NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 41 R 4.3058 8.2129 119.0742 55.8292 31.1428 176.7537 42 R 3.9320 8.2892 112.4855 59.7238 28.8137 173.7992 43 E 4.2177 8.7206 124.9370 60.3618 29.8422 178.4478 44 A 4.0451 7.9757 120.7201 55.1195 18.3675 179.3910 45 E 4.1019 8.0621 117.9482 58.9809 29.6087 179.3611 46 R 3.9383 7.7845 119.7673 60.2407 30.1722 179.2880 47 Q 4.1023 8.2764 120.2664 60.0564 28.1132 180.0765 48 A 4.3372 8.2280 122.6567 55.2370 18.3553 179.6013 49 Q 3.9696 8.4704 118.0966 59.1085 29.0734 178.2396 50 A 3.9989 8.1663 122.0239 55.2046 18.5270 179.4032 51 Q 3.9874 8.3393 118.1421 59.0828 28.8935 178.2468 52 L 3.8172 7.8000 120.6751 58.1909 42.3603 178.4803 53 E 4.0927 8.3325 118.5832 59.4428 28.9370 179.5744 54 K 4.0302 8.3587 118.2417 59.1453 32.0973 178.9034 55 A 3.8514 7.8456 119.9569 53.9561 18.1630 179.3265 56 K 3.8308 7.5757 116.5546 59.1781 32.1881 177.6454 57 T 4.4176 7.1233 112.3980 63.1626 69.4286 175.0243 58 K 4.2674 7.7001 121.6476 55.0016 32.8387 175.1263 59 P 4.4389 0.0000 0.0000 61.9564 32.2078 176.2154 60 V 3.5416 8.0502 119.2774 62.9128 31.7596 175.6381 61 A 4.3346 8.6682 130.5213 54.6870 18.8043 176.8875 62 F 4.9264 7.2422 107.7019 56.0931 41.3908 172.4634 63 A 5.3345 8.7793 119.9484 50.3033 21.9889 175.8550 64 V 4.6527 8.7508 112.1306 59.5821 36.1718 174.5603 65 R 4.4800 8.4351 123.5741 54.6908 31.5525 175.7587 66 T 4.2212 8.3515 116.9518 61.6262 70.2097 174.8135 67 N 4.9308 8.8243 119.1572 53.4605 40.2588 174.3221 68 V 4.7628 7.6338 111.6467 59.6528 36.7382 174.2883 69 R 4.9986 8.5430 117.8793 55.2552 31.4693 175.1815 70 Y 4.5790 8.3822 121.0660 55.9921 42.0979 173.6951 71 S 4.2819 8.2603 121.1509 55.8223 64.0134 173.2566 72 A 3.8291 8.4657 130.2411 51.3159 18.9793 176.5522 73 A 4.7565 8.7082 123.4979 49.8563 22.5440 176.9245 74 Q 3.9512 8.9072 121.5424 59.5858 28.9814 178.9142 75 E 4.2698 8.0603 114.1035 58.0642 29.5891 177.1632 76 D 4.5593 8.3067 118.3097 54.6911 41.5764 175.5514 77 D 4.3562 7.8368 117.9877 55.2123 38.4661 174.5660 78 V 2.6503 7.3458 117.5240 61.6965 32.8552 173.6834 79 P 3.7973 0.0000 0.0000 64.6564 31.1043 175.8903 80 V 4.0937 6.4670 116.0012 59.8468 33.1480 172.9721 81 P 4.0562 0.0000 0.0000 64.5524 31.7425 176.5776 82 G 3.5510 8.4713 108.9039 46.1776 0.0000 173.1834 *84 A 4.3286 7.5889 119.5340 51.7805 19.9019 176.8349 85 I 4.4632 8.8662 122.6787 60.2404 37.9310 176.0267 86 S 4.6880 8.6931 123.6422 57.9800 64.4290 173.3764 87 F 5.0723 8.3499 115.8540 56.4588 41.5289 172.7325 88 E 5.0705 9.7562 119.3002 54.0867 32.5765 175.7138 89 A 4.2544 8.3315 123.1989 53.3086 18.8379 178.0793 90 K 3.9095 8.6914 120.2172 56.6287 30.4249 176.5022 91 D 4.7160 7.5904 119.4358 54.2709 42.3574 175.0768 92 F 5.0662 8.7551 118.5825 55.7613 42.0771 174.6354 93 L 5.1920 8.9121 122.3743 53.3005 45.5455 175.0208 94 H 5.2043 9.3750 120.4149 54.3693 30.8595 174.0051 95 V 4.3347 8.3936 123.8709 61.2868 33.1102 175.9723 96 K 4.1988 8.9363 127.9003 58.1631 33.3314 176.3859 97 E 4.6773 7.4627 114.7969 55.3582 32.5812 174.7839 98 K 4.5815 8.6453 122.1624 56.3353 32.9828 176.0777 99 F 4.7370 9.3831 129.7336 60.0933 39.7912 174.7830 100 N 4.8232 7.8482 115.8393 52.2641 39.0212 174.0365 101 N 4.5156 8.8947 114.0155 56.3695 38.9419 175.6343 102 D 4.3876 8.4953 117.2302 54.6478 41.9794 176.0303 103 W 5.6844 8.1925 118.1659 55.0309 33.8577 174.6024 104 W 5.6041 9.9675 124.0454 55.4966 32.2062 174.6535 105 I 4.8337 8.9238 122.0127 59.6137 39.5489 176.4205 106 G 3.8136 8.0194 112.8110 45.9850 0.0000 171.6410 107 R 4.9917 7.8932 114.4573 54.1125 33.3723 174.3961 108 