NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2970 8.2649 123.5794 52.1728 19.9449 176.5947 2 C 4.7975 8.3375 116.8869 54.8985 42.2418 172.8197 3 D 4.2875 9.5644 125.5995 56.8541 42.2564 176.4284 4 Y 4.9607 7.8421 115.0386 56.4698 42.8378 174.2486 5 T 4.8893 9.4881 118.4920 60.6762 70.6653 172.1483 6 C 4.6884 9.2345 127.7660 55.8673 41.5802 175.8254 7 G 3.7421 8.2968 118.0938 47.0595 0.0000 174.7221 8 S 4.4481 8.9643 121.2714 58.6734 63.6790 173.5716 9 N 4.3583 8.1633 119.8450 52.5470 39.0443 172.8257 10 C 5.0776 8.1716 122.7986 54.9454 46.7963 172.2931 11 Y 5.4033 8.9339 123.8845 56.3329 41.3463 175.5459 12 S 5.0668 9.3598 118.4683 57.1649 65.5164 175.4173 13 S 4.3740 9.3386 116.7564 61.7736 62.3947 177.2634 14 S 4.1422 8.1247 116.5859 61.5140 62.6922 176.2350 15 D 4.3871 7.9707 122.1019 57.0868 40.5092 178.8633 16 V 3.4267 7.6360 118.5174 66.1199 31.4825 178.2145 17 S 4.0671 8.3220 115.1139 61.8514 62.5104 176.8875 18 T 3.8116 7.9982 118.0934 66.6219 68.2563 176.6552 19 A 4.1789 8.0129 122.6841 55.1399 18.3587 179.3454 20 Q 3.7628 8.3572 118.1833 59.3143 29.1028 178.4264 21 A 3.7765 8.0701 121.5792 54.9762 18.3332 179.5390 22 A 3.7377 7.5953 119.3778 55.0742 18.4603 180.0490 23 G 2.5557 6.8725 104.0751 47.7176 0.0000 175.2716 24 Y 3.5291 7.2752 122.3563 59.8383 38.8292 177.8421 25 K 3.7429 7.7607 120.5869 59.4875 32.3048 178.7821 26 L 3.8756 7.5181 119.2114 57.7592 41.5927 178.8841 27 H 3.9590 7.9932 118.4639 59.2770 29.6136 177.2587 28 E 3.6630 7.7214 118.0326 58.9076 29.3915 177.8691 29 D 4.5417 7.6889 117.3217 53.5247 41.3555 176.3290 30 G 3.7776 7.6592 107.1026 46.8882 0.0000 173.1694 31 E 4.9045 8.0066 117.1432 54.5597 32.9743 175.8212 32 T 5.1230 8.3033 115.8632 62.2869 73.0089 173.6862 33 V 4.4940 9.4687 123.3368 62.4515 35.4098 176.4259 34 G 4.5911 9.0898 111.1195 45.3801 0.0000 174.4604 35 S 4.2220 8.5489 113.0641 60.7590 63.2387 174.8274 36 N 4.5676 8.3068 116.5676 52.1695 38.6342 175.3349 37 S 3.7265 7.4507 112.9353 59.7975 60.6180 170.8359 38 Y 4.9360 8.7090 119.7081 55.9797 40.1331 174.4801 39 P 5.7108 0.0000 0.0000 62.6995 32.8738 174.7615 40 H 5.2457 8.6243 115.1277 53.4969 32.5862 172.1952 41 K 4.1494 9.0015 120.6392 57.2420 32.6909 175.0641 42 Y 4.6266 8.6609 129.0103 56.1422 39.2557 175.3741 43 N 4.1343 8.1449 124.2185 53.5947 39.5058 174.3233 44 N 3.8065 6.1566 115.8457 54.3565 37.0907 175.2100 45 Y 4.3219 7.1890 115.9051 61.1108 38.4673 178.3972 46 E 3.7219 7.9489 118.2469 57.2144 29.5542 176.9635 47 G 3.7058 7.6473 106.1873 46.2894 0.0000 174.0768 48 F 4.2433 7.7149 117.3871 57.3794 39.8641 175.9564 49 D 4.6489 8.1612 124.0276 52.9946 39.6190 176.4511 50 F 4.6755 7.4398 119.5314 57.6965 39.9276 176.2911 51 S 4.4906 8.8898 118.6903 58.9760 63.5147 173.9336 52 V 4.5070 7.5579 120.8239 60.9387 33.4905 175.0444 53 S 4.3750 8.4644 120.1098 57.8503 63.7326 174.3260 54 S 3.2003 7.9691 118.1703 56.2554 63.8571 171.5882 55 P 4.1169 0.0000 0.0000 63.0124 32.4595 174.8140 56 Y 4.9362 7.8972 117.2427 56.5702 41.6342 174.3114 57 Y 5.2507 8.5349 118.6603 56.1270 42.4935 174.1851 58 E 5.1732 9.2465 120.4335 54.4179 32.9271 174.6552 59 W 5.2888 8.8719 130.8112 55.0932 34.5809 172.5199 60 P 4.3476 0.0000 0.0000 62.2290 31.5475 175.3363 61 I 4.3227 7.7325 123.4269 59.1300 40.1145 174.7025 62 L 4.7384 8.3291 129.0226 52.8442 43.3485 177.7566 63 S 4.2760 8.8488 117.3637 61.3094 63.0075 175.9284 64 S 4.1621 8.0334 114.6886 59.6177 63.0246 175.1446 65 G 4.0755 8.1879 109.0265 45.1337 0.0000 173.5673 66 D 4.6083 7.4273 118.6522 53.8356 41.5547 175.9700 67 V 4.1113 8.0798 121.2274 61.8690 32.1879 175.4021 68 Y 4.1452 8.7742 128.1007 58.2826 38.9676 176.3432 69 S 4.4270 8.1585 118.6355 57.3498 