83 R 4.9472 9.3159 117.5222 53.9576 33.0584 176.0988 84 S 4.1426 8.9304 113.3501 61.7064 62.5599 176.4934 85 E 4.1401 8.1480 116.5348 58.0316 29.3404 176.9774 86 D 4.7574 8.4542 118.8764 55.4158 41.4323 176.6609 87 T 4.3406 8.0257 117.3440 63.8322 69.0091 173.7058 88 A 4.3275 8.4965 127.4001 52.1426 23.9537 174.0560 89 M 4.6150 8.3132 119.5062 54.9146 33.7919 174.4118 90 Y 4.8468 9.0295 124.6630 56.6348 40.1528 174.5713 91 F 5.5049 9.9441 123.8651 55.9469 42.3146 173.7630 92 C 4.4685 9.3242 122.9314 55.2423 44.1110 172.2135 93 A 4.8790 8.5749 126.5479 50.2377 22.7864 174.7637 94 R 4.5434 8.6801 121.3166 55.0839 32.1348 175.1889 95 V 4.6722 8.1609 125.6352 60.8431 32.7907 176.9134 96 S 4.6900 8.6316 125.1199 57.6034 59.8815 171.6636 97 H 4.8027 7.8278 121.4115 54.6941 33.8324 171.8851 98 Y 4.9223 7.1248 121.6079 54.3785 41.1943 174.2389 99 D 4.4167 8.4538 120.6182 56.4700 41.3248 177.9832 100 G 4.0095 8.8902 112.1772 45.4231 0.0000 173.8928 100A S 3.9700 7.0858 113.4883 58.3767 62.5902 174.0677 100B R 4.4020 8.3455 123.6719 56.6679 30.3645 175.8727 100C D 4.9718 7.5522 118.4618 52.1397 43.7434 175.8115 100I W 4.8386 8.1382 117.0502 56.7063 30.7288 173.0297 100J Y 4.4750 7.5906 120.1136 56.0039 40.6345 173.5505 100K F 5.7321 8.9983 120.0087 57.0539 38.4550 174.8405 101 D 5.0587 8.9452 123.6772 53.6322 41.1963 176.8308 102 V 4.6159 7.6243 119.2228 60.9799 34.8064 173.9547 103 W 5.1565 9.1039 126.6665 54.9220 32.5671 175.6863 104 G 4.3510 9.0375 109.9684 44.0520 0.0000 173.3099 105 A 4.4619 9.0085 121.2747 52.7741 19.1304 178.9919 106 G 3.8115 9.2638 100.4916 45.7975 0.0000 172.5711 107 T 4.6530 8.3986 114.2780 59.9340 71.1402 172.7898 108 S 4.7664 8.6349 122.9586 57.8524 64.3745 172.6519 109 V 4.8257 8.8654 126.0305 61.4953 34.4892 174.0244 110 T 4.8886 8.7586 124.8808 61.8618 71.1488 173.4084 111 V 4.6451 8.2689 127.9109 62.0729 32.1363 174.8240 112 S 4.5200 8.7907 120.8969 57.8786 66.0220 175.4438 113 S 4.4217 8.4633 121.4516 57.6284 62.1250 173.4752 114 A 4.1065 7.5333 124.3230 51.2150 21.2938 175.5461 115 K 4.5425 8.1444 120.2815 54.2044 34.5873 176.0942 116 T 4.3588 8.6445 116.1451 63.6463 67.8106 173.1551 117 T 4.8618 10.2478 125.7650 61.2320 72.3805 172.1452 118 P 5.0209 0.0000 0.0000 61.8117 32.4237 174.0380 119 P 4.9466 0.0000 0.0000 62.0742 33.2814 175.2323 120 S 4.4006 8.8786 118.2239 57.8163 64.3836 173.2399 121 V 4.5226 7.9207 123.8007 61.1578 33.5267 174.1036 122 Y 5.1909 8.7142 125.5671 55.4510 41.2155 173.2663 123 P 4.7869 0.0000 0.0000 62.6878 32.9562 175.7372 124 L 4.7642 9.1340 122.7613 53.2617 43.7239 175.1192 125 A 5.0386 8.4603 125.6449 48.9273 21.6387 174.2251 126 P 4.5074 0.0000 0.0000 61.9809 32.1889 177.1746 127 G 3.6124 8.5130 108.1933 47.9741 0.0000 173.3164 124 N 5.1642 9.3740 119.6612 51.2617 40.2239 172.7192 125 S 5.1886 8.5303 117.5449 54.7273 66.3387 171.0251 126 M 4.5674 8.0831 117.9264 54.0809 32.9889 176.1746 127 V 3.7724 8.2130 118.5933 65.0741 33.2226 174.7164 137 T 4.6384 8.4615 120.2947 61.9330 70.2327 173.7218 138 L 4.6264 8.7508 125.4040 53.1406 46.0510 175.1556 139 G 4.6424 8.0059 106.0968 46.0683 0.0000 172.8952 140 C 5.3796 9.6537 116.4646 55.2154 43.8133 173.2627 141 L 4.9862 9.1357 126.0584 53.4214 44.0460 175.0806 142 V 4.6105 9.2243 127.1617 61.3081 33.1674 173.9291 143 K 4.8172 8.8898 129.8905 54.6438 35.4825 175.7895 144 G 4.1507 8.6834 111.7257 47.0596 0.0000 172.6197 145 Y 5.0124 7.1333 116.2573 55.1780 41.2549 174.3777 146 F 4.9353 8.9619 118.1209 57.3267 43.5893 171.7276 147 P 3.6439 0.0000 0.0000 60.8819 33.7856 174.9477 148 E 4.1518 8.0729 118.4575 56.1220 30.0197 174.6465 149 P 5.0095 0.0000 0.0000 61.1733 33.9977 174.1268 150 V 4.5302 7.8490 109.3330 60.2414 35.7276 175.2439 151 T 4.6378 8.8798 118.6494 61.8147 71.7450 173.5806 152 V 4.6741 8.1926 124.1783 61.4776 34.4652 174.1087 153 T 4.7111 8.6282 121.2807 60.0136 71.8687 172.4402 154 W 5.0456 8.2574 122.9150 54.8876 