NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 5.1699 8.2048 120.0945 56.0551 33.9488 173.6345 2 R 4.3597 8.2283 116.3500 54.7270 34.6161 172.3815 3 R 4.9780 8.8884 122.4877 55.3541 32.4928 174.2738 4 Y 5.4825 8.8771 123.2037 55.1711 41.9571 175.4892 5 E 4.5238 8.6891 125.5289 54.8221 27.8693 175.7612 6 V 3.7623 7.5153 121.6052 63.2128 33.2697 174.8067 7 N 5.6500 8.6053 124.3134 51.9096 42.4118 173.3836 8 I 5.2075 8.2912 120.0085 60.4468 42.6767 173.9404 9 V 4.6841 8.5851 122.0487 61.7256 35.2282 173.4632 10 L 5.8643 8.6491 126.1495 51.2376 46.1649 175.1846 11 N 4.4426 8.9088 119.1474 54.0502 38.6181 172.6300 12 P 4.4581 0.0000 0.0000 66.1637 31.5663 177.9099 13 N 4.6582 7.7989 119.9920 52.4654 35.9176 172.8062 14 L 4.4389 7.5616 119.4421 52.9164 45.9504 175.5220 15 D 4.4258 8.6142 124.0390 53.7232 41.7816 176.6897 16 Q 3.9316 8.6478 123.0294 58.0451 28.0306 178.2734 17 S 4.3111 7.3184 115.8228 60.8393 62.8878 175.7953 18 Q 3.8737 7.8103 120.0471 59.2755 29.1334 178.6631 19 L 3.9763 8.2336 121.3274 57.7955 41.8924 178.4630 20 A 4.3828 7.6307 119.3132 53.5994 19.3674 178.9484 21 L 3.9071 8.3904 118.5950 58.1658 41.6383 179.5949 22 E 3.9516 8.7022 118.6458 59.2232 29.3457 179.2070 23 K 3.8786 7.5187 117.3365 59.6737 32.1377 178.3642 24 E 3.9053 8.6801 119.5037 59.7270 29.4448 179.1833 25 I 3.6684 7.3375 119.4453 64.3171 37.1618 178.6494 26 I 3.5471 8.0457 120.9653 64.3371 36.9942 178.2814 27 Q 3.8513 8.2944 119.2456 59.3279 28.5028 179.5093 28 R 3.8910 8.1315 118.5356 59.5511 29.7698 178.2549 29 A 3.8006 8.2372 120.3733 54.3153 18.6457 179.2122 30 L 3.7709 8.4202 115.8930 57.7665 41.7428 179.2742 31 E 3.8206 7.7922 117.6128 59.9532 29.5826 178.2971 32 N 4.4593 7.4611 115.0463 54.9666 38.8572 174.7696 33 Y 4.7544 7.3964 118.5162 56.1915 39.2166 174.3981 34 G 4.0498 8.6553 118.8492 45.2138 0.0000 171.9931 35 A 4.5751 9.0290 120.8015 51.0281 20.5600 179.4066 36 R 4.2336 8.5337 124.5458 54.6630 29.6001 174.5157 37 V 3.7528 8.1555 122.6030 63.9505 31.6260 173.5099 38 E 4.4889 9.0241 125.1267 57.8644 31.4999 175.9646 39 K 4.6739 8.0824 119.1927 56.5322 34.6323 174.5445 40 V 5.7449 7.6094 127.1002 62.1452 32.8435 171.1051 41 E 4.6527 8.5103 126.2803 54.2896 29.9218 175.8899 42 E 4.1363 8.0870 119.8979 56.4979 29.6759 176.2736 43 L 3.8856 8.4692 125.1333 56.5776 42.1271 178.8715 44 G 2.0000 6.8553 105.0471 44.3999 0.0000 173.3813 45 L 3.3482 5.9946 117.1011 54.5397 40.2840 176.0341 46 R 4.3817 8.4257 125.0486 55.1748 31.7254 174.4736 47 R 3.6665 7.7596 120.5787 54.9720 28.4292 176.6842 48 L 4.2824 8.5345 124.1452 53.8576 42.5499 177.8005 49 A 4.1630 8.3673 123.3648 54.8645 18.4977 177.5962 50 Y 4.9263 6.4397 111.3865 53.9446 41.1562 173.1709 51 P 4.2564 0.0000 0.0000 63.6268 31.5806 176.8553 52 I 4.1414 8.1663 123.6829 60.3930 36.0065 172.6702 53 A 3.4580 8.6759 128.2067 52.4099 14.3986 175.7888 54 K 3.8963 7.7227 119.5356 56.6998 31.3184 176.0443 55 D 4.3741 7.7964 120.3835 54.3537 41.3813 175.4984 56 P 4.5689 0.0000 0.0000 63.6206 31.4632 175.3387 57 Q 4.9148 7.1448 117.7976 54.5135 32.2787 175.5992 58 G 3.5111 8.0168 102.6754 45.4620 0.0000 172.7733 59 Y 3.9416 8.5519 129.4056 57.7657 39.4163 175.2584 60 F 4.8179 8.2780 125.7512 57.3150 40.8384 174.8743 61 L 5.3527 8.2187 121.1237 53.5290 46.2837 175.4314 62 W 4.5133 7.7262 124.7432 57.9365 33.6815 173.0459 63 Y 4.5391 8.6324 126.9156 55.4225 38.6267 175.3757 64 Q 3.7822 6.3636 125.4514 56.5525 30.3021 175.4476 65 V 4.8667 8.7476 117.4479 60.1282 37.3073 173.4060 66 E 5.7363 8.9272 123.2984 53.9251 31.5799 174.3959 67 M 5.6557 8.7671 123.3761 50.9979 35.5832 172.9128 68 P 4.5842 0.0000 0.0000 62.6417 31.2997 175.3304 69 E 4.0847 8.5136 118.5983 57.5586 30.2319 179.5686 70 D 4.3619 7.5383 121.3321 55.1888 40.9365 179.7049 71 R 4.2151 8.2059 121.2979 