64.3702 172.5124 70 G 3.7571 6.9152 105.7747 44.3913 0.0000 174.9302 71 G 3.7767 8.3924 107.4107 44.3728 0.0000 172.5536 72 S 4.1708 8.6753 114.3612 58.2744 62.5065 173.3166 73 P 4.0615 0.0000 0.0000 62.1651 31.8584 177.6619 74 G 3.7777 7.4516 108.4888 45.3461 0.0000 172.6077 75 A 4.6381 8.3323 117.8343 52.1785 21.2497 176.9541 76 D 5.1830 7.9108 115.5359 53.3136 43.2138 175.8756 77 R 4.8266 8.8844 120.0740 54.6093 35.1590 174.1011 78 V 4.2677 8.6664 123.0789 61.3789 33.8227 174.5300 79 V 4.7544 8.4487 127.9484 60.9597 33.6688 174.3265 80 F 5.5099 8.3741 122.1359 55.2386 42.1221 173.2053 81 N 5.8051 8.6432 116.6489 50.1674 39.9261 175.1561 82 E 4.2797 9.2399 117.2503 59.6756 29.5062 177.8954 83 N 4.6688 8.4820 113.5549 52.4672 38.7511 174.1672 84 N 3.7328 8.1328 115.8300 54.3746 37.9623 173.6793 85 Q 4.3673 8.1923 114.7497 53.8203 30.1110 175.1294 86 L 4.3023 8.3455 123.9613 54.9021 42.7487 176.1996 87 A 3.9599 8.7220 130.1888 53.2348 19.2654 176.8260 88 G 3.7833 6.2266 100.6305 46.1485 0.0000 171.8699 89 V 4.6578 7.4772 119.4144 60.7290 33.9667 174.3586 90 I 4.9707 8.5013 120.8507 59.4531 41.3161 174.0535 91 T 5.0953 8.7382 116.0299 61.2188 70.8482 174.1021 92 H 4.8121 9.1244 122.3911 56.4656 29.4580 175.9263 93 T 4.0864 7.7024 117.7031 64.7399 68.4885 174.7514 94 G 3.9156 9.1050 113.4172 45.4711 0.0000 172.6571 95 A 4.8094 7.5201 121.2821 49.6576 21.6526 177.0047 96 S 4.2794 8.6899 118.3049 59.7801 64.5850 174.5707 97 G 3.7020 8.1623 112.9380 47.4935 0.0000 173.6392 98 N 4.7962 8.7899 120.6330 52.7836 38.1368 174.3503 99 N 4.9066 8.2523 117.5734 53.0750 39.4917 173.4603 100 A 5.0594 8.5090 119.5321 50.7715 22.5858 175.8123 101 V 4.9449 8.7887 111.6193 59.5091 36.2901 175.1459 102 E 4.3853 8.7288 121.5366 56.2592 30.2692 177.4645 103 C 4.6883 8.8478 121.5143 56.8743 38.2107 174.1162 104 T 4.1800 8.4720 111.6007 61.8693 68.6603 174.5422 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 A 8.26 4.30 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 2 C 8.34 4.80 0.00 3.02 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 3 D 9.56 4.29 0.00 2.73 2.35 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 4 Y 7.84 4.96 0.00 3.03 2.87 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 5 T 9.49 4.89 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 1.27 0.00 0.00 6 C 9.23 4.69 0.00 3.30 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 7 G 8.30 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 0.00 0.00 0.00 8 S 8.96 4.45 0.00 3.84 3.89 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 9 N 8.16 4.36 0.00 2.78 2.19 0.00 0.00 6.34 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 10 C 8.17 5.08 0.00 2.83 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 11 Y 8.93 5.40 0.00 3.07 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 12 S 9.36 5.07 0.00 3.93 4.05 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 0.00 0.00 0.00 13 S 9.34 4.37 0.00 3.92 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 14 S 8.12 4.14 0.00 4.07 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 15 D 7.97 4.39 0.00 3.02 2.87 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 V 7.64 3.43 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.70 0.00 0.00 17 S 8.32 4.07 0.00 4.01 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 18 T 8.00 3.81 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 1.24 0.00 0.00 19 A 8.01 4.18 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 20 Q 8.36 3.76 0.00 2.18 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.73 0.00 0.00 0.00 0.00 0.00 2.01 2.27 0.00 21 A 8.07 3.78 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 22 A 7.60 3.74 