NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.4308 8.2649 122.4708 52.1128 18.8469 176.8788 3 T 4.1419 7.9326 119.9264 62.6749 70.5452 174.4981 4 K 5.3211 9.0396 125.4039 54.7785 37.1528 174.5732 5 A 5.4128 8.9513 123.7399 50.7269 23.4141 175.0659 6 V 4.9906 9.0263 117.3938 61.0121 35.4988 173.4176 7 C 4.8530 8.9630 121.9478 58.2609 35.2590 172.8412 8 V 4.4459 8.4771 126.7003 61.5553 32.3614 174.4754 9 L 4.5002 8.7239 129.8160 54.5419 42.7310 176.6908 10 K 4.8417 9.1734 122.5637 55.6258 37.3642 175.4060 11 G 4.1403 7.9311 106.9746 46.9833 0.0000 172.8639 12 D 4.5803 9.0940 119.1164 56.4051 41.1185 176.6288 13 G 4.3832 7.5715 108.6743 43.5114 0.0000 171.5770 14 P 4.0912 0.0000 0.0000 64.5457 31.8453 176.6177 15 V 4.0926 7.0559 120.7192 63.1150 31.8038 175.1219 16 Q 4.7347 8.3292 124.5935 55.3804 32.4978 173.3133 17 G 4.1817 7.8328 106.9622 46.4900 0.0000 171.7299 18 I 5.1184 7.7705 119.2744 59.3934 40.9834 175.1869 19 I 4.7167 8.7036 126.8759 59.5437 40.5965 174.3627 20 N 4.9116 8.8435 125.0675 51.5484 40.9864 174.0147 21 F 5.2884 8.9598 119.9535 55.9731 43.3581 174.4860 22 E 5.0006 9.4250 123.4181 55.7051 32.7975 173.6810 23 Q 4.8481 9.0250 130.3575 54.3412 30.0934 176.3138 24 K 4.0986 8.9104 127.3760 58.7834 32.6486 177.8300 25 E 4.7563 7.8367 117.1000 54.0319 33.2481 176.2133 26 S 3.9340 9.0591 118.1415 61.4459 62.7329 175.0280 27 N 4.5994 8.1764 114.8392 52.5634 37.6261 174.3777 28 G 4.1208 8.3412 109.7911 43.1904 0.0000 171.3024 29 P 4.6950 0.0000 0.0000 62.4792 32.9342 175.9292 30 V 4.5661 8.7806 121.1881 61.1115 33.6085 174.8332 31 K 4.6123 8.9536 128.6938 56.2385 33.5328 176.2202 32 V 4.8948 8.9047 125.0788 60.7941 33.9798 174.3219 33 W 5.5426 8.7718 124.0176 54.9493 32.2264 175.3356 34 G 3.8189 7.3578 106.2023 46.0921 0.0000 170.5554 35 S 4.8673 7.8393 114.9159 56.9820 65.7243 174.2649 36 I 4.9409 8.4921 128.3836 59.5373 39.8662 174.8925 37 K 4.7970 8.9057 124.4082 55.8806 36.7001 176.8126 38 G 3.6947 8.8279 105.8006 45.9251 0.0000 173.2609 39 L 4.4605 7.7282 119.8097 52.8537 42.9202 176.5423 40 T 4.2761 8.2902 112.8061 61.1973 69.3532 173.8542 41 E 3.8964 8.6752 125.8780 57.3798 30.6899 174.9882 42 G 3.8447 8.4878 110.6070 43.9692 0.0000 172.6479 43 L 4.6589 8.2598 119.6743 55.1318 42.7343 176.5789 44 H 5.0900 9.2852 119.0343 53.7508 33.3667 173.4458 45 G 4.0449 8.9443 110.0521 46.8922 0.0000 172.9641 46 F 5.0632 8.4126 125.0683 57.6779 41.7888 172.5633 47 H 5.2488 8.9036 122.6368 53.8118 33.7378 172.6911 48 V 4.4168 8.6272 121.3633 62.3382 32.9285 175.2381 49 H 5.1246 9.4116 125.6386 54.5546 30.7335 176.0853 50 E 3.7751 8.9548 121.7172 59.0792 29.6074 177.0344 51 F 5.0539 8.0400 118.5411 55.8289 40.7948 176.3530 52 G 4.1196 8.5140 113.0220 44.8985 0.0000 173.0345 53 D 4.7743 8.1252 119.1479 52.3815 42.8804 174.8400 54 N 5.2429 8.4365 122.5128 52.7295 39.3687 175.5102 55 T 3.7263 8.2589 113.3123 66.5669 69.0238 175.5291 56 A 4.6147 8.5007 124.9526 51.6409 19.9149 177.8406 57 G 3.9123 7.8766 110.8258 46.8010 0.0000 174.7961 58 C 4.3684 8.6485 115.3638 59.9581 37.8940 175.7245 59 T 3.7761 7.9162 117.2254 66.6031 67.7862 176.4462 60 S 4.1983 8.0838 115.5715 61.0439 63.1231 175.8501 61 A 4.5168 7.4252 124.6810 54.3659 18.1942 178.5396 62 G 4.1911 8.0404 105.0973 44.6579 0.0000 170.4735 63 P 4.7721 0.0000 0.0000 61.7323 34.2598 174.9944 64 H 4.2123 8.6287 116.5508 55.9298 29.3714 175.5347 65 F 4.2645 9.0308 126.0007 58.3535 40.0166 174.8090 66 N 5.1574 7.9764 125.3880 51.8064 39.1101 172.6712 67 P 4.1526 0.0000 0.0000 64.7550 32.3960 178.0050 68 L 4.2974 7.6276 116.9389 53.8690 41.7711 176.3365 69 S 3.6110 7.3715 113.4241 59.9436 60.6308 171.6556 70 R 4.5551 8.2028 118.1609 54.3672 