NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 D 4.6108 8.3649 120.3169 52.8265 41.0758 174.8355 4 V 3.8225 7.7755 113.4023 61.4701 32.1328 174.0139 5 A 4.8159 9.1732 126.4714 49.9504 23.6445 174.5852 6 I 4.1205 8.3269 120.5978 61.6769 37.2448 176.3453 7 V 3.9410 9.1236 127.8251 64.9971 32.4718 176.0738 8 K 4.5454 7.6176 118.8539 55.3362 35.2687 174.0574 9 E 5.2175 8.4696 122.8976 54.4493 32.9813 174.4559 10 G 4.0460 7.5773 108.0399 46.1965 0.0000 171.2422 11 W 5.1831 8.7509 119.6856 56.4131 30.1605 176.5073 12 L 4.8962 9.3754 122.6010 53.4688 46.2326 175.2851 13 H 5.3016 9.1619 119.9421 54.9637 30.0395 174.0179 14 K 4.7965 9.3461 126.2940 54.5923 34.2190 175.1772 15 R 3.7390 7.7187 128.1833 55.0613 30.5636 176.4257 16 G 3.5890 8.2548 113.5864 46.3014 0.0000 173.6142 17 E 3.8795 8.4580 120.6485 58.3467 29.9075 177.4535 18 Y 4.3568 7.4292 113.8605 59.4798 39.4087 176.3340 19 I 4.1448 7.4355 126.6032 60.0311 36.6464 177.3535 20 K 4.1795 8.3988 124.4681 56.7672 31.2495 177.6672 21 T 4.4433 8.0578 110.9458 61.0442 70.9127 172.9608 22 W 5.2318 8.7517 121.2114 55.0986 31.3334 176.0108 23 R 4.9938 9.1322 122.7412 53.5467 34.0582 172.8629 24 P 5.1423 0.0000 0.0000 63.1214 32.3089 175.8390 25 R 5.1043 9.8044 122.1212 54.7448 34.9667 173.5308 26 Y 4.1299 8.9456 125.0940 56.3696 39.8596 174.2419 27 F 4.9590 8.5270 126.0234 55.6773 42.3373 174.9705 28 L 5.2872 8.7119 120.8840 53.0448 45.4521 175.0918 29 L 5.4326 9.4712 126.6867 53.5589 44.1512 175.4396 30 K 5.0850 9.0481 125.8716 54.5803 34.8903 176.8851 31 N 4.5124 8.9935 120.2450 55.0410 38.8721 175.2126 32 D 4.6168 7.9059 115.6172 53.8899 40.2225 177.0858 33 G 4.0118 8.2297 109.6164 45.4166 0.0000 173.8195 34 T 4.1520 8.4879 118.0825 63.8630 69.6791 173.1292 35 F 5.4823 8.9116 128.0476 56.5671 42.2138 173.0605 36 I 4.5980 8.5726 127.0769 58.8471 40.9736 174.2767 37 G 2.7522 8.0292 115.8489 43.9044 0.0000 171.3617 38 Y 4.9869 8.4803 120.6461 55.5335 41.4778 177.0075 39 K 4.1919 8.9724 122.4790 58.8638 32.6851 176.9036 40 E 5.0399 7.8058 115.2877 53.7578 33.2340 175.2295 41 R 3.1529 8.4785 121.1992 55.5462 30.3455 174.6665 42 P 3.8491 0.0000 0.0000 62.8871 31.9166 175.0536 43 Q 4.5333 8.0339 120.6041 54.5949 31.9167 175.7861 44 D 4.6657 8.1005 122.6226 51.8908 39.7098 176.0373 45 V 4.4003 6.7792 119.0496 61.7635 34.7572 173.7171 46 D 4.6068 8.6056 123.4265 56.0680 40.7866 177.4686 47 Q 4.2049 7.9017 118.0412 57.1943 29.3902 176.4659 48 R 3.7584 7.5754 113.6097 56.1589 29.5055 176.0300 49 E 4.0109 8.7598 122.1311 56.1053 30.2250 176.2629 50 A 4.3124 8.2661 126.2619 51.1214 19.2156 175.8461 51 P 3.9547 0.0000 0.0000 62.4349 32.0762 176.3864 52 L 4.3641 7.9270 118.7509 55.9199 42.6114 176.9061 53 N 5.0836 7.4478 115.6522 51.4905 42.9399 173.5514 54 N 5.0466 8.9582 121.3320 53.4746 40.9385 173.1156 55 F 5.0582 8.8156 121.0003 55.6842 41.7393 173.6255 56 S 4.8193 8.8237 115.7966 58.2537 63.1724 174.3110 57 V 4.1461 8.5639 119.2768 61.2097 31.8541 176.0399 58 A 4.1871 7.6845 124.2645 53.6539 18.5347 177.7435 59 Q 3.6349 8.7690 119.2846 56.7598 26.4408 174.0981 60 C 4.9623 7.9356 115.4724 55.9056 40.0385 172.6263 61 Q 4.8279 9.2514 121.7360 54.4499 31.4604 173.9740 62 L 5.3094 8.4996 124.9750 53.4997 43.7135 175.6929 63 M 4.9895 9.2829 122.7927 53.4392 36.1335 174.5693 64 K 5.2118 8.6818 120.2079 55.2273 35.3337 175.2055 65 T 4.7783 8.9796 117.0757 61.1402 71.3648 173.6918 66 E 4.8266 8.9450 121.5213 55.9022 31.0403 176.3694 67 R 4.7707 7.5709 116.5421 53.5428 33.5739 173.9963 68 P 4.4125 0.0000 0.0000 64.4195 31.9112 176.4126 69 R 4.4230 7.5621 118.0642 53.1535 