32.1807 175.5055 155 N 4.2966 8.9887 124.7942 55.5383 36.0555 175.5615 156 S 3.5514 10.1078 111.8153 59.8766 60.8713 175.2013 157 G 3.9798 8.9772 106.6671 46.5578 0.0000 173.5234 158 S 4.1637 8.1592 114.4156 61.2651 62.2889 174.4901 159 L 4.4153 7.9719 120.8133 54.2195 41.6495 176.3968 160 S 4.5825 8.6843 119.0356 59.5328 65.4887 175.1111 161 S 4.3393 7.9003 112.8498 58.6801 64.1702 174.3848 162 G 3.7522 8.6483 109.4907 45.5952 0.0000 172.6751 163 V 4.5041 7.2240 118.7711 61.6665 33.4466 175.0550 164 H 4.6949 9.2989 123.7321 54.5428 32.3670 172.3172 165 T 4.8859 8.3535 120.5344 61.7469 70.0464 174.5061 166 F 4.5708 8.9666 125.8118 55.8562 40.1871 174.4222 167 P 4.3967 0.0000 0.0000 62.3406 31.8829 176.3268 168 A 4.5880 8.5337 123.5634 52.2717 19.3427 176.8784 169 V 4.4630 8.7424 120.9931 60.9722 34.6146 174.2070 170 L 4.5701 8.5052 129.4279 53.7563 42.8973 175.4234 171 Q 4.3970 8.9985 127.2074 55.6819 32.2494 174.6663 172 S 3.7613 9.6218 118.7761 59.8454 60.5422 173.1312 173 D 4.5288 8.3181 116.4594 54.3799 38.8393 173.9459 174 L 4.8189 7.8057 119.0228 52.9642 46.1279 175.0562 175 Y 4.9257 8.0620 118.2388 57.1859 40.2088 175.0435 176 T 5.2227 8.7157 118.3059 61.9511 72.9246 172.8203 177 L 5.4024 9.7617 126.7855 53.6635 46.4607 174.8796 178 S 5.3198 8.7278 116.4337 57.0234 67.1788 172.4538 179 S 5.5907 9.3541 114.9479 57.0139 66.0585 172.8278 180 S 5.4927 9.7659 121.0705 56.6539 66.6206 173.1458 181 V 4.5610 8.2529 119.8091 60.3209 34.6400 173.8701 182 T 5.2472 8.0897 119.7055 62.0681 70.6028 174.0163 183 V 4.5619 7.9820 117.2200 58.7514 36.4186 173.4369 184 P 4.3595 0.0000 0.0000 62.4178 31.6542 178.0015 185 S 4.2225 8.8375 117.7148 61.1744 62.7232 174.8966 186 S 4.7921 7.9463 115.8901 58.9911 63.2606 174.7161 187 T 4.5060 8.4215 119.0458 63.8670 70.6512 174.2498 188 W 5.3176 7.8826 128.2627 54.6838 33.6756 173.3435 189 P 2.9792 0.0000 0.0000 65.2689 30.5330 178.3689 190 S 3.7251 6.9103 111.6848 60.9414 63.4347 173.9142 191 E 4.5374 8.5986 122.0587 55.2677 30.8420 176.9325 192 T 4.2689 8.2105 118.0662 63.9274 69.4777 174.5252 193 V 4.7567 8.3540 122.9729 62.2287 34.9762 173.6496 194 T 5.3342 9.6495 124.5833 61.8751 73.0405 170.3840 195 C 4.2683 8.6298 119.9744 53.6223 45.0943 172.4484 196 N 4.5166 8.8303 122.1379 51.9768 39.4113 173.9724 197 V 4.5184 8.4150 125.0752 61.2369 33.7315 174.6046 198 A 4.8983 9.0028 129.2469 50.7834 22.2942 174.4065 199 H 4.7611 8.7942 124.3392 53.7640 29.2303 173.3982 200 P 4.0823 0.0000 0.0000 65.2331 31.7833 178.1779 201 A 3.8730 8.0090 119.2394 55.1967 17.9754 178.3588 202 S 4.5347 7.7318 105.9129 57.4359 63.3777 173.8811 203 S 3.7202 7.7751 115.2082 60.0797 61.0303 172.3724 204 T 4.2459 7.4920 115.3462 63.3977 69.8370 174.6665 205 K 4.8615 8.3998 126.0873 55.2334 33.6040 173.9711 206 V 4.2720 8.6475 126.2164 60.9709 33.7031 173.7457 207 D 5.1247 8.6403 127.2089 52.4594 43.0645 175.4785 208 K 4.4193 8.4258 125.9505 54.2108 33.9034 175.0436 209 K 4.7978 8.5763 129.3592 56.0111 33.1741 176.5363 210 I 4.4214 9.0374 129.0228 60.3868 37.2509 175.4442 211 V 4.6351 8.3084 120.2971 58.5574 33.6249 174.7494 212 P 4.7474 0.0000 0.0000 63.0084 31.7625 176.1335 213 R 4.7130 8.2296 117.0113 54.9815 32.1737 174.2206 214 D 4.7007 8.4996 120.6710 53.6927 42.0325 176.3391 215 C 4.3144 8.5700 116.6040 58.5378 29.9258 173.4033 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 V 8.05 4.52 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 0.85 0.00 0.00 1.02 0.00 0.00 3 K 9.12 4.61 0.00 1.87 1.60 0.00 1.65 0.00 0.00 1.67 0.00 0.00 2.90 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.37 1.53 7.81 4 L 8.82 5.28 0.00 1.63 1.50 0.87 0.92 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 5 V 8.91 4.67 2.08 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 1.09 0.00 0.00 0.95 0.00 0.00 6 E 8.85 5.33 0.00 2.40 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 2.41 2.62 0.00 7 S 9.53 4.59 0.00 3.86 