56.6198 29.8063 178.9073 72 V 3.4498 8.1429 120.5337 65.3043 31.2039 178.3171 73 N 4.3924 8.0354 116.8497 55.3282 38.2374 177.1696 74 D 4.3105 7.9275 120.1203 57.2326 41.0868 177.8248 75 L 4.0976 8.2094 120.6418 58.5676 41.8058 178.7151 76 A 3.9564 8.0406 119.4815 55.5514 18.4837 179.3436 77 R 3.9290 8.0684 116.6277 59.6035 30.1092 178.3497 78 E 3.7859 8.2711 119.0361 59.4473 29.5788 179.2908 79 L 3.9505 7.4830 117.2489 57.8819 41.7478 179.5288 80 R 4.0999 8.5369 117.3924 59.0282 30.0468 177.8833 81 I 3.6377 7.7352 117.2785 62.9809 37.1649 175.3546 82 R 3.7979 7.6977 128.1975 56.0440 29.6349 176.6368 83 D 4.2508 8.8370 124.3479 57.7611 41.1017 178.2969 84 N 4.3317 8.1570 114.9434 55.1534 39.6719 175.4064 85 V 4.6574 8.4236 122.4983 61.2902 29.5750 176.5276 86 R 4.1639 8.7797 121.7793 57.1408 30.8950 176.7222 87 R 4.5637 7.5451 120.6875 56.6131 34.6090 172.9511 88 V 4.8225 8.1072 121.1912 62.2487 34.3457 173.7931 89 M 4.8720 8.8146 127.0476 53.6256 32.7508 172.4629 90 V 3.9560 8.0243 120.3165 62.9142 32.6662 174.9931 91 V 4.7139 8.5360 126.4622 60.8388 35.5003 173.8924 92 K 4.3690 8.6594 125.1581 55.8123 33.0268 176.0787 93 S 4.7783 9.2348 121.9721 57.7233 63.8241 173.2233 94 Q 4.4963 8.2499 120.8817 54.0268 32.4899 175.3187 95 E 4.0219 8.6717 120.3537 55.8175 28.1336 174.7633 96 P 4.3002 0.0000 0.0000 62.1544 32.1814 175.4445 97 F 5.2036 8.4344 119.9111 57.5741 41.8811 173.1438 98 L 4.7358 8.7038 127.0724 53.6459 43.2695 175.4677 99 A 4.2739 8.2032 121.7394 51.9101 20.6789 176.7917 100 N 4.0407 8.6210 115.1358 53.5444 35.8070 174.6299 101 A 4.1833 7.9111 122.8811 52.8242 18.3237 177.8127 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 8.20 5.17 0.00 1.97 2.12 0.00 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.39 0.00 2 R 8.23 4.36 0.00 2.00 1.30 0.00 3.28 0.00 0.00 3.32 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.73 0.00 3 R 8.89 4.98 0.00 1.82 1.67 0.00 3.12 0.00 0.00 3.67 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 4 Y 8.88 5.48 0.00 2.82 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 5 E 8.69 4.52 0.00 2.10 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.49 0.00 6 V 7.52 3.76 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.88 0.00 0.00 7 N 8.61 5.65 0.00 2.66 2.87 0.00 0.00 6.38 7.37 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 8 I 8.29 5.21 2.04 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.88 0.96 0.00 0.00 9 V 8.59 4.68 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 0.56 0.00 0.00 1.08 0.00 0.00 10 L 8.65 5.86 0.00 1.84 1.49 0.98 0.78 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 11 N 8.91 4.44 0.00 2.70 2.74 0.00 0.00 7.03 7.69 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 12 P 0.00 4.46 0.00 2.23 2.23 0.00 3.81 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.10 0.00 13 N 7.80 4.66 0.00 2.73 2.83 0.00 0.00 6.68 7.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 L 7.56 4.44 0.00 1.64 1.36 0.84 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 15 D 8.61 4.43 0.00 2.72 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 Q 8.65 3.93 0.00 2.16 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.88 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 17 S 7.32 4.31 0.00 3.95 3.78 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 18 Q 7.81 3.87 0.00 2.04 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.84 0.00 0.00 0.00 0.00 0.00 2.42 2.39 0.00 19 L 8.23 3.98 0.00 1.62 1.44 0.20 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 20 A 7.63 4.38 1.41 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 21 L 8.39 3.91 0.00 1.69 1.71 0.93 0.47 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 22 E 8.70 3.95 0.00 1.89 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 2.30 