NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1771 8.1727 122.0503 56.2941 34.2048 174.1139 2 V 4.5394 8.1128 125.9599 60.7313 32.4014 174.5801 3 F 4.4517 9.9543 128.8622 57.4753 40.3011 174.9741 4 E 4.3567 8.8352 120.3231 55.6568 31.0607 177.3030 5 R 3.3317 8.8867 121.7864 60.3543 29.9985 179.6510 6 C 4.3254 8.0454 115.3264 59.7089 39.7275 175.5364 7 E 3.8939 8.1583 120.6715 59.3073 29.2168 178.5716 8 L 3.5923 8.0336 120.0766 57.8009 42.0686 178.6682 9 A 3.9537 7.8561 120.8242 55.3163 18.3014 179.8967 10 R 3.9017 8.1409 116.5538 59.4893 30.2305 179.4422 11 T 3.8261 7.8370 115.5702 66.6899 68.6247 176.7080 12 L 3.8652 8.1341 121.2671 57.4505 41.6028 179.4546 13 K 3.8932 8.0989 119.5451 59.7484 31.9556 179.0112 14 R 3.9781 7.7075 116.8318 59.0266 30.0242 178.1122 15 L 4.3424 7.4518 115.6248 54.1133 41.8521 176.8091 16 G 3.8212 7.8887 106.8547 47.1074 0.0000 175.0829 17 M 3.9268 7.6956 120.3077 56.1232 32.5603 175.9073 18 D 4.4529 8.0058 118.0595 56.0045 41.2314 175.9004 19 G 3.9663 9.4371 115.8626 45.3277 0.0000 171.5813 20 Y 4.2208 8.2820 122.1047 58.9659 38.9914 176.4028 21 R 3.6043 9.0264 126.5800 57.2483 27.9029 177.0931 22 G 3.8221 8.1375 102.7351 45.7445 0.0000 173.8537 23 I 4.1671 7.8320 122.1551 58.9456 38.3177 175.8899 24 S 4.7271 8.3494 120.2515 57.7014 63.9940 174.7588 25 L 4.2026 9.3429 124.0012 58.7660 41.6371 179.4139 26 A 4.1428 8.1986 119.9169 55.2402 18.1871 179.3205 27 N 4.4158 8.2549 115.0484 56.4083 38.6297 177.6316 28 W 4.2934 8.0329 119.8317 59.9761 29.0781 178.3344 29 M 4.1434 8.5011 118.7363 58.5871 31.4821 177.7282 30 C 3.0326 8.1672 118.8418 59.3032 43.4108 175.2974 31 L 3.9427 8.3444 121.7743 58.3879 41.7355 178.8576 32 A 4.0916 8.3680 120.6687 54.8341 18.2320 179.4254 33 K 2.8159 8.2079 118.3849 59.4056 32.0422 179.1418 34 W 4.2645 7.6755 117.3302 59.1578 29.0561 178.4765 35 E 4.3127 8.4276 118.7968 58.6796 29.1617 177.7893 36 S 4.5351 7.8302 109.7577 56.6181 64.3396 174.3397 37 G 3.2596 8.2067 108.8337 47.0185 0.0000 173.3972 38 Y 3.6337 7.5602 113.2257 58.5881 35.1266 168.8232 39 N 5.2511 7.6928 119.1198 52.1614 39.9676 175.7574 40 T 4.1838 8.9432 117.3852 63.7799 69.2757 176.0068 41 R 4.4221 8.0155 116.9381 55.7373 30.1289 176.3111 42 A 4.3379 7.6194 121.4486 52.7988 19.4049 176.9903 43 T 4.9719 8.3428 110.7064 59.9941 72.3987 172.9730 44 N 4.8809 8.7907 122.0631 52.1393 41.9387 172.4501 45 Y 4.5452 8.7061 127.9640 57.3870 40.8446 174.0155 46 N 4.7259 8.1974 124.2996 51.0540 38.3449 175.1402 47 A 3.6784 8.2725 127.0408 54.8164 18.9368 179.2591 48 G 3.8065 8.1039 104.0306 48.1884 0.0000 173.7328 49 D 4.7041 7.4059 114.6330 51.9053 40.3125 175.6835 50 R 3.9176 8.1485 116.4634 57.0034 28.1103 175.8933 51 S 4.8934 7.8296 113.0058 57.2362 66.1753 172.7200 52 T 5.0174 8.7701 115.5096 61.9359 72.8012 172.8903 53 D 5.3816 8.7700 124.9907 53.1914 43.1204 175.1131 54 Y 5.0464 9.1956 121.1912 57.4715 41.7957 177.3669 55 G 4.3797 9.0382 111.4613 46.2041 0.0000 173.4954 56 I 3.9406 8.2567 116.8377 62.9282 37.9365 177.4720 57 F 4.6991 8.0005 115.6517 56.3052 39.7718 175.4418 58 Q 3.5798 7.8764 119.0263 57.1446 26.5163 174.0133 59 I 4.4177 8.2604 119.0878 61.0709 39.3327 176.6994 60 N 5.3911 9.1941 125.9547 53.1753 39.7013 175.8482 61 S 4.5314 9.2708 121.3829 61.0749 63.3262 175.5752 62 R 3.7247 8.7518 122.2246 58.6294 30.3117 177.7997 63 Y 4.3377 7.5545 114.6021 57.5799 40.5906 176.8785 64 W 5.0221 8.1309 118.9898 57.5484 31.2405 174.0049 65 C 5.6182 8.1574 111.5966 53.6410 45.5473 172.9597 66 N 5.0023 9.0486 119.4265 52.3303 39.9962 174.8915 67 D 4.8289 8.7652 123.6885 52.1787 40.7232 177.9720 68 G 4.1281 8.5027 110.8077 46.0790 0.0000 174.7951 69 K 4.3720 8.0578 116.0712 56.7274 33.0702 176.0869 70 T 4.4483 7.7107 117.4251 61.5192 