NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 S 4.3370 8.3344 116.7633 58.6625 63.9941 176.3129 5 V 3.8236 8.6547 125.1499 60.8919 30.2435 168.4374 6 V 3.6605 8.4106 122.8395 62.5934 33.3866 175.0244 7 K 4.6255 8.3064 126.2319 54.9539 34.1955 175.7551 8 S 4.3260 8.2062 114.7501 61.7998 63.7603 175.1535 9 E 4.1802 7.6894 118.9501 55.9409 28.6531 176.2755 10 D 4.7293 7.3770 117.0618 54.4127 43.7648 177.8750 11 Y 4.2112 7.5533 116.2494 59.2581 37.7142 177.0617 12 A 4.4800 7.3221 121.0737 51.9983 19.5849 176.4390 13 L 4.8210 7.3334 115.5748 51.5278 44.5344 174.7686 14 P 4.2656 0.0000 0.0000 63.2692 31.6657 175.7387 15 S 4.8463 8.3449 115.4012 56.4692 66.0777 172.1406 16 Y 4.5737 8.3423 120.7200 56.4239 39.7237 174.8174 17 V 4.3563 7.1400 117.7611 59.7538 35.6874 174.8563 18 D 4.6095 8.5047 123.0205 52.7443 41.0673 176.1595 19 R 4.4587 7.9341 124.2495 54.2951 33.0259 175.7432 20 R 3.3893 8.7397 124.9641 59.1880 30.1562 177.0626 21 D 4.8133 7.9840 113.8716 53.6062 38.7736 176.2258 22 Y 4.7432 8.1302 121.5236 55.4992 38.6771 173.5986 23 P 4.6177 0.0000 0.0000 64.5194 32.1502 177.3284 24 L 4.6872 6.6902 118.4540 51.9547 40.4340 174.3328 25 P 4.8112 0.0000 0.0000 61.7734 32.2520 177.6210 26 D 4.6169 8.7976 119.2533 56.8060 40.9292 177.3277 27 V 4.5385 7.0466 106.9304 58.8564 35.3380 175.2834 28 A 4.1518 8.2898 124.3965 52.1893 18.9649 177.6458 29 H 3.7451 8.4036 120.8805 58.1052 29.9645 175.6988 30 V 3.9789 7.7350 120.3935 60.8531 31.3164 175.1205 31 K 4.0583 8.4634 127.5655 58.2087 33.2565 176.5936 32 N 4.7302 7.9001 116.8541 51.3369 39.2285 173.9918 33 L 4.3951 8.2601 124.2158 53.1466 43.0562 177.5969 34 S 4.2184 8.6277 118.3234 58.7302 64.1082 175.4892 35 A 4.0117 8.4673 123.2498 54.7247 18.0583 180.0198 36 S 4.0095 7.9328 112.6647 61.2761 63.6154 176.1476 37 Q 3.9898 8.1449 121.9622 59.0342 28.1382 179.6686 38 K 3.9754 8.3463 118.6399 59.0084 31.8992 178.7901 39 A 4.0101 7.3743 120.3230 53.9156 19.1044 179.1158 40 L 3.9212 8.5971 119.5507 58.2641 41.9455 179.2248 41 K 4.1054 7.9892 117.0997 58.6426 32.2462 178.8434 42 E 4.1817 7.6239 119.3283 58.9430 29.4629 178.7219 43 K 3.9074 8.3861 120.0555 59.6125 32.0834 178.1731 44 E 3.6163 8.2367 118.3584 59.2894 29.4855 178.3483 45 K 4.3025 8.0250 115.8850 56.9622 32.6327 176.2831 46 A 4.5306 8.3754 123.5262 49.8431 21.2975 176.3401 47 S 4.0036 8.2937 112.8499 58.6270 62.8272 175.2950 48 W 4.6451 8.5269 126.6680 59.2862 29.2371 178.5237 49 S 4.2524 7.8590 113.6576 61.2676 62.2577 175.4469 50 S 4.4440 7.8299 114.5905 59.3122 63.0214 174.4417 51 L 4.5203 7.7565 121.3228 54.0899 42.4721 177.2821 52 S 4.5906 10.3333 117.7966 57.4046 65.6376 175.3909 53 I 3.6361 8.3369 124.5355 65.1695 36.8844 178.0823 54 D 4.3674 8.1255 118.7114 57.5297 40.5781 178.7005 55 E 4.0046 8.0263 118.5316 59.0337 29.6121 179.1365 56 K 3.8082 8.6046 118.9990 59.8136 32.2089 179.3470 57 V 3.6295 7.9568 118.1637 66.0436 31.3661 177.6894 58 E 3.9895 8.1816 119.1197 59.1909 29.2245 178.7034 59 L 3.9979 8.2934 119.4822 57.9263 41.6207 178.9583 60 Y 4.1233 8.0260 119.1054 60.7763 38.6225 177.8932 61 R 4.4338 8.1442 118.7434 57.9586 30.3983 178.5936 62 L 4.0568 7.9837 119.6843 57.2397 41.6084 178.7772 63 K 3.8573 7.4905 118.6035 56.2619 32.3963 176.1661 64 F 5.2720 7.5373 117.2248 55.0703 41.3817 174.5429 65 K 3.6976 8.7002 126.3179 56.6880 32.5110 176.6903 66 E 4.8680 8.5839 120.8204 54.9624 31.8806 176.8883 67 S 5.4437 8.8189 118.4206 56.9771 65.7675 175.6318 68 F 3.8201 8.8920 119.6712 60.5163 38.4311 177.4563 69 A 4.0328 8.1912 118.6174 55.4564 18.4119 