NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 P 4.4840 0.0000 0.0000 62.4078 32.7855 176.6276 6 T 3.9113 9.7350 113.6296 61.1523 70.5792 174.3059 7 I 3.6461 8.3219 122.0700 64.5094 37.5336 179.1042 8 N 4.2257 8.2216 117.3896 56.9796 38.5892 176.3126 9 Q 3.9907 8.3938 119.4805 59.3163 28.9162 179.1307 10 L 3.9366 7.9058 119.6074 57.9349 41.3600 179.8952 11 V 3.6818 7.5512 117.4250 65.8748 31.5240 178.0862 12 R 4.0253 8.1494 117.6308 58.7089 30.1296 178.4340 13 K 4.3235 8.9011 117.5776 54.9065 33.0280 177.5413 14 G 3.8645 7.4184 109.8666 44.6178 0.0000 172.8116 15 R 4.1796 8.1875 117.4080 54.9449 30.7523 176.3109 16 E 4.1393 8.6556 124.4024 55.2772 29.9139 176.4226 17 K 4.1370 8.4298 126.2736 56.1447 32.8421 177.2951 18 V 3.7639 8.1030 121.8473 62.8246 32.1453 175.8498 19 R 4.4910 8.1404 122.6604 54.0176 31.9843 175.5969 20 K 4.1079 8.5985 123.3261 55.9765 32.7137 176.8765 21 K 4.3997 8.3797 123.3749 54.4364 33.0896 176.4999 22 S 4.1439 8.6124 119.0468 58.8178 62.7676 173.6134 23 K 4.3518 8.4374 125.0904 55.9497 31.9471 177.2685 24 V 4.1665 7.5157 119.9234 62.1168 32.8530 172.5898 25 P 4.4683 0.0000 0.0000 61.2112 29.7351 176.2402 26 A 3.9454 7.7633 118.7366 51.3580 19.0368 178.1625 27 L 2.9161 8.1499 120.4061 58.5132 42.9932 174.3717 28 K 3.9509 9.4584 114.7558 56.2421 29.7401 175.1278 29 G 3.9469 8.2664 106.0896 46.0228 0.0000 174.1773 30 A 4.2171 7.2806 121.4853 51.1170 19.0300 177.1085 31 P 4.1239 0.0000 0.0000 64.8328 31.6929 176.2651 32 F 5.0664 7.3422 113.9268 56.4974 43.7898 173.7728 33 R 4.6664 8.5773 116.8403 55.8029 33.8523 173.6597 34 R 5.1368 8.6028 121.8020 55.1660 32.8620 175.2348 35 G 4.4486 8.7050 106.2498 45.5621 0.0000 170.8804 36 V 4.9387 8.2575 118.7665 60.9540 34.2279 175.4818 37 C 4.7715 9.1356 125.8653 60.7067 28.3404 172.9017 38 T 4.4818 8.7509 117.7364 64.7012 70.3457 175.0428 39 V 4.3078 7.5540 119.7911 60.9909 35.1089 174.4781 40 V 4.4953 8.1317 127.6589 61.5061 30.2766 176.3295 41 R 4.2316 7.5971 126.0034 56.7535 33.0571 175.6498 42 T 5.2968 8.0831 107.4683 63.5901 70.8669 173.7759 43 V 4.0252 8.1547 126.2415 62.8556 33.4844 173.9908 44 T 5.1654 8.0359 113.4574 58.3525 71.1897 172.5273 45 P 5.1177 0.0000 0.0000 62.2327 32.5582 174.0230 46 K 4.6592 8.0494 118.7033 57.8159 36.0344 178.2073 47 K 3.4920 8.8771 117.4683 57.1877 32.6409 173.3218 48 P 4.6015 0.0000 0.0000 65.1174 33.3626 176.8416 49 N 4.3396 8.0335 115.7191 53.1734 38.9621 174.2128 50 S 4.5854 9.1384 114.3477 55.5738 65.3497 173.1935 51 A 4.4367 7.4208 127.3301 52.3385 20.4860 175.4528 52 L 4.8658 7.7278 119.2099 53.0906 42.2493 176.4065 53 R 4.2643 8.6443 123.1259 55.7674 31.6292 175.9319 54 K 4.3131 8.5519 123.4032 56.1467 33.3768 176.2338 55 V 4.9618 7.6709 123.1772 61.3578 35.4487 174.2661 56 A 4.7397 8.1658 121.1251 50.8542 22.9769 176.1207 57 K 4.4717 9.0428 123.2998 56.2008 33.8079 176.4410 58 V 4.8075 9.0182 123.5679 61.1657 35.3999 174.3403 59 R 4.7835 8.9853 128.7892 54.8656 30.7822 175.3449 60 L 4.8067 9.6851 128.6786 54.5203 42.4672 178.9790 61 T 3.9395 8.6452 112.8291 64.2206 68.8901 175.7745 62 S 4.2286 7.9754 115.5676 59.5365 63.3478 174.9179 63 G 4.0096 8.6219 110.1499 45.1951 0.0000 172.6276 64 Y 4.5743 7.7484 117.0637 56.3036 40.7232 174.9717 65 E 5.0027 8.8339 122.2221 55.1435 30.8516 175.4773 66 V 4.7197 8.9574 117.7610 59.5094 36.9829 175.1518 67 T 4.8839 8.5537 118.3516 63.3186 69.8768 173.8594 68 A 5.2633 9.0016 126.6962 50.3368 22.9059 174.7163 69 Y 4.3372 9.2209 122.2356 57.2644 40.7242 174.6213 70 I 4.5700 6.3653 125.7629 58.3125 37.7763 173.8906 71 P 4.6620 0.0000 0.0000 62.8939 32.1619 176.6736 72 G 3.8379 8.7195 105.7138 44.6229 0.0000 174.1475 73 E 4.0454 8.5836 119.3177 58.6373 29.6425 177.8905 74 G 4.2173 7.6116 104.5044 44.0432 0.0000 171.0360 