NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1553 8.1727 122.0497 56.2880 34.1059 174.1006 2 V 4.5849 8.1725 127.1000 60.5970 32.3585 174.4009 3 F 4.4415 10.0740 128.7366 57.6321 40.1722 174.8268 4 E 4.2244 8.9234 120.4460 55.4196 31.1579 176.3666 5 R 3.2741 8.9987 119.1368 61.1128 29.8432 179.2140 6 C 4.3048 8.0268 115.3741 59.8410 35.2673 175.7574 7 E 3.8863 8.1305 120.6498 59.2937 29.2264 178.5504 8 L 3.6363 7.9474 120.1454 57.6784 42.0647 178.5867 9 A 3.9379 7.8484 120.8506 55.3857 18.3409 179.9085 10 R 3.9058 7.9748 116.4757 59.5467 29.8741 179.4453 11 T 3.8648 7.4882 114.4487 66.5731 68.8431 176.3430 12 L 3.9632 8.1071 121.2492 57.6454 41.6502 179.4532 13 K 3.9212 8.0519 119.4791 59.7015 31.9011 179.0448 14 R 4.0648 7.9854 117.0773 58.4077 29.9650 177.8598 15 L 4.4633 7.3945 117.1361 53.8475 41.7789 176.6123 16 G 3.8650 7.7013 106.0840 47.1453 0.0000 175.2073 17 M 4.0279 7.7978 120.2259 55.9585 32.6760 175.5299 18 D 4.4609 8.0556 117.8481 55.6832 41.0722 175.7547 19 G 3.9246 9.2243 115.4044 45.5760 0.0000 171.3524 20 Y 4.1876 8.2020 121.8835 58.8196 38.9035 176.5320 21 R 3.6598 9.0573 127.1106 57.2658 27.7843 177.3446 22 G 3.8144 8.2909 103.7551 45.6039 0.0000 174.0700 23 I 4.0002 7.5422 122.1589 59.5045 37.6269 175.9802 24 S 4.6373 8.2805 120.8964 57.7681 65.0863 174.8413 25 L 4.2244 8.6865 123.5481 58.4947 41.9342 178.8782 26 A 4.1834 8.1854 120.1682 55.2750 18.2740 179.2857 27 N 4.4381 7.9168 113.6581 56.4416 38.5813 177.7269 28 W 4.2898 7.8413 120.3658 59.9084 29.0636 178.6032 29 M 4.1506 8.4014 118.8170 58.5858 31.4382 177.9312 30 C 3.3241 8.0187 118.5852 59.0680 43.2039 175.3850 31 L 3.9931 8.0876 121.6790 58.1935 41.7853 178.7735 32 A 4.3184 8.3650 122.2422 54.4707 18.3699 179.2261 33 K 2.9118 8.4942 118.4632 59.5603 32.0103 179.1055 34 W 4.2502 7.9504 117.4415 59.3315 29.0105 178.3398 35 E 4.3641 8.4966 118.9357 58.7562 28.9136 177.8755 36 S 4.5307 8.0651 108.8919 56.8251 65.1738 174.0664 37 G 3.1388 8.2779 108.8866 47.2412 0.0000 173.4949 38 Y 3.6862 7.6921 112.5814 58.5935 35.1883 168.9238 39 N 5.2706 7.6903 118.8748 52.1196 39.6443 175.4873 40 T 4.2041 9.0607 117.8946 63.4985 69.9865 175.9422 41 R 4.8016 8.0478 117.4436 55.7513 30.5188 176.4454 42 A 4.3576 7.7865 122.3494 52.8629 19.3063 177.4218 43 T 5.1122 8.2891 110.6251 60.4242 72.7293 172.9516 44 N 4.8643 8.5577 120.3802 52.8091 42.7012 172.3323 45 Y 4.8740 8.7788 127.5366 56.6339 41.2278 173.9392 46 N 4.7735 8.1175 124.1323 51.1167 38.7533 175.3121 47 A 3.5710 8.1843 127.4569 54.5753 19.0399 179.3157 48 G 3.7162 8.0891 104.4940 48.2083 0.0000 174.0183 49 D 4.7581 7.5898 115.3544 51.9476 39.9719 175.6900 50 R 3.9498 8.0584 116.3974 57.0881 28.1636 175.7762 51 S 5.0182 7.6269 112.6004 56.9151 66.5142 172.1418 52 A 5.1749 8.8668 119.5505 50.8128 23.0807 174.8160 53 D 5.5110 9.0717 120.3597 52.9377 43.5397 175.2744 54 Y 4.8771 9.2498 120.7925 57.5475 41.7267 177.0330 55 G 4.2741 8.9247 111.7716 46.3234 0.0000 173.3771 56 I 3.9581 8.0857 116.3347 62.8003 37.9794 177.8555 57 F 4.9545 7.9330 115.6981 56.4412 40.1180 175.1068 58 Q 3.5866 7.9049 119.2943 57.0943 26.5636 174.0497 59 I 4.3858 8.1611 119.0474 61.1457 39.1434 176.8988 60 N 5.4928 9.1664 125.6163 53.2985 39.8992 175.7708 61 S 4.6660 9.1027 120.0265 60.2568 63.3830 175.4328 62 R 3.7606 8.9012 122.3665 58.6927 30.3098 177.7743 63 Y 4.3048 7.8195 114.5192 57.7936 40.7272 177.2386 64 W 4.7263 8.0360 118.9468 57.7933 30.0393 173.6949 65 C 5.6111 7.9619 110.6119 53.4220 45.0178 171.7604 66 N 5.0782 8.9673 119.7286 52.1259 39.8010 174.7809 67 D 4.8722 8.4844 122.8603 52.2600 40.2946 178.0497 68 G 4.0426 8.6002 107.5780 46.2437 0.0000 174.7237 69 K 4.5018 8.0504 116.4997 56.5846 33.0184 175.6177 70 T 4.6069 7.7260 117.2568 61.3263 69.5624 172.3228 71 P 4.1691 0.0000 0.0000 64.2902 31.6640 175.9682 72 G 3.9578 