32.0521 174.0591 70 P 4.6039 0.0000 0.0000 63.3645 31.9577 174.9518 71 N 4.2789 8.9386 113.2227 54.9008 36.7378 174.0999 72 T 5.0827 7.8490 113.7314 62.1766 71.1570 174.7561 73 F 5.5720 9.1326 119.8333 55.2401 41.7125 173.5810 74 I 5.0102 9.3675 121.7720 59.6835 40.6985 174.3869 75 I 4.8911 8.9702 127.6665 59.7627 39.3150 174.4557 76 R 5.0558 9.2080 128.4618 54.6245 32.8387 173.7640 77 C 5.1528 9.4141 123.3201 55.2690 44.1003 173.3562 78 L 4.6454 8.7138 124.0088 53.7487 41.4486 175.8543 79 Q 4.0753 8.8864 124.0726 54.2169 29.6507 179.0397 80 W 3.9503 9.8958 128.4898 58.1371 26.8507 176.1489 81 T 4.5087 9.4603 118.2021 62.4613 70.1092 174.7164 82 T 4.3326 7.8994 120.6017 62.3165 69.7355 173.4913 83 V 4.6120 8.1928 125.7823 61.4100 33.1176 174.6464 84 I 4.2595 8.7236 130.0012 59.9596 38.9674 174.6343 85 E 4.9380 8.4129 126.7547 54.4744 32.5081 174.4459 86 R 4.2729 8.9540 126.0105 54.4851 33.4471 174.6214 87 T 4.7139 7.6059 119.9801 61.6218 71.2697 173.3558 88 F 5.4016 8.7135 123.8283 55.9426 43.7401 173.3110 89 H 5.4738 9.6828 120.2410 54.7675 33.2434 172.5594 90 V 4.8467 8.0331 116.7754 59.3416 35.0213 175.7023 91 E 4.0579 9.0856 123.3033 58.4753 30.2253 177.5160 92 T 4.8078 7.5508 108.2409 58.4875 73.1492 173.1267 93 P 4.5106 0.0000 0.0000 65.4760 31.3629 178.6500 94 E 3.9818 8.1484 118.1576 59.4033 29.4691 178.8957 95 E 4.0576 8.1426 118.1803 59.3650 29.5242 179.3931 96 R 3.9808 8.0482 118.4671 59.4168 30.1310 178.2060 97 E 4.0680 8.2637 120.5283 58.4241 29.5393 178.2725 98 E 3.7813 8.0588 119.4523 59.1431 29.6125 179.0316 99 W 3.8798 8.0425 118.9474 59.8644 28.9354 178.7332 100 T 3.6230 8.0319 110.1558 65.0257 68.0474 176.6264 101 T 3.7861 8.0220 118.3975 66.1093 68.4588 176.4733 102 A 3.8605 7.6035 122.1914 55.2354 18.3485 179.7289 103 I 3.4829 7.8125 118.4908 64.5798 37.0981 178.5058 104 Q 3.9114 8.2997 120.6554 59.4283 28.8433 178.4811 105 T 3.8381 8.0156 116.9113 66.4703 68.4564 176.9029 106 V 3.5356 7.7380 119.9455 65.8935 31.5001 177.9243 107 A 3.9811 8.1754 120.7220 55.3437 18.2154 179.3397 108 D 4.3825 8.5625 117.9534 57.3828 40.9622 179.2324 109 G 3.6245 8.1948 106.2419 47.9143 0.0000 175.8061 110 L 4.0775 7.9858 121.5163 57.2227 41.5199 179.4966 111 K 3.9527 8.3011 120.0869 59.1665 32.1021 178.8016 112 K 4.0469 8.2078 120.1101 59.5974 31.7836 178.5935 113 Q 3.9580 7.9698 119.3809 58.9752 28.8568 177.7726 114 E 3.9441 8.2858 120.4313 59.4162 29.6719 178.6112 115 E 3.9066 8.3661 118.7397 59.5736 29.3278 179.2746 116 E 3.9828 8.0517 117.1234 58.5660 29.4828 178.2173 117 E 4.2667 7.5258 118.1920 58.3675 30.2693 177.2891 118 M 4.2270 8.0913 117.2180 55.7770 32.7677 176.4288 119 D 4.0659 7.7512 119.5251 54.9864 42.0273 176.4597 120 F 4.0367 7.9769 121.9382 58.7373 36.6503 175.7817 121 R 4.1497 7.7881 121.9214 56.6333 29.8721 177.3409 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 3 D 8.36 4.61 0.00 2.80 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 4 V 7.78 3.82 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 0.71 0.00 0.00 0.94 0.00 0.00 5 A 9.17 4.82 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 0.00 0.00 6 I 8.33 4.12 1.88 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.60 0.96 0.00 0.00 7 V 9.12 3.94 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 0.62 0.00 0.00 0.90 0.00 0.00 8 K 7.62 4.55 0.00 1.50 1.18 0.00 1.03 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.30 0.82 7.81 9 E 8.47 5.22 0.00 1.92 1.88 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 2.19 2.38 0.00 10 G 7.58 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 11 W 8.75 5.18 0.00 3.34 3.25 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 0.00 12 L 9.38 4.90 0.00 1.52 1.47 -0.51 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 13 H 9.16 5.30 0.00 3.48 3.54 0.00 5.59 0.00 0.00 0.00 0.00 6.