NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5855 8.3049 120.3488 54.9167 34.6845 176.1985 2 K 4.4153 8.8077 125.7139 56.2650 32.4474 176.0157 3 T 4.6040 9.6380 112.1119 61.4701 71.9397 175.0484 4 F 4.4601 8.5581 119.0477 56.8299 41.1865 175.0293 5 T 4.7730 8.1426 116.1835 61.9691 68.0851 173.4213 6 A 4.4351 8.1590 130.0146 51.8900 19.5829 176.5900 7 K 4.6128 8.4547 118.2215 54.1511 34.2378 174.9827 8 P 4.7217 0.0000 0.0000 62.8165 31.4667 176.0133 9 E 4.4997 8.0713 117.8315 57.0230 30.6676 176.5126 10 T 4.4434 7.7670 106.9724 61.2442 69.2939 174.5017 11 V 4.1813 7.4008 115.6994 60.6539 33.0875 175.1620 12 K 4.7361 8.0456 119.1547 55.1125 35.8027 176.1688 13 R 4.6933 8.1385 117.1773 55.4344 31.8769 173.2210 14 D 4.8561 8.3403 119.5779 52.6952 45.9712 173.4425 15 W 4.5706 8.3225 120.5111 54.6105 30.6675 175.2763 16 Y 5.7540 8.2790 120.0899 55.1971 42.8240 174.3138 17 V 4.8372 8.1862 119.0843 61.6295 35.0239 174.5259 18 V 4.8253 8.4409 119.2568 60.2195 36.4352 173.0380 19 D 5.2920 8.6346 121.2597 52.6478 44.9985 174.4368 20 A 4.6545 8.4487 123.6882 50.5452 21.9108 175.9421 21 T 4.7995 7.6049 111.8724 60.1741 70.8579 174.0470 22 G 3.8643 9.0005 113.9494 45.6235 0.0000 173.0936 23 K 4.3426 7.6694 118.1288 55.5615 33.1748 177.3592 24 T 3.8524 8.4896 117.5250 65.7134 68.8991 175.2730 25 L 3.6424 7.7823 118.2573 54.8624 38.7738 174.0919 26 G 4.0597 7.4729 105.4688 45.9897 0.0000 173.9285 27 R 4.5684 8.1929 116.9562 55.9204 30.5069 176.2633 28 L 4.6870 7.5279 116.3917 53.7113 44.3010 178.5486 29 A 4.0611 8.1092 120.8759 55.1911 18.1498 179.2867 30 T 3.9514 7.8779 106.0544 63.9077 69.2997 175.4307 31 E 4.3655 7.6966 120.1136 57.9744 30.5884 178.0185 32 L 4.0300 7.8081 118.0890 57.2632 41.2454 179.0973 33 A 4.0333 7.7719 121.3909 54.7810 18.3727 179.4283 34 R 3.9065 7.6865 115.5556 58.3420 30.3006 179.1130 35 R 3.9285 7.6421 117.5204 58.5206 30.1635 177.9411 36 L 4.4542 7.5129 114.9424 54.9932 41.7902 177.8197 37 R 4.3980 7.7081 119.0016 55.6272 30.8310 177.9560 38 G 3.7465 7.9318 106.2103 45.5487 0.0000 173.1939 39 K 4.1432 8.1438 119.4435 57.4345 31.2711 176.2042 40 H 5.4468 8.1385 131.7719 56.7820 25.9347 176.7205 41 K 3.8340 7.1519 118.9215 56.7229 32.6628 176.4875 42 A 3.5503 7.8457 120.5844 52.9078 15.3612 177.1757 43 E 4.0076 7.7884 118.8765 57.3885 30.7154 178.1484 44 Y 3.5905 7.9669 115.1888 58.6408 35.3873 168.7024 45 T 4.9952 8.0760 114.8961 61.0477 72.0957 172.0820 46 P 4.7527 0.0000 0.0000 63.0876 32.9073 176.1946 47 H 4.3772 8.3858 114.4908 57.6768 29.1129 175.4820 48 V 4.1290 7.3869 120.8584 60.7295 32.0458 174.2764 49 D 4.9816 8.4190 126.7824 53.1692 43.2690 175.8762 50 T 4.4096 7.8505 116.4522 62.0059 70.5012 175.3510 51 G 3.9017 8.2928 114.9229 46.2562 0.0000 171.7587 52 D 4.5835 8.1278 117.9569 53.3735 45.2130 174.3113 53 Y 4.4074 7.5470 117.6121 56.7179 39.7209 174.9618 54 I 4.5887 7.7882 121.4299 60.2773 41.3162 173.6929 55 I 4.7791 8.3281 125.4402 59.8128 40.9154 174.3777 56 V 4.4655 8.4871 127.6750 61.4170 33.1373 175.7115 57 L 4.8667 8.4561 127.4205 54.4740 42.5858 175.8037 58 N 5.1735 7.8833 114.1133 52.8157 40.1057 174.7118 59 A 4.6299 8.2216 118.8590 52.2593 20.0772 176.5547 60 D 4.7259 7.8520 114.4371 55.1289 40.1382 176.0580 61 K 4.7711 7.9757 116.9445 56.4753 33.9532 175.8158 62 V 4.6834 7.8832 116.9237 59.9516 34.2012 174.3701 63 A 4.5272 8.2395 124.2538 50.7173 22.2415 175.6530 64 V 4.0374 7.8274 117.6054 62.8788 34.4507 176.8730 65 T 3.1248 8.7515 108.4057 62.2443 69.1159 170.7174 66 G 4.1622 10.4294 112.4549 45.2046 