NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4624 8.1927 115.3065 57.9237 63.4714 173.6192 3 R 3.8601 8.9728 128.5982 59.3759 29.8246 176.6285 4 A 4.1207 8.3550 121.5679 55.7192 18.9621 179.7577 5 K 4.0033 8.0298 121.8344 59.7890 31.7174 181.0831 6 R 4.1255 8.0609 120.1318 59.4551 30.0776 178.6124 7 I 3.7857 8.1034 119.5783 64.9062 37.2589 178.4366 8 M 4.3312 8.2712 119.3773 58.2221 31.7240 178.9884 9 K 4.0114 8.0283 118.2718 59.5237 32.2478 179.2092 10 E 3.9885 8.4545 118.8722 59.5005 29.3763 179.2026 11 I 3.6092 8.1906 120.2555 64.6669 37.1325 178.2510 12 Q 3.9321 8.0594 119.3871 59.0407 28.7047 177.7726 13 A 3.9826 7.9089 120.8699 55.2230 18.6900 179.5526 14 V 3.7678 7.9989 119.0628 66.6353 31.4794 179.1352 15 K 4.0191 7.9966 119.0270 57.6265 31.6118 179.2626 16 D 4.6376 8.1535 116.3631 55.4310 41.8452 175.7419 17 D 4.9422 7.7788 118.3586 52.1317 41.2650 174.5117 18 P 4.2572 0.0000 0.0000 65.6906 32.0560 179.0877 19 A 3.9112 7.8777 119.0113 54.0810 17.6279 178.0532 20 A 4.0413 7.9441 118.4969 53.2365 18.8615 178.1493 21 H 4.4598 8.4262 112.5005 56.8153 26.6811 173.8315 22 I 5.1467 7.1796 119.8568 59.8681 39.1980 175.3721 23 T 4.7906 8.7626 115.2019 59.9574 72.4551 172.7446 24 L 4.9661 8.2334 124.1930 53.9360 45.0211 174.9013 25 E 4.6014 8.8165 124.8628 54.4586 34.2951 175.0211 26 F 4.6818 8.3497 121.4276 57.6075 39.4193 176.0238 27 V 3.7110 8.8248 123.3571 65.4777 31.4870 175.7429 28 S 4.7356 7.6094 110.3559 56.9857 65.9841 172.9688 29 E 4.3235 8.6180 117.4237 56.5692 29.3382 177.0410 30 S 4.3941 7.6782 113.8581 59.2300 62.9182 172.8361 31 D 4.5299 7.4483 117.3451 52.9599 41.5296 174.6410 32 I 4.2692 8.1515 109.7838 60.7376 37.8956 175.4562 33 H 4.8360 8.1432 115.8841 56.1987 30.4978 173.3049 34 H 5.2490 8.5013 118.2648 54.4717 30.4161 174.0911 35 L 5.2736 9.0362 122.4911 53.1775 46.9167 175.2255 36 K 4.8838 9.1942 120.2369 54.7472 34.6445 175.8524 37 G 4.5484 9.0594 112.6550 44.7721 0.0000 172.4244 38 T 5.9160 8.8991 111.3848 58.9442 72.7702 172.5911 39 F 5.8499 7.8982 115.8953 55.0709 41.7786 173.1122 40 L 4.9886 8.7738 119.5402 53.4885 42.9763 177.0696 41 G 4.8105 9.1974 109.8870 45.4605 0.0000 171.8559 42 P 4.6337 0.0000 0.0000 61.4048 32.0433 174.9765 43 P 4.4224 0.0000 0.0000 63.9765 31.9549 176.3730 44 G 3.9766 9.6420 108.2199 46.2997 0.0000 173.4191 45 T 4.8475 7.4365 114.5265 60.5926 72.5350 173.2801 46 P 4.2431 0.0000 0.0000 65.2004 31.6284 177.4627 47 Y 4.9107 7.7480 114.2032 56.7594 38.2516 174.7430 48 E 4.3539 8.1594 122.4561 57.6189 30.0497 177.1743 49 G 4.0061 9.2686 114.5849 44.8820 0.0000 173.4301 50 G 3.7730 7.8660 106.8954 45.1028 0.0000 172.6417 51 K 4.8506 8.1454 123.5875 54.2531 34.3487 175.1347 52 F 4.7473 8.7282 126.8003 55.6275 41.4451 174.7261 53 V 4.7066 8.8050 123.8741 61.0274 34.0522 174.3770 54 V 4.5065 8.8080 127.4059 60.7638 34.5312 173.9276 55 D 4.7798 8.8787 128.5293 54.2945 42.4311 174.8181 56 I 4.9580 8.8863 126.3762 59.3785 41.0547 173.9277 57 E 4.8476 9.0134 127.3340 54.4644 32.2318 174.6563 58 V 4.2948 8.3724 121.5101 59.1616 32.9067 174.8025 59 P 4.4870 0.0000 0.0000 62.1901 32.4083 176.8592 60 M 3.9703 8.7688 119.2534 59.0148 31.9366 177.9056 61 E 4.3039 8.1763 115.4875 57.1863 30.1209 175.9895 62 Y 4.5205 7.9171 121.1316 57.7607 39.2961 174.0857 63 P 3.4298 0.0000 0.0000 62.7464 31.4663 177.1439 64 F 4.6755 8.2374 117.3821 58.2145 39.3805 175.7863 65 K 4.7544 7.7213 119.6880 53.3153 35.1855 174.2332 66 P 2.9700 0.0000 0.0000 61.2883 31.8184 174.3301 67 P 4.2811 0.0000 0.0000 63.1148 32.7854 176.1185 68 K 4.3953 9.0308 125.0780 54.3850 32.9934 176.4683 69 M 5.3239 8.5203 125.1437 52.5514 35.2374 175.3474 70 Q 4.8011 8.6682 119.9563 54.4672 32.7026 174.0492 