NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 T 4.2118 8.1744 110.9380 61.5452 69.9576 173.1931 2 D 4.4427 8.4570 123.7369 51.8709 42.3241 173.2546 3 L 5.3709 8.4083 127.2131 54.0634 42.4086 177.9389 4 S 4.1941 8.1217 117.9936 61.4811 62.8256 176.3776 5 A 4.0814 7.9747 124.0234 54.9477 18.2367 179.4273 6 Q 4.0022 8.1063 116.1926 59.1290 28.9068 178.7428 7 K 3.9783 8.3840 119.5480 59.7235 31.8272 179.3215 8 R 3.9546 7.8121 117.8333 59.2208 29.9895 178.6164 9 L 4.0214 7.9385 118.5577 57.6167 41.6442 179.1766 10 A 4.0557 8.9377 121.1249 55.3363 18.3365 179.4903 11 A 4.1453 8.0318 119.1161 55.2216 18.2631 179.4448 12 D 4.2775 7.8238 116.6728 57.2054 41.2097 178.8813 13 V 3.6153 7.6775 118.3493 65.0035 31.6293 178.1283 14 L 4.1368 8.3035 118.1259 54.0863 42.8238 176.4036 15 D 4.4657 7.4351 117.0410 53.8112 39.3835 172.2729 16 V 4.4043 8.4219 118.5829 59.8499 34.9986 174.6939 17 G 3.7337 8.4552 110.2386 45.4676 0.0000 174.6301 18 K 3.8013 8.9273 122.7305 59.7243 32.1537 178.4441 19 N 4.5729 8.0734 113.0928 54.7660 38.8129 175.6084 20 R 4.3953 8.1721 117.5395 56.5536 31.1826 176.4571 21 V 4.3935 7.3984 111.9526 60.8035 32.3436 175.5018 22 W 4.8329 9.7353 135.0000 55.5589 33.6168 174.0601 23 F 5.3253 7.7448 124.0062 55.1911 41.4030 174.4996 24 N 3.2036 7.8658 122.5749 52.6201 39.0435 174.0417 25 P 4.1332 0.0000 0.0000 64.9309 31.5954 176.7243 26 E 4.5042 8.3143 115.6691 56.3715 30.3499 176.4463 27 R 4.6363 7.7723 119.3320 55.6412 31.2668 178.4675 28 Q 3.9365 8.4041 118.1741 59.1935 28.6367 178.0352 29 G 3.6087 8.0828 104.6528 48.2087 0.0000 174.8515 30 D 4.4510 7.8753 120.3049 57.2871 41.0056 178.7823 31 I 3.5349 7.7990 120.1302 64.1155 36.7376 178.3006 32 A 3.9528 8.5540 122.1343 55.0560 18.2611 178.7662 33 D 4.6327 7.6812 114.7847 54.5203 41.1746 176.5293 34 A 4.0805 7.5433 123.3374 52.3239 18.3858 176.6290 35 I 4.1830 8.6416 123.2432 63.5698 38.8920 177.4203 36 T 4.4308 8.1679 110.7762 60.6310 71.3559 175.8822 37 R 3.9514 8.3892 120.6786 59.4081 30.0600 178.9563 38 E 3.9336 8.1290 118.7669 59.2843 29.7737 178.4629 39 D 4.3576 8.0780 119.1983 57.0022 40.7809 178.8618 40 V 3.5100 7.6651 118.8256 66.1697 31.5864 178.1108 41 R 3.9480 8.2238 118.0948 59.4464 29.8976 178.5677 42 E 3.9533 8.1983 118.8676 59.3957 29.6372 178.9318 43 L 4.0693 7.8120 118.6980 57.3049 41.6069 179.5881 44 V 3.8087 8.1323 118.9064 66.2180 31.2977 177.8084 45 D 4.3960 8.2745 117.7007 57.3744 40.7912 178.0600 46 E 4.2503 7.9772 116.1770 56.6274 29.5567 178.0074 47 G 3.9923 8.1672 107.3556 45.4869 0.0000 174.6611 48 A 4.2897 8.2122 122.6476 53.9226 19.4834 177.8509 49 I 5.3052 7.8281 114.9516 59.9640 40.4338 175.1456 50 Q 4.8317 9.6135 123.5666 54.6034 34.1574 173.2873 51 A 5.1821 8.3865 121.7239 50.0267 20.7753 176.7436 52 K 4.1631 9.0485 123.2356 56.1810 32.9694 177.3323 53 D 4.4565 8.5867 123.2449 54.1767 41.4751 176.0654 54 K 4.3801 8.2765 122.2197 55.1748 34.0748 176.6881 55 K 4.1850 8.4864 123.6990 56.3385 32.9128 176.0638 56 G 4.1879 8.1198 111.1480 43.4820 0.0000 172.2872 57 N 4.4309 8.6902 121.4300 52.8155 39.1686 175.1625 58 S 4.2126 8.6157 119.6343 59.0278 63.3103 174.6289 59 R 4.6028 8.6003 123.8038 56.1266 30.1358 178.5290 60 G 3.5939 7.9010 107.2756 48.2158 0.0000 176.3296 61 R 3.9724 8.0417 120.5993 58.4339 30.0508 179.0745 62 A 3.9752 7.8886 120.1036 55.2786 18.6138 179.6046 63 R 3.9169 8.2122 116.8443 59.3904 30.1061 179.0655 64 E 3.9251 8.1888 118.2848 59.4688 29.4403 179.3770 65 R 3.8885 7.7928 118.0030 59.6855 30.0908 178.3255 66 Q 3.9984 8.5306 118.1573 59.0039 