0.0000 173.9215 67 N 4.7866 7.2785 113.6964 53.3582 40.5797 175.4717 68 K 4.2486 8.0437 118.5187 57.2022 31.9159 177.5032 69 R 4.7411 7.7366 112.3574 57.6849 33.0110 176.3352 70 T 4.2990 7.8500 109.8399 63.7743 69.5798 176.5092 71 D 4.4855 7.8039 117.4511 53.6887 40.6491 174.6469 72 K 4.1600 7.4433 122.3466 55.7546 32.0024 176.1611 73 V 3.7514 7.7630 127.2233 61.6982 33.1134 174.5075 74 Y 4.3834 7.9328 121.2048 56.3433 41.7255 174.4029 75 Y 4.5992 8.2504 120.8166 56.7294 41.3613 174.4502 76 H 4.9112 8.4642 114.2721 55.0240 32.0878 172.8452 77 H 4.5783 8.8869 120.5958 55.7480 30.5341 176.4415 78 T 3.7662 7.9527 115.7884 62.8928 68.6775 174.8915 79 G 3.9093 7.6831 106.3083 45.9240 0.0000 172.6379 80 H 4.2927 8.5608 113.8855 56.4104 32.9906 174.6290 81 I 2.8014 8.5302 127.7453 61.9309 37.7743 172.5063 82 G 3.7474 8.3263 107.2763 45.2837 0.0000 171.0593 83 G 3.9280 8.1582 104.8237 44.0134 0.0000 172.8836 84 I 4.5266 7.8234 117.6734 59.7273 41.0055 173.5885 85 K 4.8580 9.0667 128.3104 54.8538 34.4245 175.3484 86 Q 4.9878 8.5967 120.7265 54.5692 31.5078 174.3487 87 A 4.7389 8.5925 121.9690 51.1170 23.5177 174.8644 88 T 4.9552 8.3689 113.9513 59.5471 71.4289 174.4205 89 F 4.1266 8.7022 122.2304 61.7473 38.1767 176.6994 90 E 3.9886 8.5893 117.3967 59.7564 29.2140 178.9705 91 E 4.1445 8.1545 118.4442 58.9152 29.9350 177.5800 92 M 4.5409 7.7374 116.6850 55.2384 32.0137 177.0027 93 I 4.2672 7.1690 110.4830 60.2586 38.5364 175.6159 94 A 4.3562 7.2366 120.6750 52.4798 19.9862 177.1550 95 R 4.2221 7.2298 114.4992 54.8375 29.2259 172.4650 96 R 3.7207 8.3156 127.2413 55.5394 27.4238 174.6301 97 P 4.8475 0.0000 0.0000 64.1953 31.9737 177.5074 98 E 4.3178 7.2540 117.8910 54.0247 27.3308 175.8983 99 R 4.4495 7.4837 114.2654 56.2667 31.9417 176.3098 100 V 3.9715 7.9458 111.5908 61.5565 31.4492 176.1929 101 I 4.3839 7.4334 113.1832 60.8169 38.8047 177.3621 102 E 4.1648 8.0776 121.0084 59.0161 29.9863 178.7892 103 I 3.8052 7.7032 118.9815 64.0114 37.4028 177.9321 104 A 4.1054 7.5266 121.2854 54.2370 18.0270 178.3056 105 V 4.4463 7.5033 106.2908 60.8074 33.3043 177.5727 106 K 3.9487 8.2424 124.0656 59.5119 32.0351 178.7163 107 G 3.9532 8.0014 103.9284 46.5522 0.0000 173.6837 108 M 4.2948 7.5781 118.1059 55.4888 32.5998 176.0610 109 L 4.5292 7.3993 120.5387 53.0342 43.4960 174.6595 110 P 4.7417 0.0000 0.0000 60.8574 31.1962 175.2853 111 K 3.8188 8.7511 118.5117 56.6020 30.5358 173.2841 112 G 4.3530 7.8008 105.0300 47.0931 0.0000 173.6539 113 P 4.2992 0.0000 0.0000 64.0056 30.3998 178.1599 114 L 5.0113 7.9145 116.1143 54.5729 41.9518 178.0759 115 G 3.8086 7.6519 106.3290 46.5564 0.0000 176.2380 116 R 4.1261 7.8977 120.7255 59.0355 30.1966 177.1262 117 A 4.4337 7.4351 117.9486 52.8054 18.5025 177.9145 118 M 4.4238 7.1293 115.4864 55.8408 32.5918 177.4904 119 F 4.3513 8.4298 123.1969 60.5324 39.4637 176.5678 120 R 4.4266 7.5634 115.1901 56.3124 30.5187 176.9302 121 K 4.1112 7.6568 116.5804 56.2701 33.3207 175.8798 122 L 4.1527 7.2275 121.5082 54.5116 42.2763 176.3904 123 K 4.1367 8.3484 125.4616 56.2533 35.4115 174.8087 124 V 3.4612 8.9382 126.8555 61.0820 31.3548 175.1352 125 Y 3.9532 8.8715 117.9550 57.9007 36.5877 168.6577 126 A 4.1702 8.3091 122.5398 53.8615 19.3849 177.9253 127 G 4.1590 8.9661 109.9306 45.2068 0.0000 173.6382 128 N 4.2723 8.5340 114.4330 53.3739 35.6090 173.6928 129 E 4.5761 7.7714 112.9178 55.5978 32.6902 173.6227 130 H 2.6807 7.5486 113.3715 54.4052 30.7087 173.1018 131 N 4.6879 8.2121 117.2386 53.2205 37.6041 174.6438 132 H 4.4082 7.7762 114.4930 55.6757 