NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2570 8.3144 119.9989 56.0245 33.6959 174.5850 2 E 3.7533 8.4693 119.2055 55.0704 29.8414 175.0693 3 T 4.1539 8.7336 118.4173 61.1761 72.2526 175.0451 4 A 4.0002 8.5090 123.1392 55.2084 18.5213 179.9496 5 A 4.1229 7.9850 118.7166 55.3423 18.5217 179.5982 6 A 4.0231 8.1638 119.3824 55.1429 18.3631 179.7740 7 K 4.1312 8.4420 119.9177 59.0227 32.1455 178.8529 8 F 4.1165 8.4501 121.0840 61.2508 39.3098 177.0345 9 E 4.0210 8.3395 117.8690 59.4401 29.0773 179.3185 10 R 3.8800 7.9862 117.6753 59.4791 30.2489 178.1180 11 Q 4.0263 8.0658 116.6515 57.5758 29.2166 176.1222 12 H 4.6105 7.9276 114.1620 54.1280 31.1632 173.3157 13 M 4.7922 7.9034 118.4861 53.5478 34.0744 176.3969 14 D 4.8180 8.8354 121.7453 53.2490 41.1467 175.8563 15 S 4.4027 8.3170 116.0730 60.2924 63.6811 175.9331 16 S 4.3887 7.8181 115.3945 60.1969 62.9026 174.2432 17 T 4.7523 7.4928 108.7640 59.8856 71.4804 174.0210 18 S 4.2811 8.5169 118.0241 60.2742 63.4919 173.7070 19 A 3.8471 6.8959 119.9839 50.8844 21.3801 175.2579 20 A 3.4467 8.4808 123.9052 51.9743 18.6462 178.2553 21 S 4.4794 8.4824 116.6947 58.9532 64.4429 173.6890 22 S 4.6230 7.4568 114.7883 56.9771 65.4155 174.9301 23 S 4.3270 8.5593 114.6493 60.4640 63.0539 174.5934 24 N 4.6964 8.0493 117.8385 53.6623 39.0521 176.0004 25 Y 4.0224 8.0479 120.3449 61.1710 38.6649 177.6102 26 C 4.2003 8.3230 116.8767 60.0844 39.5062 175.7465 27 N 4.4214 8.2495 117.4816 56.6346 38.1308 177.3723 28 Q 3.9146 7.9915 119.0971 59.2590 28.8575 178.7021 29 M 3.7599 7.6739 121.3354 57.8801 31.7851 178.7702 30 M 4.0629 8.1539 119.3012 57.9735 32.0134 178.8513 31 K 3.9128 7.6914 119.1426 59.5082 32.4809 179.1197 32 S 4.0739 8.0978 114.0101 61.2696 62.9483 175.6690 33 R 4.3503 7.9700 117.3431 55.5301 29.7536 175.9203 34 N 4.2868 7.9253 114.0484 54.4152 36.8040 175.4807 35 L 4.2070 7.9589 119.4958 56.5841 42.0185 178.5928 36 T 5.6127 7.5977 106.9205 60.5295 69.1450 175.4135 37 K 4.1438 8.3309 123.8643 60.2136 32.3507 177.5630 38 D 4.5858 7.9728 116.4174 56.0689 41.8245 176.2232 39 R 3.8706 7.2356 112.9205 55.4545 31.4139 174.1574 40 C 4.7171 8.7899 116.2864 55.9347 39.8583 174.1586 41 K 4.3049 8.0417 124.0270 55.6971 32.3367 175.9769 42 P 4.5946 0.0000 0.0000 65.4049 32.5948 176.4487 43 V 5.0895 7.6066 117.9124 61.2948 34.8648 174.0736 44 N 4.7346 9.0629 124.2487 52.7677 42.7132 172.9094 45 T 4.7715 7.9532 121.7976 61.6726 71.5879 172.9231 46 F 4.7823 8.9765 124.5002 55.6445 41.9639 174.6298 47 V 4.5375 9.0053 123.3340 61.0709 33.3441 175.7952 48 H 5.5129 8.7181 129.2159 53.8668 26.1387 173.3932 49 E 4.8004 7.6560 117.8537 53.3854 34.4454 176.4586 50 S 4.3881 8.3477 114.7891 58.2348 65.0831 174.9651 51 L 4.0079 8.5166 124.4471 58.3486 41.9076 179.1629 52 A 4.1957 8.0049 120.3010 55.3914 18.1373 179.2173 53 D 4.3597 7.8835 116.1657 57.2887 41.1497 178.8294 54 V 3.8254 7.6985 118.8888 65.9502 31.7495 178.1514 55 Q 3.9086 8.5991 118.0458 58.7538 28.5196 178.4695 56 A 4.0826 8.0609 121.3591 54.3620 18.2746 179.5689 57 V 3.5300 7.6722 116.9380 65.6221 31.3296 176.7697 58 C 3.8346 7.6519 114.5187 57.9431 39.8328 173.9550 59 S 4.6443 7.4418 114.2549 57.8075 64.0131 174.8098 60 Q 4.2044 7.5152 121.0445 55.8947 27.9803 176.8181 61 K 4.2057 7.6855 127.8596 57.1724 32.9657 176.2057 62 N 4.5142 8.8141 127.2139 53.8268 39.5291 174.3389 63 V 4.5468 8.2115 117.1734 59.7621 36.7626 173.9318 64 A 4.2951 8.3891 126.1820 52.0507 19.1547 178.5150 65 C 4.6646 9.0081 119.7204 56.2476 41.1338 175.2506 66 K 3.8173 9.3092 121.1453 59.9724 31.5364 178.3252 67 N 4.5682 8.0160 112.6611 53.5400 38.5840 175.4630 68 G 4.0351 8.0990 