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 G 9.28 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 9 G 7.16 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 G 7.62 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 11 L 8.21 5.05 0.00 1.77 1.65 1.01 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 12 V 8.80 4.59 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 0.97 0.00 0.00 0.89 0.00 0.00 13 K 8.51 4.70 0.00 1.71 1.68 0.00 1.73 0.00 0.00 1.79 0.00 0.00 2.84 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.51 1.40 7.81 14 P 0.00 4.28 0.00 2.02 2.01 0.00 3.68 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.10 0.00 15 G 9.64 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 16 G 8.01 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 17 S 8.23 5.26 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 18 L 8.61 4.44 0.00 1.60 1.26 0.84 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 19 K 8.47 4.78 0.00 1.65 1.57 0.00 1.84 0.00 0.00 1.52 0.00 0.00 2.13 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.33 1.46 7.81 20 L 8.60 4.80 0.00 0.87 1.29 -0.02 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 21 S 9.11 5.29 0.00 3.80 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 22 C 9.13 5.27 0.00 2.43 2.76 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 23 A 9.07 4.87 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 24 A 8.25 5.29 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 S 8.88 4.32 0.00 3.85 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 26 G 10.74 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 0.00 0.00 0.00 27 F 7.05 4.87 0.00 3.07 2.90 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 28 T 8.66 4.09 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 29 F 8.74 3.96 0.00 2.74 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 S 8.27 4.14 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 31 N 8.32 4.68 0.00 2.71 3.00 0.00 0.00 6.94 7.10 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 32 Y 7.72 4.94 0.00 2.99 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 33 A 8.63 4.61 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 34 M 8.89 5.25 0.00 1.80 1.86 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.36 0.00 35 S 8.96 5.19 0.00 4.11 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 36 W 8.85 5.26 0.00 3.31 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 37 V 9.37 5.07 2.03 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 1.33 0.00 0.00 0.67 0.00 0.00 38 R 9.21 5.04 0.00 1.36 0.95 0.00 3.02 0.00 0.00 3.03 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.65 0.00 39 Q 8.90 5.11 0.00 2.38 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.91 0.00 0.00 0.00 0.00 0.00 2.33 2.52 0.00 40 T 8.70 4.50 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 41 P 0.00 4.26 0.00 2.12 2.25 0.00 3.73 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 2.10 2.19 0.00 42 E 8.05 4.11 0.00 2.00 2.03 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 2.35 2.37 0.00 43 K 8.69 4.11 0.00 1.92 2.05 0.00 1.75 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.52 1.53 7.81 44 R 7.74 4.18 0.00 1.86 1.83 0.00 3.13 0.00 0.00 3.21 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.65 0.00 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70 S 8.67 4.96 0.00 4.03 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 71 R 8.69 5.18 0.00 2.17 2.10 0.00 3.01 0.00 0.00 3.18 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.75 0.00 72 D 9.22 4.90 0.00 2.91 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 73 N 8.97 4.68 0.00 2.85 2.99 0.00 0.00 7.15 7.35 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 74 A 7.95 4.14 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 75 R 7.79 4.36 0.00 1.74 1.86 0.00 3.38 0.00 0.00 3.23 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.65 