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 23 G 6.87 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 0.00 0.00 0.00 24 Y 7.28 3.53 0.00 2.28 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 25 K 7.76 3.74 0.00 1.89 1.63 0.00 1.68 0.00 0.00 1.58 0.00 0.00 2.87 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.55 7.81 26 L 7.52 3.88 0.00 1.65 1.80 0.84 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 27 H 7.99 3.96 0.00 3.22 3.09 0.00 5.78 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 28 E 7.72 3.66 0.00 1.86 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.17 0.00 29 D 7.69 4.54 0.00 2.61 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 30 G 7.66 3.78 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 0.00 0.00 0.00 31 E 8.01 4.90 0.00 1.82 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 2.22 2.22 0.00 32 T 8.30 5.12 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 1.29 0.00 0.00 33 V 9.47 4.49 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 1.08 0.00 0.00 1.15 0.00 0.00 34 G 9.09 4.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 S 8.55 4.22 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 36 N 8.31 4.57 0.00 2.54 2.52 0.00 0.00 7.09 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 S 7.45 3.73 0.00 3.96 3.89 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 38 Y 8.71 4.94 0.00 3.01 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 P 0.00 5.71 0.00 2.37 2.53 0.00 3.69 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.11 0.00 40 H 8.62 5.25 0.00 3.21 3.59 0.00 5.49 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 K 9.00 4.15 0.00 1.84 1.77 0.00 1.71 0.00 0.00 1.58 0.00 0.00 2.62 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.27 1.22 7.81 42 Y 8.66 4.63 0.00 2.91 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 43 N 8.14 4.13 0.00 1.47 2.46 0.00 0.00 7.11 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 N 6.16 3.81 0.00 3.13 2.84 0.00 0.00 7.22 7.56 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 45 Y 7.19 4.32 0.00 2.92 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 46 E 7.95 3.72 0.00 1.16 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.15 0.00 47 G 7.65 3.71 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 0.00 0.00 0.00 48 F 7.71 4.24 0.00 1.88 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 49 D 8.16 4.65 0.00 2.62 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 50 F 7.44 4.68 0.00 3.13 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 51 S 8.89 4.49 0.00 4.04 4.05 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 0.00 0.00 0.00 52 V 7.56 4.51 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 1.06 0.00 0.00 1.01 0.00 0.00 53 S 8.46 4.37 0.00 4.00 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 54 S 7.97 3.20 0.00 3.34 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 P 0.00 4.12 0.00 1.76 2.05 0.00 3.60 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.01 0.00 56 Y 7.90 4.94 0.00 3.18 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 57 Y 8.53 5.25 0.00 1.83 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 58 E 9.25 5.17 0.00 1.96 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.33 0.00 59 W 8.87 5.29 0.00 3.74 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 60 P 0.00 4.35 0.00 0.88 1.19 0.00 2.20 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.44 0.00 61 I 7.73 4.32 1.58 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.46 0.63 0.37 0.00 0.00 62 L 8.33 4.74 0.00 1.93 1.60 1.03 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 63 S 8.85 4.28 0.00 3.93 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 