108.0175 45.4169 0.0000 174.7491 69 Q 4.0998 7.9416 118.4355 56.6514 29.1915 176.6572 70 T 4.4804 8.3493 109.8388 61.6749 69.2524 174.1119 71 N 4.9730 7.8467 118.5856 53.7158 38.6373 174.8813 72 C 5.3214 7.3404 116.4803 56.8935 44.3016 172.6196 73 Y 5.0945 8.9118 118.4852 56.4607 41.9475 173.7691 74 Q 5.0832 9.0287 125.2164 54.0390 31.2361 174.9676 75 S 4.3248 8.7234 122.0418 58.7188 63.1826 174.3323 76 Y 4.4663 9.0467 121.5530 60.5705 37.9010 176.4819 77 S 5.0520 7.8438 112.5597 56.5997 65.5458 174.3404 78 T 4.2807 8.2593 110.8530 61.9935 69.9755 173.4307 79 M 5.0441 8.8338 121.4108 53.4706 37.2141 174.5126 80 S 4.8614 9.4007 116.9938 58.1616 63.4931 173.0936 81 I 5.1873 9.1412 120.5760 59.4400 41.6118 174.3127 82 T 4.9389 8.8832 119.8199 61.9457 71.6186 172.4790 83 D 4.9613 9.4090 127.5030 53.2072 43.1160 174.2074 84 C 5.6309 9.1189 123.8200 55.3648 41.2055 173.1252 85 R 5.3442 8.7739 122.3178 53.8980 33.5293 174.7339 86 E 4.0393 9.0696 125.4044 56.8351 30.3823 176.4754 87 T 4.4258 8.4346 116.9025 59.8778 71.1421 175.9671 88 G 3.5956 8.7291 110.4072 48.3782 0.0000 174.5825 89 S 4.4533 7.4109 112.5673 58.3241 63.2732 174.3762 90 S 3.9899 7.7553 117.0178 58.0833 62.5426 173.6100 91 K 4.3179 8.6866 128.6329 54.8565 33.7606 174.3819 92 Y 4.2022 8.7751 127.5349 57.9334 38.8572 174.3626 93 P 3.1377 0.0000 0.0000 62.8243 32.4844 176.7354 94 N 4.6087 7.8532 119.9619 52.1401 36.9503 173.3295 95 C 4.5858 7.8966 116.7399 56.6951 42.6745 173.3202 96 A 4.9383 8.6513 125.5509 50.3442 21.8062 174.5544 97 Y 5.0903 8.5339 117.6804 56.0418 42.6264 174.5793 98 K 4.5065 9.3394 123.7099 55.6736 34.0825 175.3031 99 T 4.8687 8.5740 124.1803 62.7792 70.0320 174.1908 100 T 4.5751 8.8138 123.0243 61.7852 71.7993 172.6419 101 Q 4.9277 8.7273 127.8647 54.8261 30.6063 174.2247 102 A 4.6327 8.9387 126.6534 51.2386 23.7730 174.5359 103 N 5.4595 8.6883 115.8826 51.8004 40.6843 174.3859 104 K 4.7672 8.7087 122.2471 54.7459 37.5580 175.7446 105 H 4.8933 9.1086 118.9060 55.7574 30.0801 174.8235 106 I 4.8928 8.6131 114.6170 59.2387 40.8730 174.3306 107 I 4.8265 8.0951 124.4383 59.7448 39.8104 175.1706 108 V 4.7510 8.6288 119.2944 59.3551 36.1187 174.2485 109 A 5.1842 8.7576 124.0604 50.7179 21.1160 175.4815 110 C 5.1946 8.6768 118.5554 55.3660 37.7079 173.2465 111 E 4.6971 8.5890 119.7915 56.5861 34.3570 176.2627 112 G 4.0599 9.5392 109.0689 44.8735 0.0000 171.7624 113 N 5.0411 8.2891 117.2269 51.2004 40.5458 172.9990 114 P 4.3072 0.0000 0.0000 62.6955 31.9931 176.1763 115 Y 4.8325 8.3048 122.4468 56.9356 38.7488 174.5773 116 V 4.4421 8.0607 119.0875 58.3547 36.5952 173.4592 117 P 4.5065 0.0000 0.0000 62.7897 31.3732 177.0307 118 V 4.5061 8.4528 114.6502 60.9990 33.9796 175.0500 119 H 4.9723 7.8425 119.5757 55.0949 33.3921 171.7759 120 F 4.5585 8.8133 128.1489 57.4053 39.4387 174.3661 121 D 4.5462 8.3049 126.8800 55.9442 41.9680 175.8167 122 A 4.6033 6.4832 117.3571 51.5495 22.5156 174.7164 123 S 5.2010 8.9156 113.7290 56.7454 65.4560 174.7431 124 V 4.1569 8.7131 116.4519 61.5276 32.5827 175.3508 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 8.31 4.26 0.00 1.89 1.94 0.00 1.57 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.31 1.45 7.81 2 E 8.47 3.75 0.00 2.11 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 2.40 2.38 0.00 3 T 8.73 4.15 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 4 A 8.51 4.