69.4455 172.8289 71 P 4.3206 0.0000 0.0000 63.7177 32.0525 176.0510 72 G 3.8786 8.5093 107.8725 46.5376 0.0000 173.1268 73 A 4.5015 7.7848 119.9873 50.5188 20.6720 177.1193 74 V 4.4807 8.2009 112.6281 59.6751 35.5468 176.1292 75 N 4.9444 8.0603 116.0981 51.6474 38.4647 174.2130 76 A 3.9205 8.7562 124.3695 55.2378 19.0697 178.5425 77 C 4.4744 8.5127 110.9404 57.4050 41.0033 173.0185 78 H 4.0954 8.1060 116.3874 56.5727 26.2467 174.0999 79 L 4.8182 8.2315 117.3363 52.8977 46.4571 176.5951 80 S 4.6339 8.3542 115.0213 58.0886 63.2993 176.0433 81 C 4.0963 8.7747 124.1383 59.7288 40.6164 176.3250 82 S 3.9298 7.8086 114.5311 61.4129 61.6353 176.0183 83 A 4.0254 7.7555 122.3591 54.6765 17.9205 178.5556 84 L 4.4618 7.8390 115.8730 55.0376 41.6827 177.6509 85 L 4.9816 7.6669 117.9225 54.4758 42.4671 176.7580 86 Q 4.3366 7.7531 117.8031 55.4910 29.4334 176.0177 87 D 4.4139 8.5106 119.7290 57.0679 41.1474 176.7245 88 N 4.5418 8.0577 118.2435 53.2674 39.0971 174.7509 89 I 4.2158 8.4450 118.8748 61.0668 38.0488 177.0123 90 A 3.9453 8.1303 124.5183 55.3298 18.1882 178.3201 91 P 4.1639 0.0000 0.0000 65.5846 31.3959 178.7208 92 A 4.1023 7.9833 119.2545 55.1076 18.3386 179.7492 93 V 3.3611 8.2444 116.9942 66.0452 31.7406 178.1449 94 A 3.8356 8.1441 120.7500 55.1316 18.0465 178.8958 95 C 4.1752 8.2357 116.8779 59.7666 38.6226 175.5631 96 A 3.8697 8.0791 122.5560 55.0625 17.5691 179.7787 97 K 3.7432 7.6007 116.1985 59.4556 32.4333 179.1395 98 R 4.0578 7.6782 118.6680 59.3312 29.8970 178.5266 99 V 2.3694 7.5345 118.1853 65.8403 31.1117 178.1767 100 V 3.8511 7.7141 110.1689 63.0699 31.2437 178.1616 101 R 4.1062 7.6913 117.2322 57.3469 30.4987 176.5801 102 D 4.7035 7.3439 118.9909 52.8816 41.8655 175.3517 103 P 4.2372 0.0000 0.0000 66.1337 31.4966 178.2376 104 Q 4.0059 8.1773 116.2788 56.7242 29.8763 177.5264 105 G 3.6841 8.0463 107.2197 46.7500 0.0000 175.6429 106 I 3.6079 7.7751 119.3253 63.5063 38.0093 178.2657 107 R 4.1965 7.2890 117.7167 58.1534 30.0276 177.4847 108 A 4.0774 7.5059 120.4191 54.2158 18.6780 177.5679 109 W 4.7763 8.1107 116.7571 55.2921 30.0708 177.7886 110 V 3.7827 8.7096 124.5044 64.7985 30.8614 178.0599 111 A 4.0004 8.3201 121.0148 54.7032 18.1222 179.1960 112 W 4.0053 8.2907 126.6885 60.6933 30.6053 178.3974 113 R 3.6838 8.1898 116.0992 59.3251 29.6755 178.3989 114 N 4.3300 8.0639 114.8394 55.8947 38.6856 176.9516 115 R 3.9925 7.9223 116.6529 56.2096 31.1948 176.4622 116 C 4.5775 7.7926 115.1509 57.4371 42.8378 174.4008 117 Q 3.2082 6.5949 119.7332 57.0203 28.7636 175.1966 118 N 4.1782 8.6322 120.5180 54.2356 36.1592 173.8407 119 R 4.4520 7.2546 116.2255 54.0740 32.7222 175.8489 120 D 4.5448 8.3878 118.7696 54.1302 40.3192 175.8810 121 V 4.4819 8.1974 119.0681 61.4254 32.4127 178.4866 122 R 4.0490 8.0983 121.9674 59.1911 29.3559 178.4145 123 Q 4.0596 8.1836 117.0989 60.0320 27.9292 178.9507 124 Y 4.3403 7.6285 116.4795 59.6538 38.2971 177.1818 125 V 4.3937 7.8475 111.3014 60.4765 33.1278 175.5020 126 Q 4.1587 7.6438 118.4314 57.4739 28.5836 176.8334 127 G 3.9049 8.8324 109.1712 46.4598 0.0000 174.6425 128 C 4.4408 8.1140 115.6440 56.4802 40.6063 174.1801 129 G 3.8532 8.1071 107.2222 46.6852 0.0000 174.1496 130 V 3.9922 7.8648 118.0916 61.0656 31.9433 175.9154 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 4.18 0.00 1.72 1.83 0.00 1.30 0.00 0.00 1.21 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.95 1.01 7.81 2 V 8.11 4.54 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 0.90 0.00 0.00 0.95 0.00 0.00 3 F 9.95 4.45 0.00 2.89 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 8.84 4.36 0.00 1.91 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 0.00 2.28 2.39 0.00 5 R 8.89 3.33 0.00 1.90 1.93 0.00 3.46 0.00 0.00 3.47 