NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 13 A 4.3805 8.2493 123.6027 51.9312 19.8759 175.3104 14 E 3.9559 8.5669 114.9429 55.6717 31.2929 171.6228 15 A 4.2310 8.7696 125.6710 51.8332 15.3434 180.5875 16 G 3.9754 8.8448 109.5486 43.9383 0.0000 174.5954 17 I 3.9282 7.0750 120.1472 63.5726 38.2699 178.0526 18 T 3.9072 7.6594 115.9156 63.2333 69.1040 174.8757 19 G 3.5918 6.9453 111.7005 44.8484 0.0000 170.7327 20 T 4.8140 7.5685 116.8971 61.4683 70.5662 174.0642 21 W 4.9750 9.0584 125.6865 55.0898 33.5151 174.0414 22 Y 6.1178 9.9963 118.3022 55.5569 42.2829 174.3416 23 N 5.7092 8.9586 118.7076 49.7790 40.6876 174.9424 24 Q 4.2005 8.8199 115.9798 58.4094 28.4258 177.0833 25 L 4.3337 8.1731 117.0085 54.6734 42.4176 177.1567 26 G 3.9778 8.6497 107.4382 45.5783 0.0000 173.8639 27 S 4.6131 8.6011 115.7503 58.3042 64.7166 173.1812 28 T 4.8780 8.4876 118.5504 61.7046 71.3668 173.0976 29 F 4.8138 8.9946 128.5892 56.4703 42.2342 173.7619 30 I 4.7057 8.3941 128.3524 59.5148 39.1241 175.3181 31 V 4.7008 8.0014 126.2504 59.8750 35.3526 174.6380 32 T 4.8294 8.4698 117.1029 61.6996 71.8908 172.7580 33 A 4.9856 8.8083 128.6205 50.2394 20.8381 176.4760 34 G 4.1871 9.1860 109.5927 44.5134 0.0000 174.9306 35 A 4.2762 8.8182 123.6418 54.0902 18.5356 177.9473 36 D 4.5824 7.9060 113.6605 53.8498 41.6275 176.4411 37 G 3.1150 7.8504 105.9124 45.0439 0.0000 173.2821 38 A 4.9937 7.8209 121.1046 50.5157 21.7512 176.5606 39 L 5.3685 8.5811 118.5248 53.2940 45.8581 176.0853 40 T 4.8527 9.5919 112.6289 59.5392 73.2063 174.4878 41 G 4.0195 7.3470 107.2614 45.9356 0.0000 171.1160 42 T 5.2927 7.6340 109.0632 60.2332 72.8757 172.4266 43 Y 5.2358 9.1424 122.7036 55.9734 42.9809 173.5256 44 E 5.3495 8.7719 125.9063 54.7605 32.8444 174.0434 45 S 5.3128 9.3067 121.4949 57.1487 63.5859 173.8247 46 A 4.3456 9.0191 128.7008 53.4096 18.9722 177.7348 47 V 4.3435 7.4355 107.5923 60.1019 35.2239 175.8474 48 G 3.6584 8.5277 107.9848 44.8557 0.0000 174.1614 49 N 4.5539 7.8808 116.5912 51.7207 37.0671 173.4542 50 A 4.9215 7.2646 122.5079 50.7691 22.7120 175.7515 51 E 4.6694 9.6649 115.0437 56.6753 32.8399 177.4872 52 S 3.7578 8.5794 116.0504 57.9724 61.5485 169.3817 53 R 5.0125 8.2475 116.4731 55.8239 31.7225 175.5681 54 Y 4.8029 8.9015 117.9609 56.1536 42.3610 175.0706 55 V 4.3380 8.4986 121.9500 62.5934 32.5504 175.0632 56 L 5.4410 8.3540 125.6223 53.4636 43.7860 175.5157 57 T 4.8168 8.3912 113.3304 61.5048 71.4629 173.0272 58 G 4.7559 8.7619 112.6018 46.4715 0.0000 171.8306 59 R 5.5007 8.7131 117.3016 55.2323 35.1703 173.9820 60 Y 5.0522 8.3058 118.7928 56.0475 41.9038 174.6303 61 D 4.5437 9.1125 120.1849 53.4295 40.8259 176.4238 62 S 4.5028 8.5732 125.4762 58.2916 60.9892 173.2317 63 A 4.6830 9.0288 119.0396 52.8959 26.3000 177.2027 64 P 4.6334 0.0000 0.0000 63.1147 31.4224 176.6927 65 A 4.7184 7.7197 119.8925 52.4602 18.8113 178.1571 66 T 3.7418 7.9345 111.3745 63.6742 70.2058 174.5414 67 D 4.3771 8.3137 123.4690 57.5023 38.8524 178.9231 68 G 3.6403 6.7399 109.9444 47.6863 0.0000 172.3317 69 S 4.6144 7.4739 118.2120 56.9058 65.4791 174.4422 70 G 4.1688 8.2517 109.0650 45.6273 0.0000 173.0482 71 T 4.8424 8.6188 116.4398 61.6809 70.3903 174.7483 72 A 4.9104 8.7332 128.7746 52.0786 20.3354 175.7930 73 L 4.9253 8.6328 119.7439 55.6283 44.6486 173.7340 74 G 4.6107 9.0893 104.7917 45.9969 0.0000 172.2765 75 W 5.6222 8.3634 116.7125 55.8646 32.1711 173.3689 76 T 5.2654 9.2026 116.6210 61.8983 72.3710 173.4151 77 V 4.6845 8.5095 123.2776 61.1151 34.8982 173.7238 78 A 4.6399 8.2968 129.3653 49.2334 20.5724 177.6641 79 W 4.3252 8.3708 126.2480 55.8886 28.2314 176.3165 80 K 5.2559 7.7537 118.1945 54.7981 35.4559 174.5002 81 N 4.8521 9.0143 121.8364 52.3507 39.7881 174.3873 82 N 4.5903 8.5722 114.2514 54.8975 38.8045 175.0759 83 Y 4.5184 7.8618 114.2165 59.0690 39.6395 176.1176 84 R 4.7557 9.0225 117.1507 54.5206 34.3322 174.1234 85 N 5.1727 8.5905 116.9490 52.3967 40.3454 173.7721 86 A 4.3481 9.1214 128.6483 51.6020 20.1355 176.1136 87 H 4.1454 8.0650 112.8311 55.9482 26.6270 173.1543 88 S 5.1852 7.4390 112.1362 57.8894 67.0533 174.2338 89 A 5.0760 8.9805 120.5641 50.9283 22.8944 175.3587 90 T 5.1229 8.9368 116.5560 61.7770 72.6786 173.2934 91 T 4.9394 8.3261 114.2545 59.6196 72.3449 172.6200 92 W 4.9109 8.6296 