29.3209 176.4145 133 A 3.8199 7.9736 124.8790 55.2548 18.1424 179.9932 134 A 4.0495 7.7523 116.8196 54.2825 18.5357 177.7036 135 Q 4.2237 7.3725 115.0629 56.5464 29.5702 176.2814 136 Q 3.0258 7.5766 112.0667 55.7641 26.3749 172.0489 137 P 4.3688 0.0000 0.0000 63.4512 32.6259 176.8143 138 Q 4.6811 8.8863 124.3768 53.5623 31.1554 175.6125 139 V 3.8463 8.6441 124.0825 63.3242 32.0816 175.1543 140 L 4.5186 8.0157 125.6610 54.6273 45.7816 174.5574 141 D 4.3487 8.9394 125.8974 57.3688 41.1415 176.5406 142 I 3.6444 7.3732 123.0867 61.3838 37.0312 175.6368 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 M 8.30 4.59 0.00 1.74 0.74 0.00 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.51 0.00 2 K 8.81 4.42 0.00 1.66 1.45 0.00 1.75 0.00 0.00 1.74 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.28 1.39 7.81 3 T 9.64 4.60 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 4 F 8.56 4.46 0.00 3.12 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 5 T 8.14 4.77 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 1.27 0.00 0.00 6 A 8.16 4.44 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 7 K 8.45 4.61 0.00 1.65 1.73 0.00 1.76 0.00 0.00 1.77 0.00 0.00 2.95 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.36 1.36 7.81 8 P 0.00 4.72 0.00 2.16 2.09 0.00 3.74 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.96 0.00 9 E 8.07 4.50 0.00 1.97 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 2.23 2.27 0.00 10 T 7.77 4.44 4.25 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 1.22 0.00 0.00 11 V 7.40 4.18 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 0.96 0.00 0.00 12 K 8.05 4.74 0.00 1.70 1.68 0.00 1.84 0.00 0.00 1.80 0.00 0.00 3.09 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.39 7.81 13 R 8.14 4.69 0.00 1.47 1.81 0.00 2.78 0.00 0.00 2.80 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.39 0.00 14 D 8.34 4.86 0.00 2.77 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 0.00 0.00 0.00 15 W 8.32 4.57 0.00 3.23 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 16 Y 8.28 5.75 0.00 2.96 2.99 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 17 V 8.19 4.84 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 1.02 0.00 0.00 0.99 0.00 0.00 18 V 8.44 4.83 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 0.72 0.00 0.00 1.05 0.00 0.00 19 D 8.63 5.29 0.00 2.62 2.49 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 20 A 8.45 4.65 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 21 T 7.60 4.80 4.25 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 1.27 0.00 0.00 22 G 9.00 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 23 K 7.67 4.34 0.00 1.75 1.74 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.86 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.51 1.40 7.81 24 T 8.49 3.85 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 1.20 0.00 0.00 25 L 7.78 3.64 0.00 1.76 1.70 0.89 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 26 G 7.47 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 27 R 8.19 4.57 0.00 1.77 1.93 0.00 3.31 0.00 0.00 3.22 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.54 0.00 28 L 7.53 4.69 0.00 1.67 1.61 0.91 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 29 A 8.11 4.06 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 30 T 7.88 3.95 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 1.29 0.00 0.00 31 E 7.70 4.37 0.00 2.15 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 2.22 2.43 0.00 32 L 7.81 4.03 0.00 1.81 1.69 0.91 