178.9439 70 E 4.0857 8.1664 116.9136 59.9863 29.4510 179.7131 71 M 4.1678 8.2947 115.6884 57.7090 31.2853 177.1203 72 N 4.7167 7.7463 115.8840 52.2030 39.3416 175.3982 73 R 4.1406 7.3430 117.9630 55.9461 30.2693 176.0368 74 S 4.7663 8.3249 114.1304 56.9183 65.3958 172.4384 75 T 4.7670 7.9776 109.5473 59.6035 71.7245 173.7094 76 N 4.7501 8.5308 116.3967 53.3896 38.4916 176.4897 77 E 3.8600 8.2021 124.3595 59.4230 29.4588 179.0466 78 W 4.2509 8.2791 116.0035 59.3611 27.9921 178.4490 79 K 3.1839 7.1855 119.5154 59.1957 31.3803 179.4485 80 T 3.7482 7.4936 115.4380 66.4959 68.4914 176.6019 81 V 3.5841 7.8986 120.2260 66.1487 31.6024 178.2597 82 V 3.7722 8.3300 118.3382 65.8686 31.4602 177.9900 83 G 3.6961 8.4261 105.6941 47.9606 0.0000 175.3229 84 A 4.1697 8.6693 123.7693 54.8267 18.3293 179.5483 85 A 4.1957 8.3368 119.2263 55.7690 18.4480 179.8463 86 M 4.0751 8.3820 117.2123 58.2017 31.8889 178.7581 87 F 4.0267 8.3223 121.0209 61.4320 39.6045 177.3143 88 F 3.9403 8.7646 117.7784 60.4206 38.4600 177.8649 89 I 3.9402 8.1242 119.3574 64.2593 37.1705 178.4031 90 G 3.6227 8.4429 107.2035 47.5842 0.0000 175.6005 91 F 3.9108 8.0302 123.1398 61.1813 39.2500 177.2482 92 T 3.7192 8.1892 115.3424 66.6027 68.2055 176.2862 93 A 3.9854 7.8013 121.7552 54.7771 18.2892 179.6651 94 L 3.8551 7.4446 117.9743 57.7479 41.6122 179.5083 95 L 4.0585 7.6340 119.1517 57.5241 41.5026 179.5490 96 L 4.0071 7.7363 118.6084 57.6605 41.6893 179.0921 97 I 3.6558 7.9121 120.0153 64.3593 37.1323 177.9498 98 W 4.2496 8.6777 129.2655 60.7355 30.3832 177.6134 99 E 3.8455 8.4655 119.0575 59.0377 28.4931 178.6635 100 K 3.9127 7.9595 119.7304 59.7954 32.0549 178.3408 101 H 3.9809 7.9608 117.4457 58.3467 29.8351 175.8134 102 Y 4.3464 7.2942 115.3001 57.2658 39.1565 176.1445 103 V 4.0588 7.5539 118.0640 64.2426 33.3359 175.4367 104 Y 4.6694 7.0145 113.9740 57.4301 38.3864 176.4599 105 G 3.9278 8.4098 115.3649 44.2234 0.0000 171.0249 106 P 4.4665 0.0000 0.0000 61.8125 32.3652 175.9394 107 I 3.8604 7.7825 113.3289 59.4150 38.6238 173.8280 108 P 4.2322 0.0000 0.0000 63.1162 31.8276 177.4036 109 H 4.1605 8.7827 117.3082 58.1788 28.3318 176.7829 110 T 2.7744 7.0782 108.6835 62.5002 68.7688 174.8789 111 F 4.4920 8.0764 120.2936 57.7997 39.9147 176.5810 112 E 4.0647 7.9660 121.0800 56.7798 31.1024 177.2911 113 E 4.0003 9.0653 123.1006 59.8765 29.5912 179.0482 114 E 4.0324 8.2524 118.5732 58.6202 29.8037 178.3559 115 W 3.8710 8.2558 128.1795 60.4230 30.9439 177.7320 116 V 3.6704 8.0839 117.9942 66.1812 30.8993 177.7538 117 A 4.0610 7.9840 120.0438 55.1601 18.2113 179.8599 118 K 3.7827 7.7816 116.5191 59.4869 32.0882 179.4330 119 Q 3.8307 8.3508 120.1633 59.2686 28.8695 178.2275 120 T 3.9781 8.4060 117.1446 66.6246 68.5189 176.1821 121 K 3.5478 7.7802 121.1185 59.5695 32.2494 178.4897 122 R 3.7674 7.9050 118.7772 59.8901 29.8153 178.2269 123 M 4.0646 8.4325 118.6711 58.5082 32.0735 178.8049 124 L 4.1131 8.1352 119.2391 57.7423 41.4591 179.2523 125 D 4.4541 8.6053 119.0823 56.9088 40.8588 177.6493 126 M 4.2582 7.9760 114.5378 54.2087 32.5424 175.6843 127 K 4.2649 7.8518 116.9184 57.2236 29.9107 176.7184 128 V 3.5475 8.2624 119.0500 64.4108 32.6174 174.6570 129 A 4.3110 8.6539 126.2742 53.0103 15.3368 174.8952 130 P 4.5493 0.0000 0.0000 64.0666 32.8556 179.7973 131 I 4.0257 7.8965 119.0716 63.5142 37.5749 176.5541 132 Q 4.4862 7.9673 114.0410 56.7902 32.5646 176.4932 133 G 3.8557 8.3223 105.7158 47.8595 0.0000 173.1317 134 F 4.8675 8.4171 121.2728 59.5377 43.9369 176.4800 135 S 4.2195 9.2063 116.5643 61.2856 63.1738 176.5717 