123.7209 54.7698 32.4791 174.3813 93 S 4.9465 8.5464 118.8334 56.7821 64.8656 172.8589 94 G 4.5419 8.5541 113.3964 46.6373 0.0000 171.8125 95 Q 5.2408 8.3373 117.9634 54.9760 32.3598 173.4931 96 Y 4.9372 9.0461 122.0304 56.1177 41.4589 174.4830 97 V 4.2544 8.2149 125.4305 61.2123 34.8211 175.2773 98 G 4.1150 7.7538 116.7796 42.3522 0.0000 169.5634 99 G 3.7126 8.9173 103.4794 44.0498 0.0000 172.7874 100 A 4.0190 8.9238 122.2785 54.7206 18.2506 178.1114 101 E 4.4667 8.0068 116.1891 54.4155 30.2810 175.1472 102 A 4.6490 8.3747 127.0317 51.4566 20.2178 176.3039 103 R 5.3532 8.9581 119.6618 54.8002 35.4689 174.5882 104 I 4.9448 8.7649 121.5633 59.9288 40.6387 174.2892 105 N 5.3283 8.9430 125.9329 52.0338 40.2207 174.7086 106 T 5.4354 9.1917 113.6047 59.9945 73.3531 172.6036 107 Q 4.9495 8.8294 119.0235 53.8552 33.1056 174.8002 108 W 5.2752 8.5565 119.5680 54.5203 32.4523 173.9361 109 L 5.1748 8.5298 119.6200 52.8668 44.9461 175.3481 110 L 5.0603 9.3464 126.4184 53.6600 44.6464 174.8920 111 T 5.0339 8.6981 123.3895 61.9914 70.9500 173.8812 112 S 5.1728 8.6343 122.2399 56.6036 65.6594 174.0204 113 G 3.9822 8.8368 110.9049 46.1243 0.0000 173.2223 114 T 4.7763 8.3307 114.2746 59.8166 72.4196 172.8736 115 T 4.4104 7.9419 110.8973 60.3184 70.7536 175.3206 116 E 3.9593 8.8497 121.1959 59.7991 29.0693 179.4700 117 A 4.1483 8.0702 119.2047 54.6921 18.5834 178.3194 118 N 4.7584 7.8131 111.9723 53.2248 38.7808 176.8872 119 A 4.1506 8.0206 125.7311 53.9530 18.4552 179.5345 120 W 4.3233 8.3399 113.9367 58.3176 28.5976 176.5602 121 K 4.2382 6.5833 118.8116 56.0336 32.2079 176.7881 122 S 4.4150 7.8162 114.4560 60.2579 65.1414 173.6277 123 T 5.0828 7.7425 117.0490 61.8116 70.3039 173.7159 124 L 4.7036 8.8497 127.3959 53.5672 43.8896 176.2914 125 V 4.3296 7.6915 120.0698 60.3274 34.7324 174.8729 126 G 3.1822 6.3316 107.5616 45.7289 0.0000 171.2222 127 H 5.4741 8.1546 113.8941 54.0487 31.6460 172.6638 128 D 5.2629 9.2044 119.3122 53.0162 45.5049 174.5467 129 T 5.1459 9.1372 117.9840 61.8981 72.1366 173.0179 130 F 5.7297 9.5437 124.8613 56.1733 42.5331 174.5734 131 T 5.4500 9.3097 111.2072 60.3933 72.8086 174.1384 132 K 4.3894 8.5437 118.7784 56.2280 32.2980 177.2463 133 V 3.9155 7.7168 124.6608 62.9823 31.4749 175.4535 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 13 A 8.25 4.38 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 14 E 8.57 3.96 0.00 2.16 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 2.43 0.00 15 A 8.77 4.23 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 16 G 8.84 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 17 I 7.08 3.93 1.38 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.20 -0.36 0.48 0.00 0.00 18 T 7.66 3.91 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 19 G 6.95 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 T 7.57 4.81 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 0.74 0.00 0.00 21 W 9.06 4.97 0.00 3.16 3.35 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 22 Y 10.00 6.12 0.00 2.96 2.85 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 23 N 8.96 5.71 0.00 2.42 1.65 0.00 0.00 6.65 7.45 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 24 Q 8.82 4.20 0.00 2.21 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.96 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 25 L 8.17 4.33 0.00 1.83 1.78 0.97 1.00 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 26 G 8.65 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 27 S 8.60 4.61 0.00 4.14 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 28 T 8.49 4.88 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 0.92 0.00 0.00 29 F 8.99 4.81 0.00 2.55 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 30 I 8.39 4.71 1.73 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 1.08 0.33 0.76 0.00 0.00 31 V 8.00 4.70 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.04 0.00 0.00 0.64 0.00 0.00 32 T 8.47 4.83 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 1.15 0.00 0.00 33 A 8.81 4.99 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 G 9.19 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 0.00 0.00 0.00 0.00 35 A 8.82 4.28 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 36 D 7.91 4.58 0.00 2.59 