8.8634 109.9375 46.2161 0.0000 172.9519 73 A 4.2663 7.3697 119.7673 51.5198 19.4721 177.6061 74 V 4.3115 8.2925 112.5930 59.3009 35.4086 176.2255 75 N 4.9453 8.0161 116.8646 52.0653 37.6665 174.5327 76 A 3.9628 8.9200 125.1130 54.9180 19.1163 178.5215 77 C 4.5820 8.5718 111.1694 57.3989 41.0327 173.0298 78 H 4.0515 7.8731 116.4680 56.6085 26.4425 174.2020 79 L 4.8320 8.3931 117.3571 52.8908 46.3935 176.6423 80 S 4.6873 8.3492 115.2943 57.9831 63.2645 176.0406 81 C 4.1366 8.7483 124.2329 59.6160 40.3813 176.3199 82 S 3.9133 7.8305 114.7919 61.3794 61.6570 175.9764 83 A 4.0373 7.8290 122.2601 54.3826 17.9980 177.9274 84 L 4.4551 7.8727 116.4248 54.9846 41.8606 177.5699 85 L 5.0683 7.8925 117.4844 54.5153 42.3580 176.7349 86 Q 4.3572 7.8281 117.7500 55.3818 29.5368 175.9738 87 D 4.3910 8.5296 119.9247 57.0847 41.1339 176.7050 88 N 4.5838 8.0110 118.2171 53.0835 39.1617 174.6512 89 I 4.1917 8.4386 118.9224 60.9995 37.9956 176.9737 90 A 3.9326 8.4666 124.8649 56.0310 18.1813 180.0685 91 D 4.2974 8.0731 116.3904 57.4507 40.8846 178.7267 92 A 4.1084 7.9710 120.8621 55.0850 18.3539 179.7480 93 V 3.4464 8.1463 116.9379 66.0586 31.6873 178.1822 94 A 3.8465 7.9751 120.5936 55.1633 18.0695 178.7836 95 C 4.2677 8.3262 116.9172 59.5552 38.5237 175.6201 96 A 3.9266 8.2394 122.8348 54.9493 17.6086 179.8404 97 K 3.8687 7.7506 116.4708 59.4876 32.2576 179.0963 98 R 4.0948 7.8411 118.8567 59.3953 30.0814 178.6237 99 V 2.4633 7.6773 118.0859 65.8091 31.3552 178.1822 100 V 3.8605 7.7315 110.2739 62.9203 31.2664 177.7929 101 R 4.2271 7.6084 117.7869 57.2613 30.5531 175.8886 102 D 4.7574 7.5265 118.6425 52.9095 42.0526 175.2787 103 P 4.2295 0.0000 0.0000 66.4038 30.9150 177.9368 104 Q 3.9885 8.1570 117.4515 56.2621 29.9197 177.3858 105 G 3.7087 7.8340 106.7762 46.8289 0.0000 175.8379 106 I 3.5170 7.7260 119.6046 63.4172 37.9922 178.0148 107 R 4.1542 7.1689 117.8215 57.7101 30.0170 177.2887 108 A 3.8755 7.6745 121.3207 54.4358 18.4301 177.9334 109 W 4.6525 8.0406 116.6834 55.5751 30.0164 177.6718 110 V 3.7214 8.7386 123.3218 65.9757 31.0308 177.6993 111 A 3.9933 8.2704 120.2283 54.7350 18.1474 179.1901 112 W 3.9289 8.2436 126.7969 60.7916 30.6175 178.3872 113 R 3.7862 8.2740 116.0253 59.3483 29.6170 178.4214 114 N 4.3757 8.1820 115.4707 55.5407 38.7200 176.7962 115 R 4.1242 7.9250 115.6459 55.7685 31.5631 175.7175 116 C 4.5363 7.7428 116.0477 57.6530 42.6361 174.4362 117 Q 3.1195 6.5768 119.7193 56.9683 28.7757 175.1915 118 N 4.1832 8.6456 121.2777 54.4469 36.1882 173.7951 119 R 4.5245 7.2838 115.0717 54.0903 33.4521 175.6838 120 D 4.5750 8.4402 118.9503 53.9126 40.0906 176.0336 121 V 4.5596 8.1291 118.7785 61.2731 32.4863 178.3555 122 R 3.9961 8.0135 121.5433 59.4674 29.5125 178.6192 123 Q 3.9917 8.0702 116.5585 59.2694 28.1425 178.2090 124 Y 4.1405 8.0586 118.3065 60.0018 38.2496 176.7311 125 V 4.3281 7.5899 111.1040 60.8027 32.8113 175.6148 126 Q 4.1795 7.4220 120.6323 57.3381 28.7118 177.0600 127 G 3.9797 8.9832 111.0324 45.7695 0.0000 174.4768 128 C 4.4111 8.0300 115.9798 56.9583 40.5626 173.9843 129 G 3.8613 8.1247 107.2277 46.7345 0.0000 174.1594 130 V 4.0031 7.8977 118.0821 61.0719 32.0015 175.8804 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 K 8.17 4.16 0.00 2.01 1.63 0.00 1.25 0.00 0.00 1.05 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.88 1.14 7.81 2 V 8.17 4.58 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 0.92 0.00 0.00 0.95 0.00 0.00 3 F 10.07 4.44 0.00 2.81 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 4 E 8.92 4.22 0.00 1.98 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 0.00 2.31 2.25 0.00 5 R 9.00 3.27 0.00 1.97 1.88 0.00 3.45 0.00 0.00 3.47 7.