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.99 4.12 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 6 A 8.16 4.02 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 K 8.44 4.13 0.00 1.92 2.02 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.31 7.81 8 F 8.45 4.12 0.00 3.19 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 9 E 8.34 4.02 0.00 2.32 2.04 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 2.49 2.64 0.00 10 R 7.99 3.88 0.00 1.80 2.07 0.00 3.37 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.67 0.00 11 Q 8.07 4.03 0.00 1.55 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.46 0.00 0.00 0.00 0.00 0.00 2.24 2.49 0.00 12 H 7.93 4.61 0.00 1.87 2.65 0.00 5.59 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 7.90 4.79 0.00 1.97 2.15 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.64 0.00 14 D 8.84 4.82 0.00 2.74 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 S 8.32 4.40 0.00 3.93 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 16 S 7.82 4.39 0.00 4.04 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 17 T 7.49 4.75 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 1.27 0.00 0.00 18 S 8.52 4.28 0.00 3.82 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 19 A 6.90 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 A 8.48 3.45 0.79 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 0.00 0.00 21 S 8.48 4.48 0.00 3.97 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 22 S 7.46 4.62 0.00 3.99 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 23 S 8.56 4.33 0.00 4.03 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 N 8.05 4.70 0.00 2.82 2.88 0.00 0.00 6.45 7.31 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 25 Y 8.05 4.02 0.00 3.14 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 C 8.32 4.20 0.00 3.18 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 27 N 8.25 4.42 0.00 3.04 2.92 0.00 0.00 7.10 7.61 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 28 Q 7.99 3.91 0.00 1.92 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.82 0.00 0.00 0.00 0.00 0.00 2.31 2.34 0.00 29 M 7.67 3.76 0.00 0.78 1.16 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.59 0.00 30 M 8.15 4.06 0.00 1.74 1.94 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 2.52 0.00 31 K 7.69 3.91 0.00 1.93 1.74 0.00 1.61 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.42 7.81 32 S 8.10 4.07 0.00 3.97 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 R 7.97 4.35 0.00 1.97 2.13 0.00 3.67 0.00 0.00 3.20 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.84 0.00 34 N 7.93 4.29 0.00 2.89 2.92 0.00 0.00 6.94 7.44 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 35 L 7.96 4.21 0.00 1.89 1.66 0.87 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.60 5.61 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 1.44 0.00 0.00 37 K 8.33 4.14 0.00 1.96 1.93 0.00 1.80 0.00 0.00 1.73 0.00 0.00 3.02 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.47 1.49 7.81 38 D 7.97 4.59 0.00 2.69 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 39 R 7.24 3.87 0.00 1.82 1.80 0.00 2.93 0.00 0.00 3.29 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.57 0.00 40 C 8.79 4.72 0.00 3.11 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 41 K 8.04 4.30 0.00 1.87 1.79 0.00 1.85 0.00 0.00 1.72 0.00 0.00 3.22 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.41 7.81 42 P 0.00 4.59 0.00 2.16 2.34 0.00 3.70 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.99 0.00 43 V 7.61 5.09 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 0.79 0.00 0.00 0.98 0.00 0.00 44 N 9.06 4.73 0.00 2.62 2.24 0.00 0.00 6.89 6.81 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 45 T 7.95 4.77 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 0.83 0.00 0.00 46 F 8.98 4.78 0.00 2.98 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 