71 F 4.3696 9.5276 122.0533 58.3127 39.4721 176.0054 72 D 4.5223 9.2057 124.1141 57.1704 41.5534 177.9337 73 T 4.0193 8.0509 114.3986 63.1237 69.0920 173.8047 74 K 4.1920 8.5766 127.3416 55.9587 32.3798 176.1149 75 V 4.7867 8.4362 125.5916 61.2723 34.2103 174.2782 76 Y 4.1591 8.7676 127.3894 56.7335 38.2981 174.0111 77 H 4.8182 7.7908 124.6945 54.3313 32.9407 172.6739 78 P 4.0654 0.0000 0.0000 65.1252 31.4194 177.4205 79 N 5.0084 8.1747 112.6673 52.6699 39.1671 173.7103 80 I 4.9200 7.2902 119.1401 59.2050 40.3629 175.0596 81 S 4.3356 9.0263 121.0817 57.8686 62.5526 174.7412 82 S 4.5329 8.8196 121.7519 59.6686 63.5729 174.6332 83 V 4.1170 7.9073 120.1917 64.6102 32.3329 176.3429 84 T 4.2683 7.9784 106.9087 60.9596 69.7520 175.7443 85 G 4.2399 8.8645 109.8650 46.0156 0.0000 173.1583 86 A 4.5114 7.8868 122.1246 52.0553 19.5957 176.9164 87 I 4.9258 8.3581 120.6539 59.6489 40.3112 175.0667 88 C 4.6501 8.9804 127.5099 58.0216 32.6188 172.8706 89 L 4.4269 8.2369 129.8720 54.3215 45.0044 176.2117 90 D 4.4703 9.0989 125.6837 56.3593 39.8759 175.5134 91 I 4.0932 7.7623 111.7378 63.1009 37.7261 176.8251 92 L 4.3317 8.0030 122.4020 56.1223 42.7832 177.6509 93 K 4.2656 8.1080 116.8834 54.5627 33.4534 181.3781 94 N 4.7295 9.1066 119.0142 54.3728 40.0471 175.7142 95 A 4.7293 8.0842 121.2117 51.3668 19.4724 176.6846 96 W 4.3845 8.1425 128.3836 58.9163 31.6017 175.3812 97 S 4.3979 6.3617 116.9427 55.6003 64.8551 173.0889 98 P 4.7366 0.0000 0.0000 64.5103 31.1881 177.9289 99 V 3.6649 6.8308 109.9732 63.1505 31.8179 176.9537 100 I 3.5942 6.9361 121.3951 61.0791 37.3722 176.0169 101 T 4.7945 8.0056 114.4211 59.9555 72.5137 175.5516 102 L 4.1343 9.5408 121.0522 57.5180 41.3705 179.8125 103 K 3.9082 8.0077 119.3079 59.4943 32.1843 178.4569 104 S 4.0280 8.1684 113.1529 61.4249 62.2345 175.9411 105 A 4.0381 8.2116 123.2659 55.3278 18.1672 179.5385 106 L 3.8130 8.2106 117.7006 58.0734 41.6292 179.9397 107 I 3.6313 8.0403 119.9989 64.3669 36.9845 178.7062 108 S 4.0579 8.2305 116.3782 61.4126 62.4556 176.7169 109 L 3.9150 7.7846 121.9713 57.5176 41.1357 179.2543 110 Q 3.4722 7.2749 119.4382 58.8202 28.9348 178.0627 111 A 3.9937 7.9456 121.8005 54.6710 18.1050 179.3586 112 L 3.8930 7.4525 118.6448 58.0888 42.1690 178.7640 113 L 3.7373 7.2521 118.3072 57.6137 41.5308 178.9253 114 Q 4.3984 7.7453 118.6611 57.7977 30.2403 176.2995 115 S 4.6443 7.7572 114.9484 55.1371 63.6759 171.4700 116 P 4.3140 0.0000 0.0000 62.9266 32.0891 176.7125 117 E 4.5366 8.6912 121.2325 53.6382 28.9965 175.1351 118 P 4.2120 0.0000 0.0000 64.8860 31.9175 178.3040 119 N 4.5474 7.9492 115.0701 54.9727 38.9253 175.0098 120 D 4.6940 7.5244 117.2207 51.7675 41.4678 172.5184 121 P 4.5649 0.0000 0.0000 62.0915 32.8184 177.2644 122 Q 3.9822 8.8119 122.1443 58.0869 29.5387 175.8611 123 D 4.7496 7.6704 118.9338 52.1271 42.7153 175.8266 124 A 4.0110 8.4648 130.2255 55.2776 18.4459 178.8189 125 E 3.9566 8.1992 116.6094 59.5799 29.5984 179.5491 126 V 3.6916 8.1078 118.1430 65.8290 31.6018 177.9738 127 A 3.8396 8.0577 120.7281 54.9357 18.1637 179.4571 128 Q 3.9038 8.1200 118.2162 59.4536 29.0991 177.7487 129 H 4.2330 8.7324 119.7313 59.5690 29.7418 176.2466 130 Y 3.6646 7.9426 120.0100 60.7736 38.4970 178.1422 131 L 3.9882 7.6225 117.9513 57.7512 41.9146 179.1270 132 R 4.2047 8.2223 117.7976 58.3593 31.3400 176.5061 133 D 4.6711 8.3281 118.8135 51.3053 42.4192 174.8595 134 R 3.8664 8.4978 126.3296 59.6090 30.4802 177.7256 135 E 3.9803 8.1723 117.3936 61.3897 29.5822 180.7800 136 S 4.3088 8.0499 114.1461 60.8917 62.4008 175.6258 137 F 3.8203 8.4095 123.7320 61.6127 38.9836 176.7740 138 N 4.2184 8.8224 116.0716 56.4570 38.4022 177.4975 139 K 3.8658 7.8823 119.2075 59.6492 