0.00 76 N 7.77 3.14 0.00 2.67 2.52 0.00 0.00 6.84 7.34 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 77 I 6.67 4.54 1.45 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.86 0.08 0.00 0.00 78 L 8.61 5.21 0.00 1.99 1.45 1.14 0.14 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 79 Y 9.50 5.60 0.00 2.95 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 80 L 8.65 4.58 0.00 0.60 0.48 0.83 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 81 Q 9.20 4.40 0.00 2.10 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.56 0.00 0.00 0.00 0.00 0.00 2.26 2.30 0.00 82 M 9.03 4.52 0.00 1.39 1.58 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.81 0.00 82A T 8.19 4.94 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 1.22 0.00 0.00 82B S 8.65 3.71 0.00 4.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82C L 7.76 4.47 0.00 1.82 1.63 0.88 0.95 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 83 R 9.32 4.95 0.00 1.89 1.98 0.00 2.81 0.00 0.00 3.21 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.56 0.00 84 S 8.93 4.14 0.00 4.04 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 E 8.15 4.14 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 2.30 2.37 0.00 86 D 8.45 4.76 0.00 2.91 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 T 8.03 4.34 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 1.34 0.00 0.00 88 A 8.50 4.33 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 89 M 8.31 4.62 0.00 1.99 1.86 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 2.08 0.00 90 Y 9.03 4.85 0.00 3.08 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 91 F 9.94 5.50 0.00 3.30 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 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.78 0.00 0.00 103 W 9.10 5.16 0.00 3.02 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 0.00 104 G 9.04 4.35 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 0.00 105 A 9.01 4.46 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 0.00 106 G 9.26 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 0.00 107 T 8.40 4.65 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 1.29 0.00 0.00 108 S 8.63 4.77 0.00 3.94 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 0.00 109 V 8.87 4.83 2.36 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 0.87 0.00 0.00 0.62 0.00 0.00 110 T 8.76 4.89 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 1.41 0.00 0.00 111 V 8.27 4.65 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 1.02 0.00 0.00 112 S 8.79 4.52 0.00 3.90 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 0.00 113 S 8.46 4.42 0.00 3.81 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 0.00 114 A 7.53 4.11 0.30 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 0.00 115 K 8.14 4.54 0.00 1.71 1.73 0.00 1.80 0.00 0.00 1.63 0.00 0.00 2.75 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.30 1.31 7.81 116 T 8.64 4.36 4.36 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 1.28 0.00 0.00 117 T 10.25 4.86 4.42 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 1.35 0.00 0.00 118 P 0.00 5.02 0.00 1.96 2.01 0.00 3.72 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.14 0.00 119 P 0.00 4.95 0.00 2.00 1.98 0.00 3.69 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.68 0.00 120 S 8.88 4.40 0.00 3.50 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 0.00 121 V 7.92 4.52 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 0.70 0.00 0.00 0.78 0.00 0.00 122 Y 8.71 5.19 0.00 2.94 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 0.00 123 P 0.00 4.79 0.00 2.18 2.14 0.00 3.92 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 2.09 2.10 0.00 124 L 9.13 4.76 0.00 1.76 1.65 1.00 1.10 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 0.00 125 A 8.46 5.04 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 0.00 126 P 0.00 4.51 0.00 2.25 2.07 0.00 3.32 0.00 0.00 