47 V 9.01 4.54 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 1.14 0.00 0.00 1.04 0.00 0.00 48 H 8.72 5.51 0.00 3.14 3.45 0.00 5.62 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.66 4.80 0.00 1.95 1.85 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 2.26 2.28 0.00 50 S 8.35 4.39 0.00 4.07 4.02 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 0.00 0.00 0.00 0.00 51 L 8.52 4.01 0.00 1.83 1.74 1.03 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 52 A 8.00 4.20 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 53 D 7.88 4.36 0.00 2.89 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 54 V 7.70 3.83 2.19 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 1.22 0.00 0.00 1.09 0.00 0.00 55 Q 8.60 3.91 0.00 2.21 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.31 2.48 0.00 56 A 8.06 4.08 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 57 V 7.67 3.53 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 1.03 0.00 0.00 0.95 0.00 0.00 58 C 7.65 3.83 0.00 2.91 2.69 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 59 S 7.44 4.64 0.00 3.91 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 60 Q 7.52 4.20 0.00 1.77 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.95 0.00 0.00 0.00 0.00 0.00 2.06 2.23 0.00 61 K 7.69 4.21 0.00 2.00 1.80 0.00 1.57 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.46 1.43 7.81 62 N 8.81 4.51 0.00 2.78 2.65 0.00 0.00 7.03 7.71 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 63 V 8.21 4.55 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 0.64 0.00 0.00 0.82 0.00 0.00 64 A 8.39 4.30 1.19 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 65 C 9.01 4.66 0.00 2.91 3.02 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 0.00 0.00 0.00 0.00 66 K 9.31 3.82 0.00 1.70 1.89 0.00 1.72 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.61 7.81 67 N 8.02 4.57 0.00 2.86 2.83 0.00 0.00 7.18 7.65 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 68 G 8.10 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 Q 7.94 4.10 0.00 2.13 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.86 0.00 0.00 0.00 0.00 0.00 2.43 2.40 0.00 70 T 8.35 4.48 4.18 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 1.17 0.00 0.00 71 N 7.85 4.97 0.00 3.06 3.15 0.00 0.00 6.08 7.68 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 72 C 7.34 5.32 0.00 2.99 2.88 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 73 Y 8.91 5.09 0.00 2.78 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 74 Q 9.03 5.08 0.00 2.02 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.98 0.00 0.00 0.00 0.00 0.00 2.24 2.24 0.00 75 S 8.72 4.32 0.00 3.92 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 76 Y 9.05 4.47 0.00 3.07 2.98 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 77 S 7.84 5.05 0.00 3.90 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 78 T 8.26 4.28 4.16 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 0.99 0.00 0.00 79 M 8.83 5.04 0.00 1.97 1.99 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.49 0.00 80 S 9.40 4.86 0.00 3.90 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 81 I 9.14 5.19 1.89 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.76 1.01 0.00 0.00 82 T 8.88 4.94 4.41 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 1.30 0.00 0.00 83 D 9.41 4.96 0.00 2.69 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 C 9.12 5.63 0.00 2.95 2.85 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 85 R 8.77 5.34 0.00 1.83 1.83 0.00 3.18 0.00 0.00 3.13 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 86 