31.9970 179.6494 140 T 3.6164 7.3753 115.4790 66.3225 68.3518 176.6048 141 A 3.7848 7.4642 122.5311 55.1860 18.2732 179.6003 142 A 4.6496 7.9476 120.7081 54.6156 18.4063 179.5692 143 L 3.8822 7.9662 118.8415 58.3197 42.1684 179.3618 144 W 4.3762 8.8425 119.1472 60.0115 28.7846 178.7352 145 T 4.1155 8.2515 116.0127 66.7134 67.6881 176.9799 146 R 3.9041 7.8321 119.0248 59.1295 30.1374 178.9043 147 L 3.8238 8.0461 118.1630 57.2087 41.7183 178.1725 148 Y 4.8678 8.0481 113.0048 57.3669 39.6169 176.1743 149 A 4.5557 7.7623 122.6992 51.7277 19.6986 176.4574 150 S 4.2702 8.0256 120.8282 60.3580 63.0396 174.4136 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 S 8.19 4.46 0.00 3.92 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 3 R 8.97 3.86 0.00 2.13 2.02 0.00 3.28 0.00 0.00 3.61 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.95 0.00 4 A 8.35 4.12 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 5 K 8.03 4.00 0.00 1.81 1.83 0.00 1.82 0.00 0.00 1.57 0.00 0.00 2.83 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.37 1.32 7.81 6 R 8.06 4.13 0.00 2.24 2.21 0.00 3.55 0.00 0.00 3.21 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.74 0.00 7 I 8.10 3.79 2.03 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.71 1.13 0.00 0.00 8 M 8.27 4.33 0.00 2.13 2.19 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 3.01 0.00 9 K 8.03 4.01 0.00 2.07 1.89 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.66 7.81 10 E 8.45 3.99 0.00 2.20 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 2.39 2.64 0.00 11 I 8.19 3.61 2.06 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.70 0.88 0.00 0.00 12 Q 8.06 3.93 0.00 2.34 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.37 2.61 0.00 13 A 7.91 3.98 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 V 8.00 3.77 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 0.99 0.00 0.00 0.94 0.00 0.00 15 K 8.00 4.02 0.00 1.82 1.72 0.00 1.86 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.39 1.29 7.81 16 D 8.15 4.64 0.00 2.67 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 17 D 7.78 4.94 0.00 2.72 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 18 P 0.00 4.26 0.00 2.22 2.11 0.00 3.65 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.24 0.00 19 A 7.88 3.91 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 20 A 7.94 4.04 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 H 8.43 4.46 0.00 3.47 3.47 0.00 5.60 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 I 7.18 5.15 1.91 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.87 0.96 0.00 0.00 23 T 8.76 4.79 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 1.23 0.00 0.00 24 L 8.23 4.97 0.00 1.55 1.39 0.83 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 25 E 8.82 4.60 0.00 1.84 1.72 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 2.15 2.39 0.00 26 F 8.35 4.68 0.00 2.95 3.04 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 V 8.82 3.71 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 0.96 0.00 0.00 28 S 7.61 4.74 0.00 3.93 3.79 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 29 E 8.62 4.32 0.00 1.94 1.97 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 2.24 2.27 0.00 30 S 7.68 4.39 0.00 3.83 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 31 D 7.45 4.53 0.00 2.58 2.52 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 0.00 32 I 8.15 4.27 1.94 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.55 0.26 0.00 0.00 33 H 8.14 4.84 0.00 3.38 3.57 0.00 5.63 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 H 8.50 5.25 0.00 3.27 3.26 0.00 5.56 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 L 9.04 5.27 0.00 1.45 1.48 0.85 