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 37 G 7.85 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 0.00 0.00 0.00 38 A 7.82 4.99 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 39 L 8.58 5.37 0.00 1.68 1.50 1.09 0.31 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 T 9.59 4.85 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 1.21 0.00 0.00 41 G 7.35 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 T 7.63 5.29 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 1.21 0.00 0.00 43 Y 9.14 5.24 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 44 E 8.77 5.35 0.00 2.15 1.77 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 2.30 2.56 0.00 45 S 9.31 5.31 0.00 4.19 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 46 A 9.02 4.35 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 47 V 7.44 4.34 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 0.67 0.00 0.00 0.85 0.00 0.00 48 G 8.53 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 N 7.88 4.55 0.00 2.61 2.65 0.00 0.00 6.64 7.95 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 50 A 7.26 4.92 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 E 9.66 4.67 0.00 1.97 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 2.27 2.00 0.00 52 S 8.58 3.76 0.00 3.35 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 53 R 8.25 5.01 0.00 1.74 1.87 0.00 3.21 0.00 0.00 3.23 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 54 Y 8.90 4.80 0.00 2.89 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 55 V 8.50 4.34 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 0.76 0.00 0.00 0.94 0.00 0.00 56 L 8.35 5.44 0.00 1.90 1.65 0.82 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 57 T 8.39 4.82 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 1.26 0.00 0.00 58 G 8.76 4.76 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 0.00 0.00 0.00 59 R 8.71 5.50 0.00 1.76 1.76 0.00 3.34 0.00 0.00 3.23 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.74 0.00 60 Y 8.31 5.05 0.00 3.03 2.88 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 61 D 9.11 4.54 0.00 2.68 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 62 S 8.57 4.50 0.00 3.84 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 A 9.03 4.68 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 64 P 0.00 4.63 0.00 2.21 2.17 0.00 3.76 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 2.00 1.98 0.00 65 A 7.72 4.72 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 T 7.93 3.74 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 67 D 8.31 4.38 0.00 2.82 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 G 6.74 3.64 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 69 S 7.47 4.61 0.00 3.90 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 70 G 8.25 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 0.00 0.00 0.00 0.00 71 T 8.62 4.84 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 72 A 8.73 4.91 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 73 L 8.63 4.93 0.00 2.06 1.97 1.20 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 74 G 9.09 4.61 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 75 W 8.36 5.62 0.00 3.49 3.26 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 76 T 9.20 5.27 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 1.23 0.00 0.00 77 V 8.51 4.68 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 0.86 0.00 0.00 78 A 8.30 4.64 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 79 W 8.37 4.33 0.00 3.33 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 80 K 7.75 5.26 0.00 1.90 1.71 0.00 1.84 0.00 0.00 1.80 0.00 0.00 3.06 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.37 1.46 7.81 81 N 9.01 4.85 0.00 2.73 2.50 0.00 0.00 6.84 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 N 8.57 4.59 0.00 2.26 2.57 0.00 0.00 6.59 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 83 Y 7.86 4.52 0.00 3.20 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 R 9.02 4.76 0.00 2.01 1.89 0.00 3.18 0.00 0.00 3.37 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.84 0.00 85 N 8.59 5.17 0.00 2.64 2.63 0.00 0.00 6.97 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 A 9.12 4.35 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 87 H 8.06 4.15 0.00 3.38 3.35 0.00 5.65 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 S 7.44 5.19 0.00 3.94 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 89 A 8.98 5.08 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 90 T 8.94 5.12 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 -0.07 0.00 0.00 91 T 8.33 4.94 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 1.16 0.00 0.00 92 W 8.63 4.91 0.00 1.78 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 0.00 0.00 0.00 93 S 8.55 4.95 0.00 3.84 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 94 G 8.55 4.