28.5608 179.4637 67 K 3.9692 8.0179 119.0961 59.4024 32.1291 179.3335 68 K 3.9542 7.8076 118.2179 59.8718 32.1059 179.6465 69 R 4.4539 8.5864 119.3912 58.7777 29.7412 179.0537 70 A 4.0765 8.1669 119.9877 54.8539 18.4867 178.2619 71 Y 4.2677 8.0615 116.2778 58.1186 39.1541 176.0495 72 G 3.9200 7.8744 106.7818 46.1243 0.0000 173.2417 73 H 4.7967 8.9063 117.7368 54.8399 30.5324 174.5859 74 Q 3.9281 8.7013 115.5773 57.3639 25.7953 174.3032 75 K 4.6323 8.0018 113.9679 56.1182 33.8069 177.0422 76 G 3.8679 8.0763 108.0918 44.3144 0.0000 174.9913 77 A 3.9762 8.8042 121.5846 55.4606 18.0907 179.6005 78 G 3.9311 8.0468 100.7444 46.6327 0.0000 173.8889 79 S 4.6547 8.3997 114.7027 57.9709 64.5370 174.2711 80 R 4.4486 7.5662 120.3240 54.9324 31.0293 175.8417 81 K 4.3284 8.7259 122.2898 57.2488 34.2042 176.5729 82 G 3.9784 7.6981 105.5957 43.6330 0.0000 172.9725 83 K 4.0417 8.3038 120.6484 55.9061 33.2416 177.6939 84 A 4.0958 8.8013 124.2862 55.3470 18.1518 180.1706 85 G 3.7727 8.0842 100.8435 46.0836 0.0000 174.5676 86 A 4.3492 7.6425 122.3474 54.5548 19.3532 179.4294 87 R 4.2343 7.8000 115.1424 57.6582 30.3301 176.8863 88 Q 4.2585 7.9045 120.3682 53.4224 31.8057 172.8846 89 N 4.5912 8.8585 124.8375 53.4633 39.8104 175.1221 90 S 4.1876 8.8056 124.3953 61.4953 62.9559 176.3946 91 K 3.9781 8.0630 122.5505 59.5247 32.0254 178.5365 92 E 4.5452 8.9608 120.6209 58.9432 29.2222 178.9199 93 D 4.3133 8.2860 118.2885 57.0470 41.2222 178.1257 94 W 4.1634 8.3468 129.0038 60.2749 30.6130 177.9914 95 E 3.7193 8.3096 118.7923 59.2246 29.0240 178.9803 96 S 3.9822 8.2023 113.2948 61.8445 62.4704 175.9443 97 R 3.7609 8.1211 120.7394 59.4922 29.8538 178.6617 98 I 3.1680 7.4973 118.2718 64.1521 37.6385 178.4890 99 R 3.7735 7.6187 118.3006 58.8569 29.8152 178.5911 100 A 3.9331 7.6900 120.3284 55.4706 18.4189 179.6535 101 Q 3.8922 7.8790 116.3330 59.3232 28.6360 179.5366 102 R 4.0084 7.9776 118.9129 59.2705 30.0115 179.3182 103 T 3.9359 8.1615 116.2608 66.2533 68.4654 176.6516 104 K 3.8740 8.3547 121.8888 59.7286 32.2670 178.8923 105 L 4.1780 8.0456 119.0048 57.7271 41.3287 179.6650 106 R 3.9440 7.8983 119.1317 59.2706 30.0190 178.4234 107 E 3.9607 8.1442 118.4589 59.4794 29.5312 179.2652 108 L 4.0158 8.0451 119.0145 57.8388 41.4164 179.6355 109 R 4.1583 7.5373 118.8858 58.9250 30.0072 178.0528 110 D 4.4461 7.5501 118.1904 57.0395 40.8325 178.2647 111 E 4.1431 7.9338 118.8962 59.7434 29.6728 177.5944 112 G 3.9900 7.9360 103.6655 45.6206 0.0000 174.8611 113 T 3.9871 8.0618 116.4931 65.6645 68.3531 174.3289 114 L 4.8209 7.7523 120.4999 52.6446 44.6135 175.5360 115 S 4.6385 8.3892 117.5226 56.9017 64.8706 174.5158 116 S 4.7908 8.4512 118.0504 57.1546 60.3203 171.9727 117 S 4.6851 7.6683 124.6316 58.6835 67.4075 179.7008 118 Q 4.0806 8.6124 120.8335 58.5218 28.5897 177.3894 119 Y 4.1252 8.0804 120.0242 60.9055 38.8893 177.9167 120 R 3.6512 8.2335 118.8935 59.4253 30.0007 177.5828 121 D 4.3595 7.9271 117.2766 57.6332 41.2735 178.4335 122 L 4.1942 8.4252 119.8052 57.7483 41.5231 178.6603 123 Y 3.8602 8.5333 119.9832 60.9935 38.4914 177.8842 124 D 4.5116 8.1031 118.4428 57.5369 41.2373 179.0083 125 K 3.9907 7.8761 118.6154 59.2204 32.0389 179.2417 126 A 3.9765 8.5059 121.6308 55.0150 18.1067 179.5002 127 G 3.9922 8.0848 100.0074 45.4811 0.0000 174.1023 128 G 3.9671 7.6997 107.6029 44.2781 0.0000 173.4212 129 G 3.9270 8.4269 107.3509 46.7895 0.0000 175.1461 130 E 3.8734 7.8750 119.4035 56.6733 30.1955 176.8620 131 F 5.1734 7.3070 117.0163 55.4418 40.9564 174.6288 132 D 4.5707 8.9878 126.5599 