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 33 A 7.77 4.03 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 34 R 7.69 3.91 0.00 1.93 2.18 0.00 3.28 0.00 0.00 3.32 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.63 0.00 35 R 7.64 3.93 0.00 1.95 2.13 0.00 3.21 0.00 0.00 2.96 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.71 0.00 36 L 7.51 4.45 0.00 1.61 1.64 0.87 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 37 R 7.71 4.40 0.00 1.79 1.94 0.00 3.15 0.00 0.00 3.16 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.61 0.00 38 G 7.93 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 0.00 0.00 0.00 39 K 8.14 4.14 0.00 1.75 1.78 0.00 1.85 0.00 0.00 1.73 0.00 0.00 2.81 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.37 1.39 7.81 40 H 8.14 5.45 0.00 3.34 3.47 0.00 5.52 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 K 7.15 3.83 0.00 1.77 1.83 0.00 1.78 0.00 0.00 1.66 0.00 0.00 3.11 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.18 1.08 7.81 42 A 7.85 3.55 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 43 E 7.79 4.01 0.00 2.09 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 0.00 2.47 2.24 0.00 44 Y 7.97 3.59 0.00 3.33 3.20 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 45 T 8.08 5.00 4.35 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 1.10 0.00 0.00 46 P 0.00 4.75 0.00 2.19 2.18 0.00 3.88 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 47 H 8.39 4.38 0.00 3.27 3.41 0.00 5.52 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 V 7.39 4.13 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 0.80 0.00 0.00 0.87 0.00 0.00 49 D 8.42 4.98 0.00 2.55 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 50 T 7.85 4.41 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 1.13 0.00 0.00 51 G 8.29 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 52 D 8.13 4.58 0.00 2.53 2.52 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 53 Y 7.55 4.41 0.00 1.57 1.43 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 54 I 7.79 4.59 1.94 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 1.41 0.69 0.90 0.00 0.00 55 I 8.33 4.78 1.93 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 1.32 1.04 1.07 0.00 0.00 56 V 8.49 4.47 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 1.04 0.00 0.00 0.96 0.00 0.00 57 L 8.46 4.87 0.00 1.68 1.80 0.95 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 58 N 7.88 5.17 0.00 3.00 2.79 0.00 0.00 6.59 7.14 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 59 A 8.22 4.63 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 60 D 7.85 4.73 0.00 2.74 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 61 K 7.98 4.77 0.00 1.81 1.78 0.00 1.64 0.00 0.00 1.89 0.00 0.00 3.19 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.44 7.81 62 V 7.88 4.68 2.26 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 0.82 0.00 0.00 0.95 0.00 0.00 63 A 8.24 4.53 1.15 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 0.00 0.00 64 V 7.83 4.04 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 0.93 0.00 0.00 0.91 0.00 0.00 65 T 8.75 3.12 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 1.15 0.00 0.00 66 G 10.43 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 0.00 0.00 0.00 0.00 67 N 7.28 4.79 0.00 3.00 2.98 0.00 0.00 6.74 7.20 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 68 K 8.04 4.25 0.00 1.87 1.88 0.00 1.73 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.45 1.36 7.81 69 R 7.74 4.74 0.00 1.82 1.99 0.00 2.21 0.00 0.00 2.90 