E 9.07 4.04 0.00 1.99 1.78 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 2.13 1.89 0.00 87 T 8.43 4.43 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 1.21 0.00 0.00 88 G 8.73 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.41 4.45 0.00 3.88 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 90 S 7.76 3.99 0.00 3.81 3.75 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 91 K 8.69 4.32 0.00 1.80 1.60 0.00 1.71 0.00 0.00 1.57 0.00 0.00 2.85 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.36 1.38 7.81 92 Y 8.78 4.20 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 93 P 0.00 3.14 0.00 1.77 1.15 0.00 3.66 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.75 0.00 94 N 7.85 4.61 0.00 2.87 2.76 0.00 0.00 6.98 7.21 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 95 C 7.90 4.59 0.00 3.15 3.10 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 0.00 0.00 0.00 96 A 8.65 4.94 1.10 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 0.00 0.00 0.00 0.00 0.00 97 Y 8.53 5.09 0.00 2.86 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 98 K 9.34 4.51 0.00 1.83 1.73 0.00 1.64 0.00 0.00 1.68 0.00 0.00 2.87 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.45 7.81 99 T 8.57 4.87 4.31 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 1.28 0.00 0.00 100 T 8.81 4.58 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 1.23 0.00 0.00 101 Q 8.73 4.93 0.00 1.94 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.74 0.00 0.00 0.00 0.00 0.00 2.19 2.37 0.00 102 A 8.94 4.63 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 0.00 103 N 8.69 5.46 0.00 2.57 2.74 0.00 0.00 6.65 7.61 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 0.00 104 K 8.71 4.77 0.00 1.75 1.85 0.00 1.71 0.00 0.00 1.69 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.45 7.81 105 H 9.11 4.89 0.00 3.21 3.24 0.00 5.57 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.61 4.89 1.81 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.82 1.14 0.00 0.00 107 I 8.10 4.83 1.67 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.73 0.84 0.00 0.00 108 V 8.63 4.75 1.95 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 0.68 0.00 0.00 0.80 0.00 0.00 109 A 8.76 5.18 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 C 8.68 5.19 0.00 1.80 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 E 8.59 4.70 0.00 1.86 1.81 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 2.26 2.24 0.00 112 G 9.54 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 N 8.29 5.04 0.00 2.65 2.70 0.00 0.00 6.87 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 0.00 114 P 0.00 4.31 0.00 2.09 1.99 0.00 3.74 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00 115 Y 8.30 4.83 0.00 2.77 2.85 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 0.00 116 V 8.06 4.44 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 0.68 0.00 0.00 0.86 0.00 0.00 117 P 0.00 4.51 0.00 0.49 1.08 0.00 3.33 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.76 0.00 118 V 8.45 4.51 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 0.63 0.00 0.00 0.89 0.00 0.00 119 H 7.84 4.97 0.00 3.30 3.12 0.00 5.85 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.81 4.56 0.00 2.58 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 D 8.30 4.55 0.00 2.57 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 A 6.48 4.60 1.18 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 0.00 0.00 123 S 8.92 5.20 0.00 3.98 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 0.00 124 V 8.71 4.16 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 0.67 0.00 0.00 0.94 0.00 0.00