32.6498 176.2126 71 K 4.4688 7.9682 118.3783 55.7775 33.1973 177.0908 72 H 3.9319 8.8930 122.8394 56.9059 30.6388 174.4398 73 G 3.8808 7.5781 108.6490 45.8829 0.0000 172.9940 74 G 4.0480 8.5125 109.2109 43.8842 0.0000 173.3446 75 P 4.2670 0.0000 0.0000 65.5400 31.4654 178.2384 76 K 4.1216 7.9961 117.2784 58.7850 32.2976 177.4114 77 D 4.4529 7.3866 118.2495 54.5160 41.3807 176.3789 78 E 3.9589 8.7761 124.2086 59.3881 29.8421 177.7919 79 E 4.2109 7.8522 122.2691 55.6301 27.7323 175.1997 80 R 4.7016 7.5883 119.3312 53.9650 33.2511 175.1305 81 H 4.4820 8.9019 115.9925 55.2448 29.4079 177.0675 82 V 3.4292 8.3441 122.8032 66.0333 31.4301 177.0976 83 G 3.9347 8.1537 106.4193 45.7641 0.0000 173.1235 84 D 4.8119 7.8791 120.8568 53.8917 39.2398 175.6710 85 L 4.5351 8.2082 121.8116 53.9786 43.1284 178.8632 86 G 4.0093 7.9016 108.6170 46.8265 0.0000 174.1025 87 N 5.6353 8.7234 121.2353 51.3667 41.7579 173.6794 88 V 4.4268 9.1089 113.7759 59.9210 35.4118 174.7480 89 T 4.9275 8.4135 120.3595 61.9644 70.7776 173.1044 90 A 5.0504 9.0602 129.0692 50.3100 21.3434 176.0381 91 D 4.7714 9.4332 122.6822 53.0505 41.5418 179.0549 92 K 4.5742 8.0211 117.1347 59.3799 32.7141 176.6841 93 D 4.5950 7.8979 116.2951 53.6141 39.5422 177.2726 94 G 4.3847 9.0811 108.6354 44.6666 0.0000 173.1511 95 V 4.6960 7.6772 119.8342 61.1863 33.8001 174.5621 96 A 4.9234 9.1369 129.3369 49.4889 21.1136 175.0434 97 D 4.9025 8.6268 122.7628 53.8990 40.4575 175.8473 98 V 3.5999 8.3711 123.7638 62.8919 32.8643 175.1358 99 S 5.1020 8.5677 122.2453 57.4038 63.3002 172.6397 100 I 4.6703 8.9434 126.1321 59.0955 40.5724 173.8992 101 E 5.0731 8.5604 123.8171 54.8108 32.4390 173.9909 102 D 4.9994 9.1476 125.4188 52.9379 44.8195 175.7661 103 S 4.8256 8.8518 117.7921 58.6740 65.1285 175.9135 104 V 3.8301 8.1137 119.8382 65.3764 31.5966 176.4857 105 I 4.0856 7.6181 111.4409 61.1957 38.2021 174.8245 106 S 4.6469 8.1963 113.7720 57.6410 65.0045 174.0304 107 L 4.7872 8.3139 124.5428 54.1011 41.4627 176.7758 108 S 4.5112 7.8921 110.7016 58.7762 66.6660 175.8685 109 G 3.9015 8.6598 108.9939 44.4318 0.0000 173.8514 110 D 4.3413 8.8227 118.5049 57.9394 41.2251 177.8085 111 H 4.7899 8.1456 112.3054 55.7582 28.8209 174.5293 112 C 4.2852 7.8701 121.4389 59.9831 31.4862 173.5372 113 I 3.7686 8.5202 120.7219 61.3833 38.0376 175.9897 114 I 3.7010 7.2588 123.0664 62.7429 37.3226 176.2345 115 G 3.8255 9.1486 113.2531 45.1712 0.0000 172.6678 116 R 4.5911 7.4912 118.4252 54.6040 33.8336 174.6517 117 T 4.8476 7.8143 115.4103 62.2824 70.4263 174.4408 118 L 4.7068 8.6590 128.4436 54.3603 44.4485 175.6506 119 V 4.8963 8.4103 124.4105 61.6911 35.0740 173.7703 120 V 4.9924 8.8527 127.9090 60.8582 33.7323 174.7115 121 H 5.1726 8.5458 119.0595 53.9735 31.5711 173.6753 122 E 4.0669 9.2820 121.3670 59.1539 29.5215 177.9563 123 K 4.6088 8.6151 117.9462 54.6782 35.3051 174.7705 124 A 4.6540 8.2672 121.7887 51.6936 20.1490 176.4479 125 D 4.8282 9.3513 122.2169 53.8836 41.3339 175.9599 126 D 4.6194 9.3994 125.1637 53.0285 39.5662 176.5116 127 L 3.3772 9.1179 118.1304 56.1066 39.6624 175.9228 128 G 4.2205 8.8168 105.9342 45.8702 0.0000 174.7970 129 K 4.4816 7.8370 118.4789 56.4520 32.1375 178.2314 130 G 3.7171 7.3080 110.3435 45.8391 0.0000 174.9152 131 G 4.0743 8.4365 107.4242 45.2683 0.0000 173.3369 132 N 4.7059 7.5332 115.6352 51.3864 39.0034 174.8130 133 E 4.0363 8.7270 118.3829 59.3852 29.9070 178.4590 134 E 3.9520 8.1802 118.5977 59.1074 29.6678 178.4109 135 S 4.0702 9.3887 114.2554 61.3134 62.3501 175.7088 136 T 4.1782 7.8392 117.5631 65.0665 67.9603 174.8219 137 K 4.3460 8.0223 118.0369 57.2997 34.4882 177.2328 138 T 3.8682 7.6758 107.9860 61.1989 70.0156 175.8841 139 G 