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.38 0.00 70 T 7.85 4.30 4.25 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 1.21 0.00 0.00 71 D 7.80 4.49 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 72 K 7.44 4.16 0.00 1.85 1.85 0.00 1.80 0.00 0.00 1.89 0.00 0.00 2.84 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.16 1.19 7.81 73 V 7.76 3.75 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 0.42 0.00 0.00 0.83 0.00 0.00 74 Y 7.93 4.38 0.00 2.96 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 75 Y 8.25 4.60 0.00 2.93 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 H 8.46 4.91 0.00 3.31 3.44 0.00 5.45 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 8.89 4.58 0.00 3.32 3.25 0.00 5.87 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 T 7.95 3.77 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 1.17 0.00 0.00 79 G 7.68 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 0.00 0.00 0.00 80 H 8.56 4.29 0.00 3.03 3.18 0.00 6.08 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 8.53 2.80 1.67 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 1.31 0.79 0.79 0.00 0.00 82 G 8.33 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 0.00 0.00 0.00 83 G 8.16 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 84 I 7.82 4.53 1.90 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.66 0.98 0.00 0.00 85 K 9.07 4.86 0.00 2.15 1.85 0.00 1.71 0.00 0.00 1.74 0.00 0.00 2.90 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.43 1.40 7.81 86 Q 8.60 4.99 0.00 1.96 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.70 0.00 0.00 0.00 0.00 0.00 2.24 2.32 0.00 87 A 8.59 4.74 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 88 T 8.37 4.96 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 1.34 0.00 0.00 89 F 8.70 4.13 0.00 3.35 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 90 E 8.59 3.99 0.00 2.16 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 0.00 2.48 2.58 0.00 91 E 8.15 4.14 0.00 2.05 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 2.29 2.49 0.00 92 M 7.74 4.54 0.00 1.99 1.97 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.53 0.00 93 I 7.17 4.27 1.66 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.46 0.09 0.00 0.00 94 A 7.24 4.36 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 95 R 7.23 4.22 0.00 1.70 1.89 0.00 3.38 0.00 0.00 3.12 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.49 0.00 96 R 8.32 3.72 0.00 2.01 1.86 0.00 3.22 0.00 0.00 3.32 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 97 P 0.00 4.85 0.00 2.04 2.09 0.00 3.73 0.00 0.00 5.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.16 0.00 98 E 7.25 4.32 0.00 1.95 1.91 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 2.36 2.25 0.00 99 R 7.48 4.45 0.00 1.84 1.93 0.00 2.97 0.00 0.00 3.18 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.44 0.00 100 V 7.95 3.97 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 0.53 0.00 0.00 1.10 0.00 0.00 101 I 7.43 4.38 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 1.40 1.21 0.93 0.00 0.00 102 E 8.08 4.16 0.00 2.11 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 2.42 2.35 0.00 103 I 7.70 3.81 1.74 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.00 0.92 0.00 0.00 104 A 7.53 4.11 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 0.00 105 V 7.50 4.45 2.08 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 0.83 0.00 0.00 1.01 0.00 0.00 106 K 8.24 3.95 0.00 2.01 1.84 0.00 1.56 0.00 0.00 1.81 0.00 0.00 3.06 