0.58 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 36 K 9.19 4.88 0.00 1.56 1.66 0.00 1.73 0.00 0.00 1.63 0.00 0.00 2.85 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.34 1.49 7.81 37 G 9.06 4.55 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 0.00 0.00 0.00 0.00 0.00 0.00 38 T 8.90 5.92 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 1.18 0.00 0.00 39 F 7.90 5.85 0.00 3.14 3.17 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 40 L 8.77 4.99 0.00 1.67 1.71 0.73 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 41 G 9.20 4.81 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 42 P 0.00 4.63 0.00 2.19 2.10 0.00 3.93 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.24 0.00 43 P 0.00 4.42 0.00 2.23 2.12 0.00 3.91 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 2.05 2.03 0.00 44 G 9.64 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 45 T 7.44 4.85 4.66 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 1.63 0.00 0.00 46 P 0.00 4.24 0.00 1.51 2.05 0.00 3.63 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.10 0.00 47 Y 7.75 4.91 0.00 3.27 3.29 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 48 E 8.16 4.35 0.00 2.23 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 2.39 2.35 0.00 49 G 9.27 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 50 G 7.87 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 51 K 8.15 4.85 0.00 1.61 1.51 0.00 1.71 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.20 1.29 7.81 52 F 8.73 4.75 0.00 1.74 2.80 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 0.00 0.00 0.00 0.00 53 V 8.80 4.71 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 0.94 0.00 0.00 0.88 0.00 0.00 54 V 8.81 4.51 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 0.70 0.00 0.00 0.37 0.00 0.00 55 D 8.88 4.78 0.00 3.06 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 I 8.89 4.96 1.87 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 1.01 0.76 0.74 0.00 0.00 57 E 9.01 4.85 0.00 1.90 1.67 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 0.00 2.09 2.17 0.00 58 V 8.37 4.29 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 0.30 0.00 0.00 0.89 0.00 0.00 59 P 0.00 4.49 0.00 2.30 2.13 0.00 3.47 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 2.06 2.03 0.00 60 M 8.77 3.97 0.00 2.05 2.22 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 2.59 2.59 0.00 61 E 8.18 4.30 0.00 2.11 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 2.45 2.35 0.00 62 Y 7.92 4.52 0.00 2.93 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 63 P 0.00 3.43 0.00 1.83 1.27 0.00 3.42 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 1.48 0.00 64 F 8.24 4.68 0.00 3.17 3.19 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 65 K 7.72 4.75 0.00 1.73 1.64 0.00 1.83 0.00 0.00 1.87 0.00 0.00 3.09 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.36 7.81 66 P 0.00 2.97 0.00 1.71 1.54 0.00 3.65 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.87 0.00 67 P 0.00 4.28 0.00 1.82 1.61 0.00 2.45 0.00 0.00 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 68 K 9.03 4.40 0.00 1.42 1.74 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.74 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.32 1.28 7.81 69 M 8.52 5.32 0.00 1.75 1.91 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 70 Q 8.67 4.80 0.00 2.27 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.99 0.00 0.00 0.00 0.00 0.00 2.24 2.36 0.00 71 F 9.53 4.37 0.00 3.04 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 72 D 9.21 4.52 0.00 2.66 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 73 T 8.05 4.02 4.67 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 