3.7651 7.9221 110.1192 44.9036 0.0000 173.3080 140 N 4.2936 7.8554 113.5182 54.0523 36.7718 174.9268 141 A 4.4875 7.3778 118.7587 51.6641 19.4764 179.7207 142 G 3.7634 7.9905 103.7605 44.5415 0.0000 173.1049 143 S 4.4109 8.5856 114.9181 58.4656 64.9482 173.9305 144 R 4.4007 8.2552 119.3251 55.0847 30.0742 176.8774 145 L 4.2577 8.6019 124.8392 57.2334 42.7202 177.2743 146 A 5.0971 7.7620 119.1715 50.8114 22.9511 173.4761 147 C 5.1900 9.4488 114.8520 54.8398 47.0789 172.7463 148 G 4.5401 8.4465 103.4766 46.0774 0.0000 172.9877 149 V 4.3021 8.3594 122.2347 62.3429 32.7036 175.5369 150 I 4.0024 9.1567 129.6875 60.9907 38.1457 175.2836 151 G 4.4501 9.0402 114.3201 43.9213 0.0000 172.0192 152 I 4.3324 8.3610 122.0592 61.0812 37.6654 175.3779 153 A 4.8229 8.3080 127.6239 49.6659 22.2668 176.1087 154 Q 4.0697 8.5083 118.6661 56.4503 29.2231 175.9050 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 A 8.26 4.43 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 3 T 7.93 4.14 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 1.22 0.00 0.00 4 K 9.04 5.32 0.00 1.71 1.72 0.00 1.87 0.00 0.00 1.98 0.00 0.00 3.07 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.55 1.49 7.81 5 A 8.95 5.41 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 V 9.03 4.99 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 0.80 0.00 0.00 0.89 0.00 0.00 7 C 8.96 4.85 0.00 3.10 2.94 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 8 V 8.48 4.45 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 0.93 0.00 0.00 0.92 0.00 0.00 9 L 8.72 4.50 0.00 1.79 1.60 1.04 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 10 K 9.17 4.84 0.00 1.62 1.63 0.00 1.69 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.35 1.39 7.81 11 G 7.93 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 12 D 9.09 4.58 0.00 2.68 2.74 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 13 G 7.57 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 0.00 0.00 0.00 0.00 14 P 0.00 4.09 0.00 2.18 2.18 0.00 3.77 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 1.98 1.94 0.00 15 V 7.06 4.09 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 0.74 0.00 0.00 0.95 0.00 0.00 16 Q 8.33 4.73 0.00 2.14 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.55 0.00 0.00 0.00 0.00 0.00 2.43 2.30 0.00 17 G 7.83 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 0.00 0.00 0.00 0.00 18 I 7.77 5.12 1.82 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 1.20 0.93 0.80 0.00 0.00 19 I 8.70 4.72 1.88 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 1.24 1.51 0.57 0.00 0.00 20 N 8.84 4.91 0.00 1.44 1.42 0.00 0.00 6.41 8.01 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 21 F 8.96 5.29 0.00 2.91 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 22 E 9.42 5.00 0.00 2.46 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.40 0.00 23 Q 9.03 4.85 0.00 2.25 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.58 0.00 0.00 0.00 0.00 0.00 2.42 2.52 0.00 24 K 8.91 4.10 0.00 1.81 1.88 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.48 1.49 7.81 25 E 7.84 4.76 0.00 1.98 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.28 0.00 26 S 9.06 3.93 0.00 3.98 4.04 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 27 N 8.18 4.60 0.00 2.85 2.97 0.00 0.00 5.84 7.00 0.00 0.00 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 G 8.34 4.12 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 0.00 29 P 0.00 4.70 0.00 2.13 2.09 0.00 3.75 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 30 V 8.78 4.57 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 1.03 0.00 0.00 31 K 8.95 4.61 0.00 1.91 1.82 0.00 1.57 0.00 0.00 1.48 0.00 