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.47 7.81 107 G 8.00 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 0.00 0.00 0.00 108 M 7.58 4.29 0.00 2.04 2.28 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.50 0.00 109 L 7.40 4.53 0.00 1.73 1.62 0.97 1.00 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 0.00 110 P 0.00 4.74 0.00 2.16 1.90 0.00 3.92 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.96 0.00 111 K 8.75 3.82 0.00 1.92 1.89 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.35 1.42 7.81 112 G 7.80 4.35 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 0.00 113 P 0.00 4.30 0.00 2.20 2.12 0.00 3.57 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.11 0.00 114 L 7.91 5.01 0.00 1.68 1.63 0.92 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 115 G 7.65 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 0.00 116 R 7.90 4.13 0.00 2.02 2.18 0.00 3.19 0.00 0.00 3.32 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.77 0.00 117 A 7.44 4.43 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 0.00 118 M 7.13 4.42 0.00 2.01 2.30 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 2.76 2.52 0.00 119 F 8.43 4.35 0.00 3.15 3.20 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 0.00 120 R 7.56 4.43 0.00 1.97 1.99 0.00 3.25 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.80 0.00 121 K 7.66 4.11 0.00 1.63 1.83 0.00 1.68 0.00 0.00 1.54 0.00 0.00 2.95 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.17 1.41 7.81 122 L 7.23 4.15 0.00 1.50 1.55 0.66 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 123 K 8.35 4.14 0.00 1.86 1.75 0.00 1.82 0.00 0.00 1.77 0.00 0.00 2.99 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.35 1.39 7.81 124 V 8.94 3.46 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 1.07 0.00 0.00 0.91 0.00 0.00 125 Y 8.87 3.95 0.00 3.29 3.06 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 0.00 126 A 8.31 4.17 1.45 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 0.00 0.00 127 G 8.97 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 0.00 0.00 0.00 0.00 128 N 8.53 4.27 0.00 2.88 2.94 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 0.00 129 E 7.77 4.58 0.00 1.86 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 2.12 2.28 0.00 130 H 7.55 2.68 0.00 2.96 2.93 0.00 5.68 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 N 8.21 4.69 0.00 2.75 2.94 0.00 0.00 6.03 7.90 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 0.00 132 H 7.78 4.41 0.00 3.08 2.59 0.00 5.64 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 A 7.97 3.82 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 A 7.75 4.05 1.15 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 0.00 0.00 135 Q 7.37 4.22 0.00 0.93 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.37 0.00 0.00 0.00 0.00 0.00 1.74 1.78 0.00 136 Q 7.58 3.03 0.00 2.08 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.61 6.83 0.00 0.00 0.00 0.00 0.00 2.23 2.41 0.00 137 P 0.00 4.37 0.00 1.89 2.03 0.00 3.55 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 2.00 0.00 138 Q 8.89 4.68 0.00 2.06 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 2.51 2.46 0.00 139 V 8.64 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 0.77 0.00 0.00 0.97 0.00 0.00 140 L 8.02 4.52 0.00 1.95 1.35 0.91 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 141 D 8.94 4.35 0.00 2.63 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 0.00 142 I 7.37 3.64 1.52 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.60 0.61 0.00 0.00