136 A 4.1422 7.3862 122.4564 54.9218 18.2489 178.1990 137 K 4.4446 8.4539 113.5033 56.1866 32.7823 175.6961 138 W 4.5791 8.0684 129.9993 55.3974 32.0235 175.1033 139 D 4.4131 7.6013 125.8234 53.0404 39.9029 176.4756 140 Y 4.2803 8.4300 124.8150 60.0318 38.3332 177.1452 141 D 4.5681 8.0835 119.3059 56.7640 41.4624 178.0047 142 K 3.9479 8.2234 116.6945 56.8702 32.3913 176.5524 143 N 4.0171 7.8298 116.7499 53.7696 37.7212 172.4245 144 E 3.7276 6.0929 112.5929 53.7126 33.8926 174.4342 145 W 4.4138 7.9919 119.8743 56.3826 29.5769 176.7572 146 K 3.9254 8.9959 124.5391 56.5986 32.3553 177.3658 147 K 4.1411 8.4776 121.9382 56.8066 32.1094 176.9647 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 4 S 8.33 4.34 0.00 3.80 3.43 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 0.00 5 V 8.65 3.82 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 0.73 0.00 0.00 0.90 0.00 0.00 6 V 8.41 3.66 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 0.87 0.00 0.00 1.00 0.00 0.00 7 K 8.31 4.63 0.00 1.75 1.74 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.35 1.42 7.81 8 S 8.21 4.33 0.00 3.90 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 9 E 7.69 4.18 0.00 1.80 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 2.20 2.22 0.00 10 D 7.38 4.73 0.00 2.92 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 11 Y 7.55 4.21 0.00 2.99 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 12 A 7.32 4.48 1.04 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 13 L 7.33 4.82 0.00 1.73 1.54 0.87 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 14 P 0.00 4.27 0.00 2.06 2.04 0.00 3.62 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 15 S 8.34 4.85 0.00 3.98 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 16 Y 8.34 4.57 0.00 3.00 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 V 7.14 4.36 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 0.71 0.00 0.00 0.80 0.00 0.00 18 D 8.50 4.61 0.00 2.68 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 19 R 7.93 4.46 0.00 1.75 1.82 0.00 3.45 0.00 0.00 3.29 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 20 R 8.74 3.39 0.00 1.84 2.13 0.00 3.34 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 1.58 1.43 0.00 21 D 7.98 4.81 0.00 2.84 2.81 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 22 Y 8.13 4.74 0.00 2.94 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 23 P 0.00 4.62 0.00 2.27 2.37 0.00 3.68 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.00 0.00 24 L 6.69 4.69 0.00 1.58 1.67 0.95 1.22 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 25 P 0.00 4.81 0.00 2.04 1.89 0.00 3.84 0.00 0.00 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 2.02 0.00 26 D 8.80 4.62 0.00 2.73 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 27 V 7.05 4.54 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 0.73 0.00 0.00 1.12 0.00 0.00 28 A 8.29 4.15 1.14 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 29 H 8.40 3.75 0.00 1.68 2.91 0.00 5.93 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 V 7.74 3.98 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.76 0.00 0.00 31 K 8.46 4.06 0.00 1.87 1.88 0.00 1.59 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.34 1.42 7.81 32 N 7.90 4.73 0.00 2.67 2.78 0.00 0.00 6.89 7.85 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 33 L 8.26 4.40 0.00 1.61 1.58 0.90 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 34 S 8.63 4.22 0.00 4.03 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 35 A 8.47 4.01 