0.00 2.77 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.49 1.42 7.81 32 V 8.90 4.89 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 0.75 0.00 0.00 1.00 0.00 0.00 33 W 8.77 5.54 0.00 3.46 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 34 G 7.36 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 S 7.84 4.87 0.00 3.88 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 36 I 8.49 4.94 1.77 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 1.24 0.61 0.93 0.00 0.00 37 K 8.91 4.80 0.00 1.71 1.84 0.00 1.35 0.00 0.00 1.64 0.00 0.00 2.83 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.29 1.41 7.81 38 G 8.83 3.69 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 0.00 0.00 0.00 39 L 7.73 4.46 0.00 1.89 1.51 0.81 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 40 T 8.29 4.28 4.27 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 1.27 0.00 0.00 41 E 8.68 3.90 0.00 1.95 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 2.30 2.45 0.00 42 G 8.49 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 L 8.26 4.66 0.00 1.50 1.59 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 44 H 9.29 5.09 0.00 3.11 3.15 0.00 5.62 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 G 8.94 4.04 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 0.00 0.00 0.00 46 F 8.41 5.06 0.00 3.00 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 47 H 8.90 5.25 0.00 3.03 3.05 0.00 5.85 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 48 V 8.63 4.42 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 0.94 0.00 0.00 0.90 0.00 0.00 49 H 9.41 5.12 0.00 3.06 3.40 0.00 5.69 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 E 8.95 3.78 0.00 1.63 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 1.47 2.08 0.00 51 F 8.04 5.05 0.00 3.24 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 G 8.51 4.12 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 0.00 53 D 8.13 4.77 0.00 2.62 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 54 N 8.44 5.24 0.00 2.79 2.69 0.00 0.00 7.65 7.22 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 55 T 8.26 3.73 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 1.19 0.00 0.00 56 A 8.50 4.61 1.23 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 0.00 0.00 57 G 7.88 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 8.65 4.37 0.00 2.96 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 59 T 7.92 3.78 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 1.23 0.00 0.00 60 S 8.08 4.20 0.00 4.01 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 A 7.43 4.52 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 G 8.04 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 63 P 0.00 4.77 0.00 2.07 2.22 0.00 3.61 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 1.95 1.98 0.00 64 H 8.63 4.21 0.00 2.84 3.22 0.00 5.73 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 F 9.03 4.26 0.00 2.85 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 66 N 7.98 5.16 0.00 2.58 2.43 0.00 0.00 6.94 7.71 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 67 P 0.00 4.15 0.00 2.08 1.95 0.00 3.15 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.19 0.00 68 L 7.63 4.30 0.00 1.56 1.67 0.91 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 69 S 7.37 3.61 0.00 3.95 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 R 8.20 4.56 0.00 1.87 1.84 0.00 3.35 0.00 0.00 3.37 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.66 0.00 71 K 7.97 4.47 0.00 1.56 1.70 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.51 7.81 72 H 8.89 3.93 0.00 3.14 3.12 0.00 5.98 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 G 7.58 