2.47 0.00 23 K 7.52 3.88 0.00 2.06 1.95 0.00 1.94 0.00 0.00 1.58 0.00 0.00 2.94 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.57 1.78 7.81 24 E 8.68 3.91 0.00 2.14 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.37 0.00 25 I 7.34 3.67 1.87 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 1.68 0.87 0.86 0.00 0.00 26 I 8.05 3.55 1.92 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 1.45 0.66 0.53 0.00 0.00 27 Q 8.29 3.85 0.00 2.02 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.79 0.00 0.00 0.00 0.00 0.00 2.64 2.61 0.00 28 R 8.13 3.89 0.00 2.10 1.91 0.00 3.10 0.00 0.00 3.13 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 29 A 8.24 3.80 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 L 8.42 3.77 0.00 1.64 1.63 0.36 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 31 E 7.79 3.82 0.00 2.12 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.37 0.00 32 N 7.46 4.46 0.00 2.33 2.86 0.00 0.00 7.10 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 33 Y 7.40 4.75 0.00 2.96 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 34 G 8.66 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 A 9.03 4.58 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 36 R 8.53 4.23 0.00 1.96 1.86 0.00 3.14 0.00 0.00 3.11 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.58 0.00 37 V 8.16 3.75 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 1.00 0.00 0.00 38 E 9.02 4.49 0.00 1.87 1.95 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 2.24 2.50 0.00 39 K 8.08 4.67 0.00 1.93 2.26 0.00 2.20 0.00 0.00 2.05 0.00 0.00 3.26 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.69 1.55 7.81 40 V 7.61 5.74 1.95 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 0.85 0.00 0.00 0.45 0.00 0.00 41 E 8.51 4.65 0.00 1.95 1.83 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 2.14 2.30 0.00 42 E 8.09 4.14 0.00 1.92 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 2.47 2.57 0.00 43 L 8.47 3.89 0.00 1.63 1.63 0.90 0.87 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 44 G 6.86 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 0.00 0.00 0.00 0.00 0.00 0.00 45 L 5.99 3.35 0.00 1.76 1.74 1.01 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 46 R 8.43 4.38 0.00 2.25 1.94 0.00 3.36 0.00 0.00 3.06 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.57 0.00 47 R 7.76 3.67 0.00 1.82 1.85 0.00 3.21 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.72 0.00 48 L 8.53 4.28 0.00 1.73 1.41 0.86 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 49 A 8.37 4.16 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 50 Y 6.44 4.93 0.00 3.08 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 P 0.00 4.26 0.00 2.26 2.26 0.00 3.92 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 2.09 2.06 0.00 52 I 8.17 4.14 1.86 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.86 0.96 0.00 0.00 53 A 8.68 3.46 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 K 7.72 3.90 0.00 1.95 1.85 0.00 1.79 0.00 0.00 1.72 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.33 1.40 7.81 55 D 7.80 4.37 0.00 2.70 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 P 0.00 4.57 0.00 2.22 2.29 0.00 3.64 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.99 0.00 57 Q 7.14 4.91 0.00 1.87 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.79 0.00 0.00 0.00 0.00 0.00 2.29 2.27 0.00 58 G 8.02 3.51 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 59 Y 8.55 3.94 0.00 3.05 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 F 8.28 4.82 0.00 3.07 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 61 L 8.22 5.35 0.00 1.71 1.83 1.17 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 62 W 7.73 4.51 0.00 3.39 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 63 Y 8.63 4.54 