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 36 S 7.93 4.01 0.00 4.06 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 Q 8.14 3.99 0.00 2.35 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.38 2.42 0.00 38 K 8.35 3.98 0.00 1.97 1.87 0.00 1.65 0.00 0.00 1.65 0.00 0.00 3.12 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.70 7.81 39 A 7.37 4.01 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 40 L 8.60 3.92 0.00 1.82 1.88 0.94 1.06 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 41 K 7.99 4.11 0.00 1.93 1.87 0.00 1.76 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.69 1.61 7.81 42 E 7.62 4.18 0.00 2.14 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 2.56 2.46 0.00 43 K 8.39 3.91 0.00 1.95 1.95 0.00 1.70 0.00 0.00 1.61 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.49 7.81 44 E 8.24 3.62 0.00 2.21 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 0.00 2.68 2.45 0.00 45 K 8.02 4.30 0.00 1.91 1.87 0.00 1.76 0.00 0.00 1.73 0.00 0.00 3.11 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.52 1.78 7.81 46 A 8.38 4.53 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 47 S 8.29 4.00 0.00 3.80 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 W 8.53 4.65 0.00 3.48 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 49 S 7.86 4.25 0.00 3.91 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 50 S 7.83 4.44 0.00 4.14 3.94 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 51 L 7.76 4.52 0.00 1.97 1.63 1.01 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 52 S 10.33 4.59 0.00 4.06 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 53 I 8.34 3.64 1.87 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 1.64 0.81 0.90 0.00 0.00 54 D 8.13 4.37 0.00 2.72 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 55 E 8.03 4.00 0.00 2.16 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 2.34 2.36 0.00 56 K 8.60 3.81 0.00 1.98 1.83 0.00 1.68 0.00 0.00 1.56 0.00 0.00 2.89 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.39 1.45 7.81 57 V 7.96 3.63 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 1.02 0.00 0.00 0.90 0.00 0.00 58 E 8.18 3.99 0.00 2.20 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 2.32 2.36 0.00 59 L 8.29 4.00 0.00 1.90 1.67 0.87 0.86 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 60 Y 8.03 4.12 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 61 R 8.14 4.43 0.00 1.89 2.04 0.00 3.51 0.00 0.00 3.53 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.77 0.00 62 L 7.98 4.06 0.00 1.81 1.63 0.89 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 63 K 7.49 3.86 0.00 1.49 1.28 0.00 0.99 0.00 0.00 1.30 0.00 0.00 2.81 0.00 0.00 2.68 0.00 0.00 0.00 0.00 0.30 0.21 7.81 64 F 7.54 5.27 0.00 2.47 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 65 K 8.70 3.70 0.00 0.98 1.87 0.00 1.68 0.00 0.00 1.73 0.00 0.00 2.92 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.24 7.81 66 E 8.58 4.87 0.00 2.25 1.90 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 2.43 2.27 0.00 67 S 8.82 5.44 0.00 4.12 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 F 8.89 3.82 0.00 3.10 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 69 A 8.19 4.03 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 70 E 8.17 4.09 0.00 2.23 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 0.00 2.36 2.36 0.00 71 M 8.29 4.17 0.00 2.07 2.11 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.66 0.00 72 N 7.75 4.72 0.00 2.86 2.91 0.00 0.00 7.01 7.74 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 73 R 