L 4.3827 8.5153 122.8369 55.4143 42.8518 177.5765 109 V 3.9555 8.6250 127.3432 61.9110 30.4268 174.2561 110 K 4.4776 8.0635 124.6341 54.3534 35.2745 174.7052 111 E 4.0806 8.7769 125.5586 58.3020 29.7058 177.7351 112 G 3.9890 8.9412 111.4211 45.4299 0.0000 173.0660 113 C 4.4890 7.8746 117.7322 59.4430 28.8652 172.9859 114 E 4.7845 8.5234 121.4021 53.7836 32.7566 175.4360 115 I 3.8255 8.2815 121.1806 62.5439 38.7015 175.5109 116 G 3.9224 8.7601 113.8288 46.1620 0.0000 170.7666 117 F 5.4727 8.6243 118.8829 56.2432 41.0780 175.0310 118 I 5.1586 9.0544 125.7004 58.7939 39.2115 173.5766 119 P 3.8704 0.0000 0.0000 62.4940 31.6662 176.4441 120 S 2.9116 7.9512 118.3443 56.8200 64.2198 173.3547 121 P 4.0038 0.0000 0.0000 65.6678 30.9042 179.0886 122 V 3.4773 7.5025 116.4853 65.8203 31.2667 177.9189 123 K 3.6932 7.2872 117.6389 59.2140 32.0250 178.3734 124 L 3.8928 7.4889 118.4778 57.8225 41.7595 178.8783 125 E 4.0786 8.1527 119.0966 59.0693 29.4689 178.9754 126 N 4.6492 7.9830 115.6438 53.3498 38.6967 177.2158 *128 R 4.1904 7.9698 121.6552 56.5048 32.2361 177.0835 129 L 3.9697 8.1885 118.0015 58.0291 41.5846 179.3262 130 Q 4.1226 8.3031 119.4617 59.5823 28.9957 177.9130 131 H 4.0998 8.1539 118.6949 59.2990 29.7834 176.7255 132 E 4.0147 8.1443 120.0723 59.1516 29.5707 178.4765 133 Q 4.1234 8.2262 118.4505 58.7947 28.5508 178.5276 134 R 4.1251 7.8196 117.8591 58.4942 30.3961 178.3212 135 A 4.1830 8.1113 121.5927 54.0273 18.4670 178.1188 136 K 4.1544 7.3665 122.1724 54.5176 32.4091 181.4715 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 41 R 8.21 4.31 0.00 1.75 1.90 0.00 3.22 0.00 0.00 3.33 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.20 0.00 42 R 8.29 3.93 0.00 1.89 1.93 0.00 3.23 0.00 0.00 3.30 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.31 0.00 43 E 8.72 4.22 0.00 2.08 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 2.39 2.47 0.00 44 A 7.98 4.05 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 45 E 8.06 4.10 0.00 2.19 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 0.00 2.49 2.19 0.00 46 R 7.78 3.94 0.00 1.93 2.12 0.00 3.10 0.00 0.00 3.21 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 47 Q 8.28 4.10 0.00 2.12 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 2.29 2.25 0.00 48 A 8.23 4.34 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 0.00 0.00 0.00 0.00 0.00 49 Q 8.47 3.97 0.00 2.24 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 50 A 8.17 4.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.34 3.99 0.00 2.37 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.76 0.00 0.00 0.00 0.00 0.00 2.59 2.50 0.00 52 L 7.80 3.82 0.00 1.66 1.85 0.42 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 53 E 8.33 4.09 0.00 2.14 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 0.00 2.59 2.50 0.00 54 K 8.36 4.03 0.00 1.98 1.88 0.00 1.69 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.64 7.81 55 A 7.85 3.85 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 56 K 7.58 3.83 0.00 1.77 1.90 0.00 1.66 0.00 0.00 1.68 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.65 7.81 57 T 7.12 4.42 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 1.21 0.00 0.00 58 K 7.70 4.27 0.00 1.88 1.72 0.00 1.80 0.00 0.00 1.73 0.00 0.00 3.13 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.54 7.81 59 P 0.00 4.44 0.00 2.15 2.03 0.00 3.75 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.93 0.00 60 V 8.05 3.54 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 0.58 0.00 0.00 0.83 0.00 0.00 61 A 8.67 4.33 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 