0.00 0.00 0.00 1.40 0.00 0.00 74 K 8.58 4.19 0.00 1.34 1.04 0.00 1.00 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.59 0.00 0.00 0.00 0.00 0.94 1.41 7.81 75 V 8.44 4.79 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 0.82 0.00 0.00 1.13 0.00 0.00 76 Y 8.77 4.16 0.00 1.59 2.45 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 77 H 7.79 4.82 0.00 3.14 2.89 0.00 5.94 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 78 P 0.00 4.07 0.00 1.79 1.78 0.00 2.69 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 1.59 0.00 79 N 8.17 5.01 0.00 2.78 2.94 0.00 0.00 6.92 7.40 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 80 I 7.29 4.92 1.62 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.33 0.60 0.00 0.00 81 S 9.03 4.34 0.00 3.86 3.87 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 82 S 8.82 4.53 0.00 4.52 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 83 V 7.91 4.12 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 0.89 0.00 0.00 0.99 0.00 0.00 84 T 7.98 4.27 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 1.23 0.00 0.00 85 G 8.86 4.24 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 0.00 86 A 7.89 4.51 1.29 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 0.00 0.00 87 I 8.36 4.93 1.95 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 1.59 1.10 0.99 0.00 0.00 88 C 8.98 4.65 0.00 2.91 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 89 L 8.24 4.43 0.00 1.73 1.47 0.91 1.30 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 90 D 9.10 4.47 0.00 2.64 2.67 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 0.00 0.00 0.00 0.00 91 I 7.76 4.09 2.04 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.18 0.91 0.00 0.00 92 L 8.00 4.33 0.00 1.89 1.78 0.96 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 93 K 8.11 4.27 0.00 1.73 1.41 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.93 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.24 0.98 7.81 94 N 9.11 4.73 0.00 2.73 2.92 0.00 0.00 6.65 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 95 A 8.08 4.73 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 96 W 8.14 4.38 0.00 3.57 3.04 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 97 S 6.36 4.40 0.00 3.59 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 98 P 0.00 4.74 0.00 1.86 1.37 0.00 3.66 0.00 0.00 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.09 0.00 99 V 6.83 3.66 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 0.54 0.00 0.00 0.72 0.00 0.00 100 I 6.94 3.59 0.56 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 -0.06 0.68 0.00 0.00 101 T 8.01 4.79 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 1.27 0.00 0.00 102 L 9.54 4.13 0.00 1.72 1.74 0.75 0.80 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 0.00 103 K 8.01 3.91 0.00 1.83 1.81 0.00 1.74 0.00 0.00 1.75 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.51 1.51 7.81 104 S 8.17 4.03 0.00 3.91 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 0.00 105 A 8.21 4.04 1.55 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 0.00 0.00 0.00 0.00 0.00 106 L 8.21 3.81 0.00 2.03 1.72 0.94 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 107 I 8.04 3.63 1.97 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 1.50 0.73 0.86 0.00 0.00 108 S 8.23 4.06 0.00 4.00 3.87 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 0.00 109 L 7.78 3.92 0.00 1.37 1.62 0.82 0.60 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 0.00 110 Q 7.27 3.47 0.00 1.45 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.68 0.00 111 A 7.95 3.99 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 0.00 112 L 7.45 3.89 0.00 1.69 1.79 0.88 