7.34 4.14 0.00 1.95 1.95 0.00 3.05 0.00 0.00 3.29 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.59 0.00 74 S 8.32 4.77 0.00 4.03 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 75 T 7.98 4.77 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 76 N 8.53 4.75 0.00 2.70 2.69 0.00 0.00 6.40 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 77 E 8.20 3.86 0.00 2.09 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 0.00 2.34 2.36 0.00 78 W 8.28 4.25 0.00 3.67 3.32 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 79 K 7.19 3.18 0.00 1.34 1.36 0.00 1.32 0.00 0.00 1.21 0.00 0.00 2.83 0.00 0.00 3.13 0.00 0.00 0.00 0.00 0.30 0.45 7.81 80 T 7.49 3.75 4.36 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 1.18 0.00 0.00 81 V 7.90 3.58 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 1.06 0.00 0.00 1.00 0.00 0.00 82 V 8.33 3.77 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 1.09 0.00 0.00 1.14 0.00 0.00 83 G 8.43 3.70 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 0.00 0.00 0.00 84 A 8.67 4.17 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 85 A 8.34 4.20 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.38 4.08 0.00 2.15 2.33 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 2.88 2.60 0.00 87 F 8.32 4.03 0.00 3.08 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 88 F 8.76 3.94 0.00 3.26 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 89 I 8.12 3.94 1.98 0.00 0.00 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 1.52 0.65 0.94 0.00 0.00 90 G 8.44 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 0.00 0.00 0.00 91 F 8.03 3.91 0.00 2.59 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 92 T 8.19 3.72 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 1.22 0.00 0.00 93 A 7.80 3.99 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 94 L 7.44 3.86 0.00 1.41 1.52 0.84 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 95 L 7.63 4.06 0.00 1.72 1.63 0.92 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 96 L 7.74 4.01 0.00 1.83 1.72 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 97 I 7.91 3.66 2.02 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.99 0.89 0.00 0.00 98 W 8.68 4.25 0.00 3.40 3.43 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 0.00 99 E 8.47 3.85 0.00 2.27 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 1.47 2.01 0.00 100 K 7.96 3.91 0.00 2.02 1.90 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.46 7.81 101 H 7.96 3.98 0.00 2.89 3.00 0.00 5.95 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 Y 7.29 4.35 0.00 1.62 2.32 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 0.00 103 V 7.55 4.06 1.83 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 0.76 0.00 0.00 0.80 0.00 0.00 104 Y 7.01 4.67 0.00 3.10 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 0.00 105 G 8.41 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 0.00 106 P 0.00 4.47 0.00 2.15 2.01 0.00 3.73 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.91 0.00 107 I 7.78 3.86 1.41 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.47 0.56 0.00 0.00 108 P 0.00 4.23 0.00 2.30 1.96 0.00 3.51 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 2.25 2.09 0.00 109 H 8.78 4.16 0.00 3.45 3.49 0.00 5.65 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 T 7.08 2.77 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 0.03 0.00 0.00 111 F 8.08 4.49 0.00 3.02 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 0.00 112 E 7.97 4.06 0.00 2.26 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 