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 K 9.35 4.80 0.00 2.02 1.77 0.00 2.00 0.00 0.00 1.68 0.00 0.00 2.55 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.04 0.75 7.81 15 R 7.72 3.74 0.00 0.67 0.85 0.00 2.48 0.00 0.00 2.72 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.50 0.00 16 G 8.25 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 17 E 8.46 3.88 0.00 1.34 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 1.93 2.01 0.00 18 Y 7.43 4.36 0.00 2.96 2.92 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 19 I 7.44 4.14 1.86 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.65 0.93 0.00 0.00 20 K 8.40 4.18 0.00 1.64 1.72 0.00 1.60 0.00 0.00 1.63 0.00 0.00 3.00 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.32 1.25 7.81 21 T 8.06 4.44 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 1.23 0.00 0.00 22 W 8.75 5.23 0.00 3.13 3.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 R 9.13 4.99 0.00 1.75 1.87 0.00 3.36 0.00 0.00 3.30 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.74 0.00 24 P 0.00 5.14 0.00 2.10 2.10 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 2.10 2.01 0.00 25 R 9.80 5.10 0.00 2.14 1.88 0.00 3.29 0.00 0.00 3.22 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.95 0.00 26 Y 8.95 4.13 0.00 1.43 2.40 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 27 F 8.53 4.96 0.00 2.58 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 L 8.71 5.29 0.00 1.67 1.61 1.10 0.73 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 29 L 9.47 5.43 0.00 2.11 1.84 0.83 0.44 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 30 K 9.05 5.09 0.00 1.89 1.70 0.00 1.75 0.00 0.00 1.60 0.00 0.00 2.82 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.42 7.81 31 N 8.99 4.51 0.00 2.65 2.82 0.00 0.00 7.10 8.43 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 32 D 7.91 4.62 0.00 2.83 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 33 G 8.23 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 0.00 0.00 0.00 34 T 8.49 4.15 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 1.23 0.00 0.00 35 F 8.91 5.48 0.00 2.72 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 0.00 0.00 0.00 0.00 36 I 8.57 4.60 1.76 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.40 1.33 0.96 0.00 0.00 37 G 8.03 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 0.00 0.00 0.00 38 Y 8.48 4.99 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 39 K 8.97 4.19 0.00 1.79 1.93 0.00 1.77 0.00 0.00 1.77 0.00 0.00 3.00 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.54 1.57 7.81 40 E 7.81 5.04 0.00 1.98 1.85 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 2.31 2.27 0.00 41 R 8.48 3.15 0.00 1.28 1.56 0.00 2.61 0.00 0.00 2.96 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.50 0.00 42 P 0.00 3.85 0.00 1.74 1.44 0.00 3.25 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.56 0.00 43 Q 8.03 4.53 0.00 1.88 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.49 0.00 0.00 0.00 0.00 0.00 2.19 2.35 0.00 44 D 8.10 4.67 0.00 2.67 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 45 V 6.78 4.40 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.91 0.00 0.00 46 D 8.61 4.61 0.00 2.71 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 47 Q 7.90 4.20 0.00 2.03 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.76 