56.9280 41.0806 176.4850 133 S 4.6746 7.6008 110.6614 55.6960 66.4817 174.4972 134 V 3.5188 8.4114 118.0545 65.9226 31.0133 177.4301 135 A 4.0914 7.9829 120.1161 55.5217 18.3405 178.8977 136 D 4.3187 7.8482 116.3597 57.3462 41.0985 178.2698 137 L 3.0855 7.6125 120.4042 57.9891 42.1432 178.5636 138 E 3.9184 8.2428 118.5402 59.7994 29.1921 179.8627 139 R 3.9637 7.9774 117.0998 59.1543 30.1292 178.1990 140 Y 4.1891 7.5642 118.2808 60.5193 38.9611 177.1563 141 I 3.9625 7.9116 120.0519 63.8839 38.5606 177.4074 142 D 4.4563 7.8036 119.9604 53.9605 38.5862 176.3726 143 A 3.9342 7.8572 124.7611 52.4045 18.5478 177.9427 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 T 8.17 4.21 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 1.19 0.00 0.00 2 D 8.46 4.44 0.00 2.66 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 3 L 8.41 5.37 0.00 1.91 1.87 0.95 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 4 S 8.12 4.19 0.00 4.01 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 5 A 7.97 4.08 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 6 Q 8.11 4.00 0.00 2.49 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.80 0.00 0.00 0.00 0.00 0.00 2.44 2.46 0.00 7 K 8.38 3.98 0.00 2.00 1.80 0.00 1.34 0.00 0.00 0.82 0.00 0.00 2.16 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.38 1.45 7.81 8 R 7.81 3.95 0.00 1.93 2.10 0.00 3.10 0.00 0.00 3.18 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 9 L 7.94 4.02 0.00 1.98 1.73 0.93 0.66 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 10 A 8.94 4.06 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 11 A 8.03 4.15 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 12 D 7.82 4.28 0.00 2.73 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 13 V 7.68 3.62 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 0.94 0.00 0.00 0.96 0.00 0.00 14 L 8.30 4.14 0.00 1.77 1.81 1.03 1.12 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 15 D 7.44 4.47 0.00 2.75 2.65 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 16 V 8.42 4.40 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 0.66 0.00 0.00 0.94 0.00 0.00 17 G 8.46 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 0.00 0.00 0.00 18 K 8.93 3.80 0.00 1.80 1.86 0.00 1.66 0.00 0.00 1.81 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.53 1.49 7.81 19 N 8.07 4.57 0.00 2.70 2.85 0.00 0.00 6.84 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 20 R 8.17 4.40 0.00 2.03 1.97 0.00 3.12 0.00 0.00 3.17 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.58 0.00 21 V 7.40 4.39 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 0.69 0.00 0.00 0.69 0.00 0.00 22 W 9.74 4.83 0.00 3.28 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 23 F 7.74 5.33 0.00 2.56 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 24 N 7.87 3.20 0.00 2.67 2.51 0.00 0.00 6.89 7.73 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 25 P 0.00 4.13 0.00 2.09 2.11 0.00 3.74 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.05 0.00 26 E 8.31 4.50 0.00 2.09 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 2.27 2.27 0.00 27 R 7.77 4.64 0.00 1.70 1.79 0.00 3.13 0.00 0.00 3.15 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.52 0.00 28 Q 8.40 3.94 0.00 2.04 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.41 2.37 0.00 29 G 8.08 3.61 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 0.00 0.00 0.00 30 D 7.88 4.45 0.00 2.77 2.65 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 31 I 7.80 3.53 1.67 0.00 0.