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 1.99 0.00 127 G 8.51 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 0.00 124 N 9.37 5.16 0.00 2.97 2.78 0.00 0.00 6.64 8.49 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 0.00 125 S 8.53 5.19 0.00 3.67 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 0.00 126 M 8.08 4.57 0.00 2.07 2.14 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.51 0.00 127 V 8.21 3.77 2.08 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 0.77 0.00 0.00 0.93 0.00 0.00 137 T 8.46 4.64 4.17 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 1.20 0.00 0.00 138 L 8.75 4.63 0.00 0.95 1.16 -0.06 -0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 139 G 8.01 4.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 C 9.65 5.38 0.00 2.80 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 L 9.14 4.99 0.00 1.87 1.72 1.01 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 142 V 9.22 4.61 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 0.70 0.00 0.00 0.85 0.00 0.00 143 K 8.89 4.82 0.00 1.95 1.68 0.00 1.96 0.00 0.00 1.85 0.00 0.00 2.93 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.41 1.43 7.81 144 G 8.68 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 Y 7.13 5.01 0.00 3.12 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 0.00 146 F 8.96 4.94 0.00 3.19 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 0.00 147 P 0.00 3.64 0.00 1.46 0.58 0.00 3.83 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.84 0.00 148 E 8.07 4.15 0.00 1.64 1.70 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 1.47 1.47 0.00 149 P 0.00 5.01 0.00 2.08 1.99 0.00 3.63 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.89 0.00 150 V 7.85 4.53 1.69 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 -0.53 0.00 0.00 0.62 0.00 0.00 151 T 8.88 4.64 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 152 V 8.19 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 0.43 0.00 0.00 0.80 0.00 0.00 153 T 8.63 4.71 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 1.15 0.00 0.00 154 W 8.26 5.05 0.00 3.27 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 N 8.99 4.30 0.00 3.01 3.01 0.00 0.00 7.18 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 S 10.11 3.55 0.00 3.96 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 0.00 157 G 8.98 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 0.00 158 S 8.16 4.16 0.00 3.88 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 0.00 159 L 7.97 4.42 0.00 2.00 1.64 0.97 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 160 S 8.68 4.58 0.00 3.81 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 0.00 161 S 7.90 4.34 0.00 3.93 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 0.00 162 G 8.65 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 0.00 0.00 0.00 163 V 7.22 4.50 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 1.07 0.00 0.00 0.91 0.00 0.00 164 H 9.30 4.69 0.00 2.93 2.53 0.00 5.63 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 165 T 8.35 4.89 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 1.26 0.00 0.00 166 F 8.97 4.57 0.00 3.00 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 P 0.00 4.40 0.00 2.13 2.04 0.00 3.88 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 2.10 2.13 0.00 168 A 8.53 4.59 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 0.00 169 V 8.74 4.46 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 0.95 0.00 0.00 0.99 0.00 0.00 170 L 8.51 4.57 0.00 1.49 1.47 -0.09 0.57 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 0.00 171 Q 9.00 4.40 0.00 1.96 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.21 5.99 0.00 0.00 0.00 0.00 0.00 2.21 2.28 0.00 172 S 9.62 3.76 0.00 3.96 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 0.00 173 D 8.32 4.53 0.00 2.73 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 0.00 174 L 7.81 4.82 0.00 1.42 1.43 0.95 