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.82 0.00 6 C 8.03 4.30 0.00 3.00 3.12 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 7 E 8.13 3.89 0.00 2.06 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 0.00 2.61 2.42 0.00 8 L 7.95 3.64 0.00 1.37 1.34 -0.39 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.85 3.94 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 10 R 7.97 3.91 0.00 1.89 1.99 0.00 3.14 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 1.65 1.81 0.00 11 T 7.49 3.86 4.21 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 1.23 0.00 0.00 12 L 8.11 3.96 0.00 1.79 1.58 0.89 0.28 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 13 K 8.05 3.92 0.00 1.95 1.96 0.00 1.65 0.00 0.00 1.66 0.00 0.00 3.13 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.51 7.81 14 R 7.99 4.06 0.00 1.94 1.96 0.00 3.20 0.00 0.00 3.22 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.94 0.00 15 L 7.39 4.46 0.00 1.64 1.55 0.87 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.70 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 0.00 0.00 0.00 17 M 7.80 4.03 0.00 1.23 1.93 0.00 0.00 0.00 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.07 0.00 18 D 8.06 4.46 0.00 2.69 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 19 G 9.22 3.92 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 0.00 0.00 0.00 20 Y 8.20 4.19 0.00 3.36 3.27 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 21 R 9.06 3.66 0.00 1.82 1.81 0.00 3.24 0.00 0.00 2.98 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.23 0.00 22 G 8.29 3.81 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 23 I 7.54 4.00 1.71 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.50 -0.32 0.00 0.00 24 S 8.28 4.64 0.00 4.10 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 25 L 8.69 4.22 0.00 2.06 1.81 1.02 0.97 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 26 A 8.19 4.18 1.52 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 0.00 0.00 27 N 7.92 4.44 0.00 2.88 2.74 0.00 0.00 6.95 7.55 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 28 W 7.84 4.29 0.00 3.47 3.07 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 29 M 8.40 4.15 0.00 2.17 2.35 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.91 0.00 30 C 8.02 3.32 0.00 2.52 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 31 L 8.09 3.99 0.00 1.91 1.86 0.57 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.37 4.32 1.53 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 0.00 0.00 0.00 33 K 8.49 2.91 0.00 1.67 1.79 0.00 0.74 0.00 0.00 1.09 0.00 0.00 2.60 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.19 0.52 7.81 34 W 7.95 4.25 0.00 3.41 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 35 E 8.50 4.36 0.00 2.16 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 0.00 2.61 2.60 0.00 36 S 8.07 4.53 0.00 4.06 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 37 G 8.28 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 0.00 0.00 0.00 38 Y 7.69 3.69 0.00 3.24 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 7.69 5.27 0.00 2.83 2.89 0.00 0.00 7.01 7.10 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 40 T 9.06 4.20 4.43 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 0.00 0.00 0.00 1.46 0.00 0.00 41 R 8.05 4.80 0.00 1.88 2.07 0.00 3.08 0.00 0.00 3.25 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.82 0.00 42 A 7.79 4.36 1.38 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 43 T 8.29 5.11 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 1.29 0.00 0.00 44 N 8.56 4.86 0.00 3.00 2.80 0.00 0.00 7.07 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 45 Y 8.78 4.87 0.00 3.05 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 46 N 8.12 4.77 0.00 2.68 2.59 0.00 0.00 6.66 7.19 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 47 A 8.18 3.57 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 48 G 8.09 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 49 D 7.59 