75 H 5.1665 8.2657 115.6595 53.7666 31.3798 173.2641 76 N 5.0172 8.4765 115.8142 52.8467 37.7504 173.8382 77 L 4.2983 8.4260 118.8001 55.2641 42.5028 176.1622 78 Q 4.7776 8.5321 121.5659 53.6159 32.1836 175.8130 79 E 3.9108 8.7576 117.2092 60.1381 29.3469 178.0445 80 H 5.1635 7.8039 113.0182 55.4477 31.4571 173.6745 81 S 4.5409 8.0697 114.2976 58.3227 64.4791 173.2875 82 V 4.6521 10.1403 123.6196 62.4357 33.1520 175.2246 83 V 5.1193 8.7963 125.7069 60.4635 35.9502 173.0692 84 L 5.1256 8.3544 121.0803 53.4017 44.6562 175.3187 85 I 4.7563 9.1212 128.7332 60.9983 38.2816 176.5992 86 R 4.7186 9.1626 121.6554 55.2214 30.6121 173.6426 87 G 4.0767 8.3217 113.0396 45.4011 0.0000 171.4101 88 G 3.1804 7.7671 108.5100 43.9635 0.0000 174.0754 89 R 4.2989 7.8941 126.4462 54.9019 32.5060 175.8428 90 V 4.1032 7.8773 118.7784 62.0627 33.0743 175.6852 91 K 3.9177 8.7239 129.6384 59.0883 32.3267 177.0473 92 D 4.5278 7.9541 117.0558 54.7743 41.4769 175.4090 93 L 4.6766 7.6253 118.9165 51.7375 42.6964 173.7641 94 P 4.2501 0.0000 0.0000 63.6794 31.7494 177.2924 95 G 3.9767 9.0945 110.3982 45.0251 0.0000 173.1721 96 V 4.3202 7.7166 120.3704 61.3545 32.7487 175.7664 97 R 4.2539 8.4559 125.5896 56.1513 31.7462 175.3024 98 Y 5.4439 7.2871 112.7054 55.4099 42.5229 174.4330 99 H 5.3497 9.0230 118.1950 54.7615 32.0788 173.6497 100 I 4.7412 8.0964 121.1551 59.6504 38.4062 176.0331 101 V 3.6983 8.8965 128.3710 63.0307 32.4979 175.2872 102 R 4.3852 8.5321 128.4939 56.2105 30.6547 177.0273 103 G 3.9999 8.3496 110.4614 45.2025 0.0000 173.6395 104 V 4.1667 7.2827 120.2780 61.9723 34.6287 174.0010 105 Y 3.8354 8.0426 123.9410 60.0816 35.8340 170.9828 106 D 4.5016 9.5629 128.8610 55.6230 41.0417 175.9476 107 A 4.3463 7.8806 123.8040 50.6071 18.4460 176.9558 108 A 4.4672 8.9724 126.0907 52.2817 19.3258 177.5422 109 G 4.0122 8.2682 107.5531 45.1683 0.0000 173.7072 110 V 3.8289 8.0002 122.1322 62.8275 31.7700 176.2566 111 K 4.1056 8.7091 127.1767 57.2029 33.3721 177.3040 112 D 4.6005 8.7849 121.0520 55.0520 38.2817 174.5993 113 R 4.3091 7.2322 118.1858 56.2718 30.6777 176.5448 114 K 4.6837 8.2774 115.8586 56.7915 38.0952 177.6924 115 K 3.9314 8.5388 117.7195 58.4049 30.4833 178.9852 116 S 4.7068 9.4100 119.7391 60.1608 63.4116 177.0387 117 R 4.0036 8.3610 123.3886 59.5721 30.1570 178.7718 118 S 4.0519 8.2424 111.5258 60.7496 62.4285 174.3660 119 K 4.1824 8.0519 118.4652 56.5176 33.1515 176.1908 120 Y 3.6981 7.9733 118.6483 59.3573 35.4361 171.1925 121 G 4.2466 6.9521 107.1825 47.9625 0.0000 174.6494 122 T 4.5942 7.6555 111.0565 59.3287 71.4053 175.4587 123 K 4.0885 8.4736 124.0362 55.9700 32.7778 176.2708 124 K 4.0775 8.3215 121.9913 55.5359 32.5103 174.4381 125 P 4.3577 0.0000 0.0000 61.5639 31.7084 175.3097 126 K 3.8632 8.7111 123.5604 56.6249 31.7212 175.9056 127 E 4.0150 8.5283 122.9721 56.0337 30.2748 177.0443 128 A 4.1734 8.5495 125.1846 52.3611 18.6399 176.8251 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 5 P 0.00 4.48 0.00 2.17 2.12 0.00 3.48 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 2.08 0.00 6 T 9.74 3.91 4.24 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 0.00 0.00 1.28 0.00 0.00 7 I 8.32 3.65 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.86 0.91 0.00 0.00 8 N 8.22 4.23 0.00 2.82 2.83 0.00 0.00 7.13 7.12 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 9 Q 8.39 3.99 0.00 2.28 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.53 0.00 0.00 0.00 0.00 0.00 2.38 2.42 0.00 10 L 7.91 3.94 0.00 1.91 1.73 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 11 V 7.55 3.68 2.21 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 0.83 0.00 0.00 0.93 0.00 0.00 12 R 8.15 4.03 0.00 1.97 1.95 0.00 3.20 0.00 0.00 3.22 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.79 