0.00 0.00 0.00 0.00 0.00 2.33 2.33 0.00 48 R 7.58 3.76 0.00 1.86 2.00 0.00 2.92 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.64 0.00 49 E 8.76 4.01 0.00 1.98 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 2.34 2.35 0.00 50 A 8.27 4.31 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 51 P 0.00 3.95 0.00 1.79 0.61 0.00 3.67 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 1.75 1.70 0.00 52 L 7.93 4.36 0.00 1.47 1.73 0.95 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 53 N 7.45 5.08 0.00 2.48 2.98 0.00 0.00 6.58 6.92 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 54 N 8.96 5.05 0.00 2.57 2.69 0.00 0.00 6.88 7.02 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 55 F 8.82 5.06 0.00 3.21 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 56 S 8.82 4.82 0.00 3.89 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 57 V 8.56 4.15 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 0.43 0.00 0.00 0.94 0.00 0.00 58 A 7.68 4.19 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 59 Q 8.77 3.63 0.00 2.27 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.83 0.00 0.00 0.00 0.00 0.00 2.30 2.41 0.00 60 C 7.94 4.96 0.00 3.01 3.20 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 61 Q 9.25 4.83 0.00 2.09 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.79 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 62 L 8.50 5.31 0.00 1.58 1.62 0.89 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 63 M 9.28 4.99 0.00 1.95 1.96 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 2.54 2.51 0.00 64 K 8.68 5.21 0.00 1.66 1.76 0.00 1.76 0.00 0.00 1.68 0.00 0.00 2.79 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.46 7.81 65 T 8.98 4.78 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 1.33 0.00 0.00 66 E 8.94 4.83 0.00 1.97 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 2.22 2.25 0.00 67 R 7.57 4.77 0.00 1.81 1.79 0.00 3.32 0.00 0.00 3.27 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.68 0.00 68 P 0.00 4.41 0.00 2.20 2.22 0.00 3.88 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.14 0.00 69 R 7.56 4.42 0.00 1.30 1.25 0.00 2.21 0.00 0.00 2.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 1.06 0.00 70 P 0.00 4.60 0.00 2.19 2.05 0.00 3.76 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 71 N 8.94 4.28 0.00 3.15 3.00 0.00 0.00 7.30 6.45 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 72 T 7.85 5.08 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 1.45 0.00 0.00 73 F 9.13 5.57 0.00 3.13 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 I 9.37 5.01 1.92 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.87 0.99 0.00 0.00 75 I 8.97 4.89 2.16 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.23 1.11 0.00 0.00 76 R 9.21 5.06 0.00 1.81 1.76 0.00 3.22 0.00 0.00 3.16 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.54 0.00 77 C 9.41 5.15 0.00 2.75 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 78 L 8.71 4.65 0.00 1.58 1.70 0.95 0.94 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 79 Q 8.89 4.08 0.00 1.80 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.50 5.68 0.00 0.00 0.00 0.00 0.00 1.71 2.06 0.00 80 W 9.90 3.95 0.00 3.38 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 T 9.46 4.51 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 1.29 0.00 0.00 82 T 7.90 4.33 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 1.14 0.00 0.00 83 V 8.19 4.61 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 0.76 0.00 0.00 0.92 0.00 0.00 84 I 8.72 4.26 1.73 