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.74 0.00 6 C 8.05 4.33 0.00 3.00 3.11 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 7 E 8.16 3.89 0.00 2.06 2.25 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 2.62 2.43 0.00 8 L 8.03 3.59 0.00 1.34 1.36 -0.09 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.86 3.95 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 10 R 8.14 3.90 0.00 1.87 1.99 0.00 3.14 0.00 0.00 3.29 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 11 T 7.84 3.83 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 1.21 0.00 0.00 12 L 8.13 3.87 0.00 1.72 1.59 0.94 0.31 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 13 K 8.10 3.89 0.00 1.93 1.92 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.50 7.81 14 R 7.71 3.98 0.00 1.99 1.96 0.00 3.25 0.00 0.00 3.48 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 15 L 7.45 4.34 0.00 1.65 1.56 0.85 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.89 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 17 M 7.70 3.93 0.00 1.28 1.95 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.23 0.00 18 D 8.01 4.45 0.00 2.68 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 19 G 9.44 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 20 Y 8.28 4.22 0.00 3.31 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 21 R 9.03 3.60 0.00 1.86 1.84 0.00 3.28 0.00 0.00 3.02 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 1.38 0.00 22 G 8.14 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 23 I 7.83 4.17 1.76 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.51 -0.22 0.00 0.00 24 S 8.35 4.73 0.00 4.07 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 25 L 9.34 4.20 0.00 2.00 1.82 0.99 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.20 4.14 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 8.25 4.42 0.00 2.83 2.75 0.00 0.00 6.94 7.69 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 28 W 8.03 4.29 0.00 3.58 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 29 M 8.50 4.14 0.00 2.17 2.38 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.94 0.00 30 C 8.17 3.03 0.00 2.66 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 31 L 8.34 3.94 0.00 1.84 1.88 0.58 -0.18 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 32 A 8.37 4.09 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 33 K 8.21 2.82 0.00 1.67 1.45 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.30 0.00 0.00 2.61 0.00 0.00 0.00 0.00 0.60 1.43 7.81 34 W 7.68 4.26 0.00 3.34 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 8.43 4.31 0.00 2.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.39 0.00 36 S 7.83 4.54 0.00 4.09 4.15 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 37 G 8.21 3.26 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 0.00 38 Y 7.56 3.63 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 5.25 0.00 2.75 2.79 0.00 0.00 7.01 6.90 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 40 T 8.94 4.18 4.42 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 1.45 0.00 0.00 41 R 8.02 4.42 0.00 2.00 2.10 0.00 3.09 0.00 0.00 3.24 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.59 0.00 42 A 7.62 4.34 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 43 T 8.34 4.97 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 1.31 0.00 0.00 44 N 8.79 4.88 0.00 2.85 2.76 0.00 0.00 6.75 7.34 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 45 Y 8.71 4.55 0.00 2.99 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 N 8.20 4.73 0.00 2.67 2.59 0.00 0.00 6.69 7.53 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 47 A 8.27 3.68 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 48 G 8.10 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 