0.00 13 K 8.90 4.32 0.00 1.67 1.85 0.00 1.85 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.43 7.81 14 G 7.42 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 15 R 8.19 4.18 0.00 1.81 1.88 0.00 3.37 0.00 0.00 3.15 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.55 0.00 16 E 8.66 4.14 0.00 1.92 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 2.29 2.33 0.00 17 K 8.43 4.14 0.00 1.78 1.72 0.00 1.81 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.44 1.37 7.81 18 V 8.10 3.76 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 0.79 0.00 0.00 0.93 0.00 0.00 19 R 8.14 4.49 0.00 1.78 1.81 0.00 3.26 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 20 K 8.60 4.11 0.00 1.73 1.74 0.00 1.72 0.00 0.00 1.69 0.00 0.00 2.88 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.43 1.45 7.81 21 K 8.38 4.40 0.00 1.73 1.74 0.00 1.76 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.40 7.81 22 S 8.61 4.14 0.00 3.81 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 23 K 8.44 4.35 0.00 1.72 1.72 0.00 1.78 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.37 7.81 24 V 7.52 4.17 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 0.99 0.00 0.00 0.80 0.00 0.00 25 P 0.00 4.47 0.00 1.98 1.83 0.00 3.74 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.06 0.00 26 A 7.76 3.95 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 27 L 8.15 2.92 0.00 1.57 1.51 1.04 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 28 K 9.46 3.95 0.00 1.92 1.86 0.00 1.87 0.00 0.00 1.83 0.00 0.00 3.11 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.42 7.81 29 G 8.27 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 30 A 7.28 4.22 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 31 P 0.00 4.12 0.00 1.86 1.83 0.00 3.66 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.02 0.00 32 F 7.34 5.07 0.00 2.91 2.92 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 33 R 8.58 4.67 0.00 1.79 1.67 0.00 3.15 0.00 0.00 3.33 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.53 0.00 34 R 8.60 5.14 0.00 2.25 2.42 0.00 2.82 0.00 0.00 3.14 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.65 0.00 35 G 8.71 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 0.00 0.00 0.00 0.00 36 V 8.26 4.94 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 1.08 0.00 0.00 0.92 0.00 0.00 37 C 9.14 4.77 0.00 2.98 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 38 T 8.75 4.48 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 39 V 7.55 4.31 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 1.06 0.00 0.00 0.93 0.00 0.00 40 V 8.13 4.50 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 0.89 0.00 0.00 0.92 0.00 0.00 41 R 7.60 4.23 0.00 1.94 1.81 0.00 3.27 0.00 0.00 3.35 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.67 0.00 42 T 8.08 5.30 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 1.22 0.00 0.00 43 V 8.15 4.03 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 0.96 0.00 0.00 44 T 8.04 5.17 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 45 P 0.00 5.12 0.00 2.18 2.23 0.00 3.68 0.00 0.00 5.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.95 0.00 46 K 8.05 4.66 0.00 1.81 1.79 0.00 1.63 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.28 1.41 7.81 47 K 8.88 3.49 0.00 1.84 1.84 0.00 1.72 0.00 0.00 1.75 0.00 0.00 2.95 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.38 1.41 7.81 48 P 0.00 4.60 0.00 2.16 2.15 0.00 3.86 0.00 0.00 3.65 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 49 N 8.03 4.34 0.00 2.80 2.82 0.00 0.00 6.57 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 50 S 9.14 4.59 0.00 3.77 3.67 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 51 A 7.42 4.44 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 