2.40 2.49 0.00 113 E 9.07 4.00 0.00 2.09 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 2.44 2.45 0.00 114 E 8.25 4.03 0.00 2.13 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 2.38 2.37 0.00 115 W 8.26 3.87 0.00 3.62 3.32 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 0.00 116 V 8.08 3.67 2.30 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 0.89 0.00 0.00 1.12 0.00 0.00 117 A 7.98 4.06 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 0.00 118 K 7.78 3.78 0.00 1.62 1.52 0.00 1.43 0.00 0.00 1.29 0.00 0.00 2.81 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.30 1.31 7.81 119 Q 8.35 3.83 0.00 1.97 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.77 0.00 0.00 0.00 0.00 0.00 2.35 2.41 0.00 120 T 8.41 3.98 4.44 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 1.48 0.00 0.00 121 K 7.78 3.55 0.00 1.66 1.67 0.00 1.54 0.00 0.00 1.49 0.00 0.00 2.85 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.26 7.81 122 R 7.91 3.77 0.00 1.82 1.98 0.00 3.07 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.64 0.00 123 M 8.43 4.06 0.00 2.03 2.38 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.41 0.00 124 L 8.14 4.11 0.00 1.45 1.27 -0.81 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 125 D 8.61 4.45 0.00 2.74 2.71 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 0.00 126 M 7.98 4.26 0.00 2.17 2.16 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.83 0.00 127 K 7.85 4.26 0.00 1.99 1.99 0.00 1.51 0.00 0.00 1.12 0.00 0.00 2.43 0.00 0.00 2.20 0.00 0.00 0.00 0.00 1.61 1.27 7.81 128 V 8.26 3.55 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 0.81 0.00 0.00 0.91 0.00 0.00 129 A 8.65 4.31 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 0.00 0.00 0.00 0.00 0.00 0.00 130 P 0.00 4.55 0.00 2.28 2.51 0.00 3.76 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.02 0.00 131 I 7.90 4.03 1.92 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.47 0.94 0.00 0.00 132 Q 7.97 4.49 0.00 2.02 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.09 0.00 0.00 0.00 0.00 0.00 2.29 2.37 0.00 133 G 8.32 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 0.00 134 F 8.42 4.87 0.00 3.11 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 0.00 135 S 9.21 4.22 0.00 4.23 4.29 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 0.00 136 A 7.39 4.14 1.47 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 0.00 0.00 0.00 137 K 8.45 4.44 0.00 2.15 1.98 0.00 1.66 0.00 0.00 1.55 0.00 0.00 2.91 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.51 7.81 138 W 8.07 4.58 0.00 2.71 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 0.00 139 D 7.60 4.41 0.00 2.34 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 Y 8.43 4.28 0.00 3.06 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 D 8.08 4.57 0.00 2.81 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 0.00 142 K 8.22 3.95 0.00 1.52 1.72 0.00 1.75 0.00 0.00 1.55 0.00 0.00 2.91 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.39 1.55 7.81 143 N 7.83 4.02 0.00 2.83 2.80 0.00 0.00 6.92 7.24 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 0.00 144 E 6.09 3.73 0.00 1.73 1.68 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 1.85 1.94 0.00 145 W 7.99 4.41 0.00 3.15 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 0.00 146 K 9.00 3.93 0.00 1.76 1.75 0.00 1.73 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.40 1.34 7.81 147 K 8.48 4.14 0.00 1.72 1.70 0.00 1.74 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.43 1.41 7.81