49 D 7.41 4.70 0.00 2.70 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 50 R 8.15 3.92 0.00 2.03 2.19 0.00 3.13 0.00 0.00 3.19 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.53 0.00 51 S 7.83 4.89 0.00 3.98 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 52 T 8.77 5.02 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 0.59 0.00 0.00 53 D 8.77 5.38 0.00 2.70 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 54 Y 9.20 5.05 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 55 G 9.04 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 56 I 8.26 3.94 1.68 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 1.83 0.12 0.00 0.00 57 F 8.00 4.70 0.00 3.19 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 58 Q 7.88 3.58 0.00 2.51 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.67 6.83 0.00 0.00 0.00 0.00 0.00 2.41 2.68 0.00 59 I 8.26 4.42 2.15 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 1.46 1.14 1.11 0.00 0.00 60 N 9.19 5.39 0.00 3.08 3.02 0.00 0.00 6.97 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 61 S 9.27 4.53 0.00 4.04 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 62 R 8.75 3.72 0.00 1.55 1.11 0.00 2.65 0.00 0.00 2.92 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.12 0.00 63 Y 7.55 4.34 0.00 1.43 1.73 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 64 W 8.13 5.02 0.00 3.54 3.26 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 65 C 8.16 5.62 0.00 3.01 3.08 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 0.00 0.00 0.00 0.00 66 N 9.05 5.00 0.00 2.85 2.71 0.00 0.00 7.07 8.80 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 67 D 8.77 4.83 0.00 2.91 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 68 G 8.50 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 0.00 0.00 0.00 69 K 8.06 4.37 0.00 1.92 1.94 0.00 1.61 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.47 7.81 70 T 7.71 4.45 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 1.15 0.00 0.00 71 P 0.00 4.32 0.00 2.16 2.04 0.00 3.91 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.97 0.00 72 G 8.51 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 73 A 7.78 4.50 1.25 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 0.00 0.00 74 V 8.20 4.48 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 0.66 0.00 0.00 0.85 0.00 0.00 75 N 8.06 4.94 0.00 2.73 2.65 0.00 0.00 6.75 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 76 A 8.76 3.92 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 77 C 8.51 4.47 0.00 3.29 3.22 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 78 H 8.11 4.10 0.00 3.34 3.38 0.00 5.63 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 8.23 4.82 0.00 1.68 1.50 0.96 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.35 4.63 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 8.77 4.10 0.00 2.35 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 82 S 7.81 3.93 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 7.76 4.03 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 7.84 4.46 0.00 1.91 1.83 1.06 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.67 4.98 0.00 1.75 1.73 1.11 1.04 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 86 Q 7.75 4.34 0.00 2.23 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.73 7.11 0.00 0.00 0.00 0.00 0.00 2.38 2.55 0.00 87 D 8.51 4.41 0.00 2.65 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 88 N 8.06 4.54 0.00 2.70 2.76 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 8.45 4.22 1.80 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.00 1.00 0.00 0.00 90 A 8.13 3.95 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 P 0.00 4.16 0.00 2.19 2.12 0.00 3.70 