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 74 G 8.51 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 75 P 0.00 4.27 0.00 2.22 2.24 0.00 3.79 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.04 0.00 76 K 8.00 4.12 0.00 1.77 1.92 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.47 7.81 77 D 7.39 4.45 0.00 2.79 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 E 8.78 3.96 0.00 1.92 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 2.27 2.28 0.00 79 E 7.85 4.21 0.00 1.92 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 2.26 2.31 0.00 80 R 7.59 4.70 0.00 1.82 1.89 0.00 3.36 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.59 0.00 81 H 8.90 4.48 0.00 3.52 3.38 0.00 5.65 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 V 8.34 3.43 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.51 0.00 0.00 83 G 8.15 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 0.00 0.00 0.00 84 D 7.88 4.81 0.00 2.83 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 85 L 8.21 4.54 0.00 1.87 1.79 0.88 0.98 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 86 G 7.90 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 87 N 8.72 5.64 0.00 2.61 2.73 0.00 0.00 6.53 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 88 V 9.11 4.43 1.80 0.00 0.00 0.00 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 0.75 0.00 0.00 89 T 8.41 4.93 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 1.20 0.00 0.00 90 A 9.06 5.05 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 91 D 9.43 4.77 0.00 2.74 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 K 8.02 4.57 0.00 1.79 1.82 0.00 1.76 0.00 0.00 1.91 0.00 0.00 3.06 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.43 1.43 7.81 93 D 7.90 4.59 0.00 2.76 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 94 G 9.08 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 0.00 0.00 0.00 0.00 95 V 7.68 4.70 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.92 0.00 0.00 96 A 9.14 4.92 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 97 D 8.63 4.90 0.00 2.56 2.66 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 98 V 8.37 3.60 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 0.77 0.00 0.00 0.60 0.00 0.00 99 S 8.57 5.10 0.00 3.91 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 0.00 100 I 8.94 4.67 1.99 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.60 1.00 0.00 0.00 101 E 8.56 5.07 0.00 1.94 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.33 0.00 102 D 9.15 5.00 0.00 2.88 2.50 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 0.00 0.00 0.00 0.00 103 S 8.85 4.83 0.00 3.89 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 0.00 104 V 8.11 3.83 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 0.77 0.00 0.00 0.94 0.00 0.00 105 I 7.62 4.09 1.96 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 1.50 0.81 1.07 0.00 0.00 106 S 8.20 4.65 0.00 3.89 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 0.00 107 L 8.31 4.79 0.00 1.87 1.64 1.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 108 S 7.89 4.51 0.00 3.94 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 0.00 109 G 8.66 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 D 8.82 4.34 0.00 2.66 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 0.00 111 H 8.15 4.79 0.00 3.20 3.37 0.00 5.79 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 C 7.87 4.29 0.00 3.24 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 0.00 113 I 8.52 3.77 1.65 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.19 0.99 0.00 0.00 114 I 7.26 3.70 1.78 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.38 0.83 0.00 0.00 115 G 9.15 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 0.00 116 R 7.49 4.59 0.00 1.61 1.79 0.00 2.21 0.00 0.00 2.