4.76 0.00 2.71 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 50 R 8.06 3.95 0.00 2.05 2.19 0.00 3.12 0.00 0.00 3.20 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.53 0.00 51 S 7.63 5.02 0.00 3.96 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 52 A 8.87 5.17 1.22 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 53 D 9.07 5.51 0.00 2.68 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 54 Y 9.25 4.88 0.00 3.00 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 55 G 8.92 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 0.00 0.00 0.00 0.00 56 I 8.09 3.96 1.68 0.00 0.00 0.57 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 2.31 0.09 0.00 0.00 57 F 7.93 4.95 0.00 3.20 2.93 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 58 Q 7.90 3.59 0.00 2.54 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 6.84 0.00 0.00 0.00 0.00 0.00 2.52 2.69 0.00 59 I 8.16 4.39 2.14 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.18 1.11 0.00 0.00 60 N 9.17 5.49 0.00 3.10 3.05 0.00 0.00 6.97 7.36 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 61 S 9.10 4.67 0.00 4.05 4.33 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 62 R 8.90 3.76 0.00 1.60 1.38 0.00 2.58 0.00 0.00 2.80 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.03 0.00 63 Y 7.82 4.30 0.00 1.46 1.89 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 64 W 8.04 4.73 0.00 3.61 3.28 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 65 C 7.96 5.61 0.00 3.22 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 66 N 8.97 5.08 0.00 2.77 2.69 0.00 0.00 7.08 8.09 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 67 D 8.48 4.87 0.00 2.89 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 68 G 8.60 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 69 K 8.05 4.50 0.00 1.85 1.88 0.00 1.58 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.52 1.44 7.81 70 T 7.73 4.61 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 1.21 0.00 0.00 71 P 0.00 4.17 0.00 2.01 2.00 0.00 3.82 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 2.04 2.11 0.00 72 G 8.86 3.96 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 0.00 0.00 0.00 73 A 7.37 4.27 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 74 V 8.29 4.31 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 0.61 0.00 0.00 0.83 0.00 0.00 75 N 8.02 4.95 0.00 2.75 2.57 0.00 0.00 6.78 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 76 A 8.92 3.96 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 77 C 8.57 4.58 0.00 3.31 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 78 H 7.87 4.05 0.00 3.29 3.37 0.00 5.80 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.39 4.83 0.00 1.66 1.50 0.96 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.35 4.69 0.00 3.83 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 81 C 8.75 4.14 0.00 2.17 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 82 S 7.83 3.91 0.00 3.89 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 83 A 7.83 4.04 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 84 L 7.87 4.46 0.00 1.92 1.81 1.05 0.43 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 85 L 7.89 5.07 0.00 1.80 1.72 1.14 1.19 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 86 Q 7.83 4.36 0.00 2.23 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.59 7.10 0.00 0.00 0.00 0.00 0.00 2.37 2.50 0.00 87 D 8.53 4.39 0.00 2.62 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 88 N 8.01 4.58 0.00 2.69 2.74 0.00 0.00 6.96 7.94 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 89 I 8.44 4.19 1.73 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.54 0.97 0.00 0.00 90 A 8.47 3.93 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 91 D 8.07 4.30 0.00 2.71 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 92 A 7.97 