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 Q 8.34 5.24 0.00 2.24 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.13 6.76 0.00 0.00 0.00 0.00 0.00 2.29 2.35 0.00 96 Y 9.05 4.94 0.00 2.96 2.83 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 97 V 8.21 4.25 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 0.87 0.00 0.00 0.90 0.00 0.00 98 G 7.75 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 0.00 0.00 0.00 99 G 8.92 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 0.00 100 A 8.92 4.02 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 0.00 101 E 8.01 4.47 0.00 2.07 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 2.19 2.34 0.00 102 A 8.37 4.65 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 0.00 103 R 8.96 5.35 0.00 1.75 1.89 0.00 3.16 0.00 0.00 3.24 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.81 0.00 104 I 8.76 4.94 1.88 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 -0.22 1.06 0.00 0.00 105 N 8.94 5.33 0.00 2.84 2.83 0.00 0.00 6.22 6.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 T 9.19 5.44 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 1.49 0.00 0.00 107 Q 8.83 4.95 0.00 1.97 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.99 6.56 0.00 0.00 0.00 0.00 0.00 2.24 2.28 0.00 108 W 8.56 5.28 0.00 2.63 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 0.00 0.00 0.00 0.00 109 L 8.53 5.17 0.00 1.53 1.52 0.87 0.48 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 0.00 110 L 9.35 5.06 0.00 1.78 1.62 0.62 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 111 T 8.70 5.03 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 1.20 0.00 0.00 112 S 8.63 5.17 0.00 3.70 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 G 8.84 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 0.00 114 T 8.33 4.78 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 1.25 0.00 0.00 115 T 7.94 4.41 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 1.21 0.00 0.00 116 E 8.85 3.96 0.00 2.02 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 0.00 2.42 2.35 0.00 117 A 8.07 4.15 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 0.00 118 N 7.81 4.76 0.00 2.72 2.68 0.00 0.00 6.92 7.03 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 0.00 119 A 8.02 4.15 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 0.00 120 W 8.34 4.32 0.00 3.56 3.18 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 0.00 121 K 6.58 4.24 0.00 1.11 0.74 0.00 1.14 0.00 0.00 0.86 0.00 0.00 2.90 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.30 0.79 7.81 122 S 7.82 4.41 0.00 4.02 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 0.00 123 T 7.74 5.08 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 1.17 0.00 0.00 124 L 8.85 4.70 0.00 1.82 1.69 0.96 0.82 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 0.00 125 V 7.69 4.33 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.48 0.00 0.00 0.69 0.00 0.00 126 G 6.33 3.18 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 0.00 0.00 0.00 127 H 8.15 5.47 0.00 3.18 3.13 0.00 5.67 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 D 9.20 5.26 0.00 2.91 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 0.00 0.00 0.00 129 T 9.14 5.15 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 1.33 0.00 0.00 130 F 9.54 5.73 0.00 3.08 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 T 9.31 5.45 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 1.39 0.00 0.00 132 K 8.54 4.39 0.00 1.45 1.58 0.00 1.13 0.00 0.00 1.17 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.46 0.21 7.81 133 V 7.72 3.92 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 0.71 0.00 0.00 0.95 0.00 0.00