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.56 0.19 0.00 0.00 32 A 8.55 3.95 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 33 D 7.68 4.63 0.00 2.82 2.70 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 0.00 34 A 7.54 4.08 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 35 I 8.64 4.18 1.86 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 1.63 0.92 0.90 0.00 0.00 36 T 8.17 4.43 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 1.24 0.00 0.00 37 R 8.39 3.95 0.00 1.88 2.03 0.00 3.14 0.00 0.00 3.27 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.70 0.00 38 E 8.13 3.93 0.00 2.07 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 2.37 2.46 0.00 39 D 8.08 4.36 0.00 2.89 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 40 V 7.67 3.51 2.28 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 1.11 0.00 0.00 0.98 0.00 0.00 41 R 8.22 3.95 0.00 2.03 1.99 0.00 3.46 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.93 0.00 42 E 8.20 3.95 0.00 2.18 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 0.00 2.50 2.35 0.00 43 L 7.81 4.07 0.00 1.86 1.62 0.79 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 44 V 8.13 3.81 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 1.01 0.00 0.00 45 D 8.27 4.40 0.00 2.83 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 E 7.98 4.25 0.00 2.10 2.01 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 2.35 2.55 0.00 47 G 8.17 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 0.00 0.00 0.00 48 A 8.21 4.29 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 49 I 7.83 5.31 1.97 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 1.21 0.64 1.23 0.00 0.00 50 Q 9.61 4.83 0.00 2.19 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.75 0.00 0.00 0.00 0.00 0.00 2.32 2.50 0.00 51 A 8.39 5.18 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 52 K 9.05 4.16 0.00 1.62 1.73 0.00 1.82 0.00 0.00 1.77 0.00 0.00 2.92 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.39 1.38 7.81 53 D 8.59 4.46 0.00 2.64 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 54 K 8.28 4.38 0.00 1.85 1.80 0.00 1.58 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.35 1.41 7.81 55 K 8.49 4.18 0.00 1.73 1.74 0.00 1.71 0.00 0.00 1.70 0.00 0.00 3.24 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.43 7.81 56 G 8.12 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 57 N 8.69 4.43 0.00 2.70 2.77 0.00 0.00 7.06 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 S 8.62 4.21 0.00 3.85 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 59 R 8.60 4.60 0.00 1.84 1.92 0.00 3.13 0.00 0.00 3.34 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 60 G 7.90 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 61 R 8.04 3.97 0.00 1.86 2.00 0.00 3.13 0.00 0.00 3.34 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.71 0.00 62 A 7.89 3.98 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.21 3.92 0.00 2.02 2.00 0.00 3.14 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.88 0.00 64 E 8.19 3.93 0.00 2.21 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.45 0.00 65 R 7.79 3.89 0.00 2.01 2.14 0.00 3.12 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.90 0.00 66 Q 8.53 4.00 0.00 2.30 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.59 0.00 0.00 0.00 0.00 0.00 2.39 2.58 0.00 67 K 8.02 3.97 0.00 2.03 1.84 0.00 1.66 0.00 0.00 1.62 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.71 7.81 68 K 7.81 3.95 0.00 1.95 1.94 0.00 1.75 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.63 