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.15 0.00 92 A 7.98 4.10 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 93 V 8.24 3.36 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 0.71 0.00 0.00 0.91 0.00 0.00 94 A 8.14 3.84 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 95 C 8.24 4.18 0.00 3.14 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 96 A 8.08 3.87 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 97 K 7.60 3.74 0.00 1.60 1.42 0.00 1.27 0.00 0.00 0.79 0.00 0.00 2.30 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.30 0.83 7.81 98 R 7.68 4.06 0.00 1.99 2.10 0.00 3.27 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.91 0.00 99 V 7.53 2.37 1.77 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 -0.16 0.00 0.00 -0.65 0.00 0.00 100 V 7.71 3.85 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 1.02 0.00 0.00 1.44 0.00 0.00 101 R 7.69 4.11 0.00 2.09 2.05 0.00 3.23 0.00 0.00 3.37 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 2.11 0.00 102 D 7.34 4.70 0.00 3.02 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 4.24 0.00 2.01 2.12 0.00 3.68 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 2.02 2.13 0.00 104 Q 8.18 4.01 0.00 2.04 2.09 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 8.05 3.68 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 0.00 0.00 0.00 106 I 7.78 3.61 1.06 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 -0.47 0.00 0.00 107 R 7.29 4.20 0.00 1.97 2.04 0.00 3.22 0.00 0.00 3.27 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.51 0.00 108 A 7.51 4.08 0.92 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 0.00 109 W 8.11 4.78 0.00 3.52 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 0.00 110 V 8.71 3.78 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.98 0.00 0.00 111 A 8.32 4.00 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 0.00 112 W 8.29 4.01 0.00 3.49 3.48 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 0.00 113 R 8.19 3.68 0.00 1.98 1.98 0.00 3.34 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.99 0.00 114 N 8.06 4.33 0.00 2.52 2.71 0.00 0.00 7.01 7.18 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 0.00 115 R 7.92 3.99 0.00 1.21 0.66 0.00 2.21 0.00 0.00 2.38 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.14 0.00 116 C 7.79 4.58 0.00 1.66 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 0.00 117 Q 6.59 3.21 0.00 0.93 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.84 0.00 0.00 0.00 0.00 0.00 2.15 2.27 0.00 118 N 8.63 4.18 0.00 2.81 2.83 0.00 0.00 6.92 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 7.25 4.45 0.00 1.72 1.83 0.00 3.25 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 1.59 1.73 0.00 120 D 8.39 4.54 0.00 2.62 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 8.20 4.48 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 1.05 0.00 0.00 122 R 8.10 4.05 0.00 1.82 2.02 0.00 3.18 0.00 0.00 3.24 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.79 0.00 123 Q 8.18 4.06 0.00 2.01 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.90 0.00 0.00 0.00 0.00 0.00 2.02 1.21 0.00 124 Y 7.63 4.34 0.00 3.14 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 0.00 125 V 7.85 4.39 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 0.99 0.00 0.00 1.06 0.00 0.00 126 Q 7.64 4.16 0.00 2.20 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.25 0.00 0.00 0.00 0.00 0.00 2.60 2.31 0.00 127 G 8.83 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 0.00 128 C 8.11 4.44 0.00 3.09 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 0.00 129 G 8.11 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 V 7.86 3.99 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 0.75 0.00 0.00 0.96 0.00 0.00