52 L 7.73 4.87 0.00 1.52 1.63 0.93 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 53 R 8.64 4.26 0.00 1.99 2.17 0.00 3.26 0.00 0.00 3.24 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.97 0.00 54 K 8.55 4.31 0.00 1.54 1.56 0.00 1.62 0.00 0.00 1.72 0.00 0.00 2.86 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.57 1.52 7.81 55 V 7.67 4.96 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 0.84 0.00 0.00 1.07 0.00 0.00 56 A 8.17 4.74 1.16 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 57 K 9.04 4.47 0.00 1.78 1.75 0.00 1.65 0.00 0.00 1.61 0.00 0.00 2.84 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.47 1.55 7.81 58 V 9.02 4.81 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 1.01 0.00 0.00 1.04 0.00 0.00 59 R 8.99 4.78 0.00 1.96 1.83 0.00 3.19 0.00 0.00 3.30 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.65 0.00 60 L 9.69 4.81 0.00 1.79 1.69 0.90 0.48 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 61 T 8.65 3.94 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 1.29 0.00 0.00 62 S 7.98 4.23 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 63 G 8.62 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 64 Y 7.75 4.57 0.00 2.99 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 65 E 8.83 5.00 0.00 1.82 1.93 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 2.21 2.37 0.00 66 V 8.96 4.72 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 0.87 0.00 0.00 0.77 0.00 0.00 67 T 8.55 4.88 4.57 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 0.00 0.00 0.00 1.29 0.00 0.00 68 A 9.00 5.26 1.28 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 0.00 0.00 0.00 69 Y 9.22 4.34 0.00 2.97 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 70 I 6.37 4.57 1.51 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.64 0.77 0.00 0.00 71 P 0.00 4.66 0.00 2.74 2.53 0.00 3.81 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.21 0.00 72 G 8.72 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 0.00 0.00 0.00 73 E 8.58 4.05 0.00 1.89 1.97 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 2.17 2.18 0.00 74 G 7.61 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 0.00 0.00 0.00 0.00 75 H 8.27 5.17 0.00 3.21 3.26 0.00 5.48 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 N 8.48 5.02 0.00 2.78 2.85 0.00 0.00 5.94 7.79 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 77 L 8.43 4.30 0.00 1.66 1.65 0.82 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 78 Q 8.53 4.78 0.00 2.07 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.04 6.73 0.00 0.00 0.00 0.00 0.00 2.26 2.29 0.00 79 E 8.76 3.91 0.00 1.84 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.31 0.00 80 H 7.80 5.16 0.00 2.98 3.21 0.00 5.70 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 S 8.07 4.54 0.00 3.91 4.01 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 0.00 0.00 0.00 82 V 10.14 4.65 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 0.58 0.00 0.00 0.83 0.00 0.00 83 V 8.80 5.12 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 0.69 0.00 0.00 0.98 0.00 0.00 84 L 8.35 5.13 0.00 1.46 1.36 1.04 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 85 I 9.12 4.76 1.94 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.55 0.77 0.00 0.00 86 R 9.16 4.72 0.00 2.22 2.35 0.00 3.26 0.00 0.00 3.41 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.67 0.00 87 G 8.32 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 88 G 7.77 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 0.00 0.00 0.00 89 R 7.89 4.30 0.00 1.74 1.84 0.00 3.17 0.00 0.00 3.15 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.44 0.00 90 V 7.88 4.10 1.97 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 0.71 0.00 