62 F 7.24 4.93 0.00 3.12 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 63 A 8.78 5.33 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 64 V 8.75 4.65 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 1.01 0.00 0.00 65 R 8.44 4.48 0.00 1.45 1.62 0.00 3.09 0.00 0.00 3.21 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.50 0.00 66 T 8.35 4.22 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 0.42 0.00 0.00 67 N 8.82 4.93 0.00 2.60 2.87 0.00 0.00 6.73 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 68 V 7.63 4.76 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 0.99 0.00 0.00 1.05 0.00 0.00 69 R 8.54 5.00 0.00 1.95 1.95 0.00 2.97 0.00 0.00 3.12 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.55 0.00 70 Y 8.38 4.58 0.00 2.35 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 71 S 8.26 4.28 0.00 3.70 3.56 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 72 A 8.47 3.83 1.08 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 73 A 8.71 4.76 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 74 Q 8.91 3.95 0.00 2.05 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.91 0.00 0.00 0.00 0.00 0.00 2.43 2.35 0.00 75 E 8.06 4.27 0.00 2.01 2.02 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 2.33 2.41 0.00 76 D 8.31 4.56 0.00 3.05 3.09 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 0.00 0.00 0.00 0.00 77 D 7.84 4.36 0.00 2.93 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 78 V 7.35 2.65 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 0.01 0.00 0.00 0.89 0.00 0.00 79 P 0.00 3.80 0.00 0.49 1.10 0.00 2.20 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 1.51 0.00 80 V 6.47 4.09 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 0.82 0.00 0.00 0.92 0.00 0.00 81 P 0.00 4.06 0.00 2.03 1.95 0.00 3.79 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.03 0.00 82 G 8.47 3.55 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 0.00 0.00 0.00 *84 A 7.59 4.33 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 85 I 8.87 4.46 2.17 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 1.51 1.03 1.12 0.00 0.00 86 S 8.69 4.69 0.00 3.66 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 87 F 8.35 5.07 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 88 E 9.76 5.07 0.00 2.03 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 2.28 2.41 0.00 89 A 8.33 4.25 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 90 K 8.69 3.91 0.00 1.93 1.98 0.00 1.77 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.35 1.53 7.81 91 D 7.59 4.72 0.00 2.65 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 92 F 8.76 5.07 0.00 2.95 2.97 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 93 L 8.91 5.19 0.00 1.56 1.53 0.55 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 94 H 9.37 5.20 0.00 2.98 3.15 0.00 5.57 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 95 V 8.39 4.33 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 0.00 0.00 0.57 0.00 0.00 0.81 0.00 0.00 96 K 8.94 4.20 0.00 1.69 1.79 0.00 1.75 0.00 0.00 1.89 0.00 0.00 3.03 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.52 1.30 7.81 97 E 7.46 4.68 0.00 2.00 1.99 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 2.23 2.33 0.00 98 K 8.65 4.58 0.00 1.75 1.82 0.00 1.84 0.00 0.00 1.70 0.00 0.00 2.84 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.59 1.71 7.81 99 F 9.38 4.74 0.00 3.38 3.66 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 0.00 100 N 7.85 4.82 0.00 2.91 2.61 0.00 0.00 6.13 6.96 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 