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.31 0.00 117 T 7.81 4.85 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 1.24 0.00 0.00 118 L 8.66 4.71 0.00 1.81 1.56 0.53 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 119 V 8.41 4.90 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 0.86 0.00 0.00 0.77 0.00 0.00 120 V 8.85 4.99 2.24 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 0.78 0.00 0.00 0.95 0.00 0.00 121 H 8.55 5.17 0.00 3.23 3.53 0.00 5.66 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 E 9.28 4.07 0.00 2.09 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 0.00 2.37 2.34 0.00 123 K 8.62 4.61 0.00 1.78 1.76 0.00 1.90 0.00 0.00 1.67 0.00 0.00 2.86 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.41 1.42 7.81 124 A 8.27 4.65 1.23 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 0.00 0.00 125 D 9.35 4.83 0.00 2.77 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 D 9.40 4.62 0.00 2.94 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 L 9.12 3.38 0.00 1.82 1.77 0.94 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 128 G 8.82 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 0.00 0.00 0.00 129 K 7.84 4.48 0.00 1.79 1.83 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.84 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.42 1.50 7.81 130 G 7.31 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 G 8.44 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 0.00 132 N 7.53 4.71 0.00 2.82 2.86 0.00 0.00 5.96 7.66 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 0.00 133 E 8.73 4.04 0.00 2.06 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 2.37 2.36 0.00 134 E 8.18 3.95 0.00 2.11 1.92 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 2.37 2.40 0.00 135 S 9.39 4.07 0.00 4.15 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 0.00 136 T 7.84 4.18 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 137 K 8.02 4.35 0.00 1.81 1.71 0.00 1.67 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.35 1.31 7.81 138 T 7.68 3.87 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 1.24 0.00 0.00 139 G 7.92 3.77 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 0.00 0.00 0.00 140 N 7.86 4.29 0.00 3.06 2.90 0.00 0.00 6.86 6.65 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 0.00 141 A 7.38 4.49 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 0.00 142 G 7.99 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 0.00 0.00 0.00 143 S 8.59 4.41 0.00 3.93 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 0.00 144 R 8.26 4.40 0.00 1.67 1.86 0.00 3.18 0.00 0.00 3.14 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.59 0.00 145 L 8.60 4.26 0.00 1.57 1.69 0.95 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 146 A 7.76 5.10 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 C 9.45 5.19 0.00 3.05 3.14 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 0.00 148 G 8.45 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 0.00 149 V 8.36 4.30 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 0.77 0.00 0.00 0.97 0.00 0.00 150 I 9.16 4.00 1.73 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.38 0.44 0.00 0.00 151 G 9.04 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 I 8.36 4.33 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.54 0.91 0.00 0.00 153 A 8.31 4.82 1.21 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 0.00 0.00 154 Q 8.51 4.07 0.00 2.04 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.77 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00