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 113 L 7.25 3.74 0.00 1.59 1.15 -0.02 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 114 Q 7.75 4.40 0.00 2.05 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.15 0.00 0.00 0.00 0.00 0.00 2.41 2.47 0.00 115 S 7.76 4.64 0.00 3.94 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 0.00 116 P 0.00 4.31 0.00 0.89 1.11 0.00 3.68 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 1.84 2.08 0.00 117 E 8.69 4.54 0.00 1.90 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 2.16 2.13 0.00 118 P 0.00 4.21 0.00 2.16 2.02 0.00 3.71 0.00 0.00 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.12 0.00 119 N 7.95 4.55 0.00 2.71 2.89 0.00 0.00 6.61 8.06 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 0.00 120 D 7.52 4.69 0.00 2.49 2.48 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 0.00 0.00 0.00 0.00 121 P 0.00 4.56 0.00 2.29 1.96 0.00 3.78 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.92 0.00 122 Q 8.81 3.98 0.00 2.05 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.83 0.00 0.00 0.00 0.00 0.00 2.62 2.33 0.00 123 D 7.67 4.75 0.00 2.68 2.44 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 0.00 0.00 0.00 0.00 124 A 8.46 4.01 1.32 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 0.00 0.00 0.00 125 E 8.20 3.96 0.00 2.18 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 0.00 2.43 2.39 0.00 126 V 8.11 3.69 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 0.68 0.00 0.00 0.78 0.00 0.00 127 A 8.06 3.84 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 0.00 128 Q 8.12 3.90 0.00 2.31 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.74 0.00 0.00 0.00 0.00 0.00 2.37 2.52 0.00 129 H 8.73 4.23 0.00 3.43 3.69 0.00 5.68 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 Y 7.94 3.66 0.00 2.30 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 0.00 131 L 7.62 3.99 0.00 1.83 1.69 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 132 R 8.22 4.20 0.00 1.81 2.08 0.00 3.26 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.64 0.00 133 D 8.33 4.67 0.00 2.70 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 0.00 134 R 8.50 3.87 0.00 1.73 1.81 0.00 2.64 0.00 0.00 2.71 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.66 0.00 135 E 8.17 3.98 0.00 2.01 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 1.95 0.00 136 S 8.05 4.31 0.00 4.01 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 0.00 137 F 8.41 3.82 0.00 3.02 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 0.00 138 N 8.82 4.22 0.00 2.89 2.86 0.00 0.00 7.13 8.36 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 0.00 139 K 7.88 3.87 0.00 1.92 1.81 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.65 7.81 140 T 7.38 3.62 3.55 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 0.00 0.00 -0.26 0.00 0.00 141 A 7.46 3.78 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.95 4.65 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 0.00 143 L 7.97 3.88 0.00 1.86 1.92 0.89 0.92 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 0.00 144 W 8.84 4.38 0.00 3.67 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 0.00 145 T 8.25 4.12 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 146 R 7.83 3.90 0.00 2.04 1.93 0.00 3.30 0.00 0.00 3.19 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.78 0.00 147 L 8.05 3.82 0.00 0.57 0.37 0.49 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 148 Y 8.05 4.87 0.00 3.20 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 0.00 149 A 7.76 4.56 0.82 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 0.00 150 S 8.03 4.27 0.00 3.80 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