0.00 101 N 8.89 4.52 0.00 2.76 2.94 0.00 0.00 6.73 8.06 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 0.00 102 D 8.50 4.39 0.00 2.86 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 0.00 0.00 0.00 103 W 8.19 5.68 0.00 3.66 3.36 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 0.00 104 W 9.97 5.60 0.00 3.36 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 0.00 105 I 8.92 4.83 1.91 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 0.83 0.76 0.00 0.00 106 G 8.02 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 0.00 107 R 7.89 4.99 0.00 1.85 1.98 0.00 2.78 0.00 0.00 3.11 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.57 0.00 108 L 8.52 4.38 0.00 1.76 1.67 1.05 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 109 V 8.62 3.96 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 0.65 0.00 0.00 0.70 0.00 0.00 110 K 8.06 4.48 0.00 1.82 1.60 0.00 1.83 0.00 0.00 1.85 0.00 0.00 2.90 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.43 1.46 7.81 111 E 8.78 4.08 0.00 2.00 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 2.32 2.32 0.00 112 G 8.94 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 0.00 0.00 0.00 113 C 7.87 4.49 0.00 3.16 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 0.00 114 E 8.52 4.78 0.00 1.80 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 2.19 2.25 0.00 115 I 8.28 3.83 1.82 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 1.12 0.67 0.83 0.00 0.00 116 G 8.76 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 0.00 117 F 8.62 5.47 0.00 2.72 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 0.00 118 I 9.05 5.16 2.20 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.01 1.06 0.00 0.00 119 P 0.00 3.87 0.00 1.36 0.92 0.00 4.00 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 1.73 0.57 0.00 120 S 7.95 2.91 0.00 3.55 3.55 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 0.00 121 P 0.00 4.00 0.00 2.13 2.09 0.00 3.39 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.01 0.00 122 V 7.50 3.48 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 0.96 0.00 0.00 0.90 0.00 0.00 123 K 7.29 3.69 0.00 1.32 1.36 0.00 1.48 0.00 0.00 1.29 0.00 0.00 3.06 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.30 0.89 7.81 124 L 7.49 3.89 0.00 1.62 1.61 0.85 0.94 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 0.00 125 E 8.15 4.08 0.00 2.07 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 0.00 2.27 2.35 0.00 126 N 7.98 4.65 0.00 2.69 2.75 0.00 0.00 6.62 6.94 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 *128 R 7.97 4.19 0.00 1.92 2.08 0.00 3.18 0.00 0.00 3.32 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 129 L 8.19 3.97 0.00 1.91 1.70 0.90 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 130 Q 8.30 4.12 0.00 2.10 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.81 0.00 0.00 0.00 0.00 0.00 2.37 2.37 0.00 131 H 8.15 4.10 0.00 3.29 3.43 0.00 5.92 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 0.00 132 E 8.14 4.01 0.00 2.04 2.17 0.00 0.00 0.00 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 2.35 0.00 133 Q 8.23 4.12 0.00 2.31 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.57 0.00 0.00 0.00 0.00 0.00 2.37 2.48 0.00 134 R 7.82 4.13 0.00 1.74 1.94 0.00 3.25 0.00 0.00 3.21 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 135 A 8.11 4.18 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 0.00 136 K 7.37 4.15 0.00 1.80 1.54 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.28 1.21 7.81 * Residues marked with a * may have inaccurate shift predictions.