1.67 7.81 69 R 8.59 4.45 0.00 1.86 2.00 0.00 3.15 0.00 0.00 3.28 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.81 0.00 70 A 8.17 4.08 1.42 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 0.00 0.00 71 Y 8.06 4.27 0.00 2.95 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 72 G 7.87 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 73 H 8.91 4.80 0.00 3.38 3.28 0.00 5.97 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 Q 8.70 3.93 0.00 2.24 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 7.51 0.00 0.00 0.00 0.00 0.00 2.29 2.41 0.00 75 K 8.00 4.63 0.00 1.69 1.75 0.00 1.75 0.00 0.00 1.72 0.00 0.00 3.15 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.34 1.64 7.81 76 G 8.08 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 77 A 8.80 3.98 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 78 G 8.05 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 79 S 8.40 4.65 0.00 3.95 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 80 R 7.57 4.45 0.00 1.77 1.85 0.00 3.11 0.00 0.00 3.15 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.75 0.00 81 K 8.73 4.33 0.00 1.66 1.78 0.00 1.65 0.00 0.00 1.71 0.00 0.00 3.11 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.31 1.45 7.81 82 G 7.70 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 83 K 8.30 4.04 0.00 1.84 1.70 0.00 1.62 0.00 0.00 1.82 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.50 7.81 84 A 8.80 4.10 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 85 G 8.08 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 86 A 7.64 4.35 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 87 R 7.80 4.23 0.00 1.91 2.01 0.00 3.34 0.00 0.00 3.15 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.83 0.00 88 Q 7.90 4.26 0.00 2.05 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.87 6.98 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 89 N 8.86 4.59 0.00 2.81 2.72 0.00 0.00 6.90 7.63 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 90 S 8.81 4.19 0.00 4.10 4.13 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 91 K 8.06 3.98 0.00 1.84 2.04 0.00 1.80 0.00 0.00 1.93 0.00 0.00 2.99 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.54 1.49 7.81 92 E 8.96 4.55 0.00 2.21 2.01 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 2.35 2.30 0.00 93 D 8.29 4.31 0.00 2.85 2.84 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 94 W 8.35 4.16 0.00 3.49 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 95 E 8.31 3.72 0.00 2.26 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 2.43 2.69 0.00 96 S 8.20 3.98 0.00 3.93 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 97 R 8.12 3.76 0.00 1.84 1.80 0.00 3.36 0.00 0.00 3.11 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.75 0.00 98 I 7.50 3.17 0.56 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.35 0.16 0.35 0.00 0.00 99 R 7.62 3.77 0.00 2.07 1.89 0.00 3.21 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 100 A 7.69 3.93 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 0.00 101 Q 7.88 3.89 0.00 2.13 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.75 0.00 0.00 0.00 0.00 0.00 2.34 2.46 0.00 102 R 7.98 4.01 0.00 1.98 2.02 0.00 2.95 0.00 0.00 3.03 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.53 0.00 103 T 8.16 3.94 4.47 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 0.00 0.00 0.00 1.21 0.00 0.00 104 K 8.35 3.87 0.00 1.92 1.94 0.00 1.53 0.00 0.00 1.63 0.00 0.00 3.22 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.52 7.81 105 L 8.05 4.18 