0.00 0.61 0.00 0.00 91 K 8.72 3.92 0.00 1.69 1.80 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.85 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.40 1.51 7.81 92 D 7.95 4.53 0.00 2.77 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 93 L 7.63 4.68 0.00 1.71 1.61 1.09 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 94 P 0.00 4.25 0.00 2.04 1.99 0.00 3.65 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.07 0.00 95 G 9.09 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 0.00 0.00 0.00 96 V 7.72 4.32 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 1.18 0.00 0.00 1.01 0.00 0.00 97 R 8.46 4.25 0.00 0.69 0.95 0.00 3.04 0.00 0.00 3.31 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.46 0.00 98 Y 7.29 5.44 0.00 3.02 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 99 H 9.02 5.35 0.00 3.23 3.38 0.00 5.79 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 I 8.10 4.74 2.03 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.60 0.94 0.00 0.00 101 V 8.90 3.70 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 0.73 0.00 0.00 0.87 0.00 0.00 102 R 8.53 4.39 0.00 2.01 2.05 0.00 3.41 0.00 0.00 3.52 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.81 0.00 103 G 8.35 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.28 4.17 1.76 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 -0.14 0.00 0.00 0.61 0.00 0.00 105 Y 8.04 3.84 0.00 3.19 2.34 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 0.00 106 D 9.56 4.50 0.00 2.90 2.74 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 0.00 107 A 7.88 4.35 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 0.00 108 A 8.97 4.47 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 0.00 109 G 8.27 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 110 V 8.00 3.83 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 0.71 0.00 0.00 0.90 0.00 0.00 111 K 8.71 4.11 0.00 1.74 1.70 0.00 1.81 0.00 0.00 1.81 0.00 0.00 2.82 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.53 1.47 7.81 112 D 8.78 4.60 0.00 2.82 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 0.00 113 R 7.23 4.31 0.00 2.04 1.91 0.00 3.43 0.00 0.00 3.25 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.82 0.00 114 K 8.28 4.68 0.00 1.69 1.78 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.34 1.64 7.81 115 K 8.54 3.93 0.00 1.84 1.60 0.00 1.70 0.00 0.00 1.84 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.53 1.42 7.81 116 S 9.41 4.71 0.00 4.07 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 0.00 117 R 8.36 4.00 0.00 1.89 2.22 0.00 3.23 0.00 0.00 3.12 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.79 0.00 118 S 8.24 4.05 0.00 3.80 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 0.00 119 K 8.05 4.18 0.00 0.99 1.20 0.00 1.59 0.00 0.00 1.54 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.27 1.24 7.81 120 Y 7.97 3.70 0.00 3.24 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 0.00 121 G 6.95 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 0.00 0.00 0.00 0.00 122 T 7.66 4.59 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 1.37 0.00 0.00 123 K 8.47 4.09 0.00 1.77 1.81 0.00 1.76 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.38 7.81 124 K 8.32 4.08 0.00 1.70 1.72 0.00 1.66 0.00 0.00 1.76 0.00 0.00 3.12 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.42 1.49 7.81 125 P 0.00 4.36 0.00 2.22 2.06 0.00 3.85 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 126 K 8.71 3.86 0.00 1.86 1.94 0.00 1.46 0.00 0.00 1.76 0.00 0.00 3.12 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.51 7.81 127 E 8.53 4.02 0.00 2.10 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 2.28 2.31 0.00 128 A 8.55 4.17 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