0.00 2.64 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 64 Q 6.36 3.78 0.00 1.35 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.76 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 65 V 8.75 4.87 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 0.60 0.00 0.00 0.98 0.00 0.00 66 E 8.93 5.74 0.00 2.25 1.83 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 2.22 2.08 0.00 67 M 8.77 5.66 0.00 2.07 2.16 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.15 0.00 68 P 0.00 4.58 0.00 2.16 2.10 0.00 3.88 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00 69 E 8.51 4.08 0.00 2.18 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.26 0.00 70 D 7.54 4.36 0.00 2.76 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 71 R 8.21 4.22 0.00 1.70 1.68 0.00 2.21 0.00 0.00 2.90 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.34 0.00 72 V 8.14 3.45 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 1.04 0.00 0.00 0.62 0.00 0.00 73 N 8.04 4.39 0.00 2.73 2.90 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 74 D 7.93 4.31 0.00 2.64 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 75 L 8.21 4.10 0.00 2.00 1.92 0.92 1.03 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 76 A 8.04 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 77 R 8.07 3.93 0.00 1.95 2.06 0.00 3.14 0.00 0.00 3.10 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.64 0.00 78 E 8.27 3.79 0.00 2.13 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 2.11 2.36 0.00 79 L 7.48 3.95 0.00 1.64 1.67 0.85 1.01 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 80 R 8.54 4.10 0.00 1.75 2.00 0.00 3.21 0.00 0.00 3.24 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.78 0.00 81 I 7.74 3.64 1.98 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.65 0.90 0.00 0.00 82 R 7.70 3.80 0.00 1.82 2.11 0.00 3.29 0.00 0.00 3.30 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.62 0.00 83 D 8.84 4.25 0.00 2.65 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 84 N 8.16 4.33 0.00 2.91 2.84 0.00 0.00 6.74 7.68 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 85 V 8.42 4.66 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 0.97 0.00 0.00 0.98 0.00 0.00 86 R 8.78 4.16 0.00 1.73 1.98 0.00 3.28 0.00 0.00 3.29 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.58 0.00 87 R 7.55 4.56 0.00 2.00 1.83 0.00 3.24 0.00 0.00 3.20 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.41 0.00 88 V 8.11 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 0.78 0.00 0.00 0.95 0.00 0.00 89 M 8.81 4.87 0.00 2.20 1.94 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.56 0.00 90 V 8.02 3.96 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 0.68 0.00 0.00 0.88 0.00 0.00 91 V 8.54 4.71 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 1.01 0.00 0.00 1.12 0.00 0.00 92 K 8.66 4.37 0.00 1.66 1.63 0.00 1.66 0.00 0.00 1.44 0.00 0.00 2.74 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.21 1.10 7.81 93 S 9.23 4.78 0.00 3.79 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 94 Q 8.25 4.50 0.00 2.02 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 7.00 0.00 0.00 0.00 0.00 0.00 2.24 2.36 0.00 95 E 8.67 4.02 0.00 1.89 1.90 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 2.30 2.31 0.00 96 P 0.00 4.30 0.00 2.07 2.11 0.00 3.71 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.15 0.00 97 F 8.43 5.20 0.00 2.85 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 98 L 8.70 4.74 0.00 1.71 1.61 0.96 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 99 A 8.20 4.27 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 N 8.62 4.04 0.00 2.81 2.83 0.00 0.00 6.88 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 0.00 101 A 7.91 4.18 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