0.00 2.03 2.09 0.89 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 106 R 7.90 3.94 0.00 2.17 2.19 0.00 3.11 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 1.62 1.68 0.00 107 E 8.14 3.96 0.00 2.22 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 2.33 2.61 0.00 108 L 8.05 4.02 0.00 1.76 1.75 0.93 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 109 R 7.54 4.16 0.00 1.58 1.84 0.00 2.69 0.00 0.00 2.25 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.32 0.00 110 D 7.55 4.45 0.00 2.77 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 0.00 111 E 7.93 4.14 0.00 2.06 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.58 0.00 112 G 7.94 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 0.00 0.00 0.00 113 T 8.06 3.99 4.34 0.00 0.00 0.00 0.00 0.00 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 0.00 114 L 7.75 4.82 0.00 1.73 1.64 1.05 0.90 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 0.00 115 S 8.39 4.64 0.00 4.02 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 0.00 116 S 8.45 4.79 0.00 4.02 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 0.00 117 S 7.67 4.69 0.00 4.00 4.11 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 0.00 0.00 0.00 118 Q 8.61 4.08 0.00 2.16 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.51 0.00 119 Y 8.08 4.13 0.00 3.10 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 R 8.23 3.65 0.00 2.03 1.97 0.00 3.27 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.76 0.00 121 D 7.93 4.36 0.00 2.98 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 0.00 122 L 8.43 4.19 0.00 1.87 1.80 1.00 0.98 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 0.00 123 Y 8.53 3.86 0.00 2.44 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 0.00 124 D 8.10 4.51 0.00 2.80 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 0.00 125 K 7.88 3.99 0.00 1.88 1.42 0.00 1.72 0.00 0.00 1.48 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.33 1.53 7.81 126 A 8.51 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.08 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 0.00 0.00 0.00 128 G 7.70 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 0.00 0.00 0.00 129 G 8.43 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 0.00 130 E 7.87 3.87 0.00 1.16 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 2.07 1.89 0.00 131 F 7.31 5.17 0.00 3.16 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 0.00 132 D 8.99 4.57 0.00 2.73 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 0.00 133 S 7.60 4.67 0.00 3.93 3.95 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 0.00 134 V 8.41 3.52 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 1.07 0.00 0.00 0.89 0.00 0.00 135 A 7.98 4.09 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 0.00 136 D 7.85 4.32 0.00 2.82 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 0.00 137 L 7.61 3.09 0.00 1.44 1.64 -0.25 0.60 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 0.00 138 E 8.24 3.92 0.00 2.16 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 2.29 2.46 0.00 139 R 7.98 3.96 0.00 2.02 2.04 0.00 3.19 0.00 0.00 3.17 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.77 0.00 140 Y 7.56 4.19 0.00 3.10 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 0.00 141 I 7.91 3.96 1.98 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 1.55 0.77 0.91 0.00 0.00 142 D 7.80 4.46 0.00 2.65 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 0.00 143 A 7.86 3.93 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