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.56 0.62 0.00 0.00 85 E 8.41 4.94 0.00 1.80 1.61 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 2.03 2.22 0.00 86 R 8.95 4.27 0.00 1.71 1.51 0.00 2.94 0.00 0.00 2.91 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.50 0.00 87 T 7.61 4.71 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 1.14 0.00 0.00 88 F 8.71 5.40 0.00 1.51 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 0.00 0.00 0.00 0.00 89 H 9.68 5.47 0.00 2.87 2.96 0.00 5.72 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 V 8.03 4.85 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 1.26 0.00 0.00 91 E 9.09 4.06 0.00 1.96 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 2.31 2.31 0.00 92 T 7.55 4.81 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 1.28 0.00 0.00 93 P 0.00 4.51 0.00 2.31 2.47 0.00 3.89 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 2.09 1.93 0.00 94 E 8.15 3.98 0.00 2.10 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.47 0.00 95 E 8.14 4.06 0.00 2.32 2.20 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 2.42 2.38 0.00 96 R 8.05 3.98 0.00 2.07 2.15 0.00 3.38 0.00 0.00 3.38 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.75 0.00 97 E 8.26 4.07 0.00 2.27 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 2.29 2.18 0.00 98 E 8.06 3.78 0.00 2.19 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 0.00 1.96 2.19 0.00 99 W 8.04 3.88 0.00 3.09 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.03 3.62 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 0.90 0.00 0.00 101 T 8.02 3.79 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 1.14 0.00 0.00 102 A 7.60 3.86 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 0.00 0.00 103 I 7.81 3.48 1.74 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.65 0.76 0.00 0.00 104 Q 8.30 3.91 0.00 2.21 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.58 0.00 105 T 8.02 3.84 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 1.17 0.00 0.00 106 V 7.74 3.54 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 1.03 0.00 0.00 0.95 0.00 0.00 107 A 8.18 3.98 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 0.00 108 D 8.56 4.38 0.00 2.84 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 0.00 109 G 8.19 3.62 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 0.00 0.00 0.00 110 L 7.99 4.08 0.00 1.88 1.74 0.96 0.92 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 0.00 111 K 8.30 3.95 0.00 1.92 1.96 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.45 7.81 112 K 8.21 4.05 0.00 2.02 1.98 0.00 1.58 0.00 0.00 1.57 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.44 1.49 7.81 113 Q 7.97 3.96 0.00 2.19 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.58 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 114 E 8.29 3.94 0.00 2.09 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 0.00 2.30 2.36 0.00 115 E 8.37 3.91 0.00 2.15 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 2.30 2.68 0.00 116 E 8.05 3.98 0.00 2.11 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 2.36 2.50 0.00 117 E 7.53 4.27 0.00 1.96 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 2.27 2.34 0.00 118 M 8.09 4.23 0.00 1.96 2.05 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.82 0.00 119 D 7.75 4.07 0.00 2.59 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 0.00 0.00 0.00 120 F 7.98 4.04 0.00 3.17 2.98 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 0.00 121 R 7.79 4.15 0.00 1.82 1.86 0.00 3.29 0.00 0.00 3.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.76 0.00