4.11 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 93 V 8.15 3.45 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 0.81 0.00 0.00 0.86 0.00 0.00 94 A 7.98 3.85 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 95 C 8.33 4.27 0.00 3.15 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 96 A 8.24 3.93 0.95 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 0.00 0.00 97 K 7.75 3.87 0.00 1.65 1.41 0.00 1.32 0.00 0.00 0.76 0.00 0.00 2.35 0.00 0.00 2.57 0.00 0.00 0.00 0.00 0.30 1.09 7.81 98 R 7.84 4.09 0.00 2.02 2.17 0.00 3.30 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.98 0.00 99 V 7.68 2.46 1.86 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 -0.31 0.00 0.00 -0.50 0.00 0.00 100 V 7.73 3.86 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 1.21 0.00 0.00 1.42 0.00 0.00 101 R 7.61 4.23 0.00 2.13 2.08 0.00 3.34 0.00 0.00 3.30 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.73 0.00 102 D 7.53 4.76 0.00 3.16 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 0.00 103 P 0.00 4.23 0.00 2.14 2.21 0.00 3.78 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.02 0.00 104 Q 8.16 3.99 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.87 0.00 0.00 0.00 0.00 0.00 2.41 2.31 0.00 105 G 7.83 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 0.00 106 I 7.73 3.52 0.99 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 -0.70 0.00 0.00 107 R 7.17 4.15 0.00 1.98 2.01 0.00 3.21 0.00 0.00 3.26 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.53 0.00 108 A 7.67 3.88 0.71 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 0.00 109 W 8.04 4.65 0.00 3.54 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 0.00 110 V 8.74 3.72 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 1.18 0.00 0.00 0.99 0.00 0.00 111 A 8.27 3.99 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 0.00 0.00 0.00 0.00 0.00 0.00 112 W 8.24 3.93 0.00 3.42 3.52 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 0.00 113 R 8.27 3.79 0.00 2.08 2.02 0.00 3.65 0.00 0.00 3.58 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 2.20 0.00 114 N 8.18 4.38 0.00 2.64 2.70 0.00 0.00 6.89 8.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 R 7.93 4.12 0.00 0.67 0.69 0.00 2.75 0.00 0.00 2.80 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.62 0.00 116 C 7.74 4.54 0.00 1.58 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 0.00 117 Q 6.58 3.12 0.00 0.93 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.91 0.00 0.00 0.00 0.00 0.00 2.16 2.27 0.00 118 N 8.65 4.18 0.00 2.80 2.82 0.00 0.00 6.87 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 0.00 119 R 7.28 4.52 0.00 1.76 1.78 0.00 3.24 0.00 0.00 3.06 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.49 0.00 120 D 8.44 4.57 0.00 2.64 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.13 4.56 2.39 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 0.86 0.00 0.00 1.04 0.00 0.00 122 R 8.01 4.00 0.00 1.98 2.02 0.00 3.15 0.00 0.00 3.24 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 123 Q 8.07 3.99 0.00 2.08 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.91 0.00 0.00 0.00 0.00 0.00 2.20 1.77 0.00 124 Y 8.06 4.14 0.00 3.19 3.16 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 0.00 125 V 7.59 4.33 2.14 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 0.93 0.00 0.00 1.05 0.00 0.00 126 Q 7.42 4.18 0.00 1.91 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.57 0.00 0.00 0.00 0.00 0.00 2.52 2.45 0.00 127 G 8.98 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 0.00 128 C 8.03 4.41 0.00 3.11 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 0.00 129 G 8.12 3.86 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 0.00 0.00 0.00 130 V 7.90 4.00 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 0.74 0.00 0.00 0.96 0.00 0.00