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 175 Y 8.06 4.93 0.00 1.74 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 T 8.72 5.22 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 177 L 9.76 5.40 0.00 1.87 1.70 0.99 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 178 S 8.73 5.32 0.00 3.97 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 0.00 179 S 9.35 5.59 0.00 4.05 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 0.00 180 S 9.77 5.49 0.00 3.92 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 0.00 181 V 8.25 4.56 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.54 0.00 0.00 0.42 0.00 0.00 182 T 8.09 5.25 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 1.15 0.00 0.00 183 V 7.98 4.56 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 0.58 0.00 0.00 0.97 0.00 0.00 184 P 0.00 4.36 0.00 2.19 1.98 0.00 3.63 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.07 0.00 185 S 8.84 4.22 0.00 4.02 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 0.00 186 S 7.95 4.79 0.00 3.89 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 0.00 187 T 8.42 4.51 4.39 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 1.28 0.00 0.00 188 W 7.88 5.32 0.00 3.17 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 0.00 189 P 0.00 2.98 0.00 1.62 1.20 0.00 3.48 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.55 0.00 190 S 6.91 3.73 0.00 4.00 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 0.00 191 E 8.60 4.54 0.00 2.20 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 2.32 2.45 0.00 192 T 8.21 4.27 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 1.32 0.00 0.00 193 V 8.35 4.76 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 0.93 0.00 0.00 1.12 0.00 0.00 194 T 9.65 5.33 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 195 C 8.63 4.27 0.00 1.23 1.18 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 0.00 196 N 8.83 4.52 0.00 2.56 2.71 0.00 0.00 6.16 8.24 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 0.00 197 V 8.41 4.52 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 0.74 0.00 0.00 0.72 0.00 0.00 198 A 9.00 4.90 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 H 8.79 4.76 0.00 3.05 3.12 0.00 5.65 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 P 0.00 4.08 0.00 2.13 2.06 0.00 3.76 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.07 0.00 201 A 8.01 3.87 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 0.00 202 S 7.73 4.53 0.00 4.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 S 7.78 3.72 0.00 4.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 T 7.49 4.25 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 1.18 0.00 0.00 205 K 8.40 4.86 0.00 1.67 1.63 0.00 1.72 0.00 0.00 1.60 0.00 0.00 2.85 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.27 1.38 7.81 206 V 8.65 4.27 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 0.91 0.00 0.00 0.88 0.00 0.00 207 D 8.64 5.12 0.00 2.53 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 0.00 208 K 8.43 4.42 0.00 1.83 1.61 0.00 1.58 0.00 0.00 1.61 0.00 0.00 2.87 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.36 1.44 7.81 209 K 8.58 4.80 0.00 1.87 1.76 0.00 1.70 0.00 0.00 2.43 0.00 0.00 3.01 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.55 1.42 7.81 210 I 9.04 4.42 2.01 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.19 0.83 0.00 0.00 211 V 8.31 4.64 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 1.03 0.00 0.00 212 P 0.00 4.75 0.00 1.91 1.70 0.00 3.64 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.00 0.00 213 R 8.23 4.71 0.00 1.91 1.92 0.00 3.10 0.00 0.00 3.29 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.71 0.00 214 D 8.50 4.70 0.00 2.70 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 C 8.57 4.31 0.00 3.09 2.93 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 * Residues marked with a * may have inaccurate shift predictions.