S 8.03 4.16 0.00 4.03 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 65 G 8.19 4.08 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 0.00 0.00 0.00 66 D 7.43 4.61 0.00 2.72 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 67 V 8.08 4.11 2.18 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 1.04 0.00 0.00 1.02 0.00 0.00 68 Y 8.77 4.15 0.00 2.63 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 0.00 0.00 0.00 0.00 69 S 8.16 4.43 0.00 3.87 3.80 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 70 G 6.92 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 G 8.39 3.78 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 0.00 0.00 0.00 72 S 8.68 4.17 0.00 3.88 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 73 P 0.00 4.06 0.00 1.48 1.30 0.00 3.94 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 2.01 0.00 74 G 7.45 3.78 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 0.00 0.00 0.00 75 A 8.33 4.64 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 76 D 7.91 5.18 0.00 2.78 2.51 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 77 R 8.88 4.83 0.00 1.43 1.58 0.00 3.14 0.00 0.00 2.76 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.80 0.00 78 V 8.67 4.27 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 1.00 0.00 0.00 0.73 0.00 0.00 79 V 8.45 4.75 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 0.44 0.00 0.00 0.22 0.00 0.00 80 F 8.37 5.51 0.00 3.24 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 81 N 8.64 5.81 0.00 3.05 3.17 0.00 0.00 6.90 7.81 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 82 E 9.24 4.28 0.00 2.12 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.44 0.00 83 N 8.48 4.67 0.00 2.92 2.83 0.00 0.00 6.85 8.00 0.00 0.00 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 N 8.13 3.73 0.00 1.44 2.29 0.00 0.00 7.07 6.93 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 85 Q 8.19 4.37 0.00 2.32 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.78 0.00 0.00 0.00 0.00 0.00 2.31 2.27 0.00 86 L 8.35 4.30 0.00 1.56 1.54 0.87 0.96 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 87 A 8.72 3.96 0.32 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 88 G 6.23 3.78 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 0.00 0.00 0.00 89 V 7.48 4.66 1.66 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 0.85 0.00 0.00 -0.11 0.00 0.00 90 I 8.50 4.97 1.91 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.90 0.62 0.00 0.00 91 T 8.74 5.10 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 1.29 0.00 0.00 92 H 9.12 4.81 0.00 3.27 3.35 0.00 5.68 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 93 T 7.70 4.09 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 1.24 0.00 0.00 94 G 9.10 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 A 7.52 4.81 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 96 S 8.69 4.28 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 97 G 8.16 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 98 N 8.79 4.80 0.00 2.76 2.85 0.00 0.00 6.80 8.00 0.00 0.00 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 N 8.25 4.91 0.00 3.01 2.81 0.00 0.00 6.64 7.09 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 0.00 100 A 8.51 5.06 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 0.00 101 V 8.79 4.94 2.18 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 0.85 0.00 0.00 1.07 0.00 0.00 102 E 8.73 4.39 0.00 1.70 1.75 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 1.83 1.47 0.00 103 C 8.85 4.69 0.00 2.94 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 0.00 104 T 8.47 4.18 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 1.23 0.00 0.00