NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 31 Q 4.4328 8.3401 119.1197 54.4735 29.7725 174.8973 32 A 4.1065 8.1889 125.8618 48.3961 19.2447 175.7124 33 P 4.2048 0.0000 0.0000 66.1470 31.9488 176.8830 34 E 4.0411 8.1274 118.3310 58.7683 29.5605 178.3039 35 E 4.0774 8.4033 119.5539 59.0585 29.5574 179.1879 36 R 3.9755 7.8992 115.7874 59.2249 29.7177 178.2969 37 C 4.1459 8.2496 119.5917 61.9836 31.4346 175.5586 38 R 3.9420 8.0450 120.4461 59.5345 29.7279 178.4659 39 L 3.9819 8.1933 118.6966 57.8344 41.4728 179.4898 40 A 4.0564 8.4805 120.7589 55.0535 18.3308 179.5833 41 A 3.6139 8.3614 119.4921 55.3048 18.4486 179.9549 42 Q 3.9131 8.4753 116.6960 58.9206 28.6850 178.5630 43 A 4.1275 8.3125 121.4531 54.3546 18.2745 179.2494 44 C 4.0614 7.6804 117.9031 62.3539 31.8089 175.5944 45 I 3.6846 7.5343 114.7166 64.1534 36.9621 178.3561 46 R 3.9749 8.0122 119.5547 58.9247 29.8824 178.9271 47 A 4.0629 7.7118 120.7106 55.2381 18.3103 179.5812 48 C 4.2171 8.4513 115.7646 63.0970 28.4133 176.2176 49 E 4.0065 8.7946 120.4877 59.0120 28.8633 179.5042 50 R 3.8984 7.8850 118.8400 59.5485 30.3239 177.8334 51 Y 4.1004 8.1550 119.3646 60.6228 38.5331 177.9665 52 L 3.7429 8.0558 118.8725 57.5796 41.8915 178.7933 53 A 4.3114 7.6834 117.7043 53.0686 19.2369 178.5719 54 L 4.3964 7.7759 116.7927 55.5122 42.7602 176.9665 55 C 3.9370 7.1714 118.5743 60.4025 31.4674 173.2855 56 T 4.3462 8.4672 122.8364 63.7418 68.5395 174.8164 57 E 4.6791 7.8146 118.1004 55.5553 30.3193 176.1138 58 S 4.4592 7.8657 113.6674 58.6820 63.9122 174.1509 59 S 4.6608 8.7461 116.9520 56.9266 64.9268 175.3169 60 R 3.9275 8.4570 122.7138 59.5289 28.9105 178.6077 61 E 3.9321 8.1122 119.3327 59.1082 29.8006 178.4444 62 Q 4.0774 8.1688 117.5750 59.2932 28.7570 179.1122 63 R 4.0713 8.4952 119.3179 59.3751 30.0975 178.9253 64 Q 3.9979 8.1275 119.3646 59.4900 29.0918 178.0898 65 H 4.2433 8.6085 117.2902 58.6307 28.6735 177.6364 66 A 4.1521 8.4820 122.8985 55.2234 18.2097 179.9773 67 G 3.5632 8.5070 104.5666 47.9259 0.0000 175.7238 68 D 4.2434 8.2184 121.2220 57.2660 40.7902 178.4415 69 C 4.0971 8.1189 118.8192 62.3574 31.3763 175.3348 70 A 3.9314 8.0437 121.5620 55.2413 18.2308 179.1624 71 D 4.3618 8.3149 117.4732 57.6143 40.9268 178.8556 72 L 3.9290 7.8959 119.3972 58.2491 41.6349 179.5942 73 C 3.9523 8.3843 116.7735 62.5958 27.8726 176.4062 74 R 3.9173 7.8470 120.0582 58.7852 29.5757 178.7929 75 L 3.8778 7.6812 119.4922 58.2171 42.0928 178.6400 76 A 4.0474 8.0059 119.2153 55.0290 18.3438 179.2276 77 A 4.1004 7.8904 118.3466 55.3778 18.9278 179.2518 78 L 4.3312 7.9634 120.2258 57.4928 42.0574 179.2161 79 L 4.2348 8.0503 118.6613 55.0295 41.9229 178.9960 *81 E 4.2401 8.2139 120.2487 56.5972 31.3600 177.6836 82 R 4.4078 8.0262 114.7768 55.3090 30.0366 176.4122 83 R 3.7643 7.9417 115.1788 57.0136 28.0542 176.4733 84 S 4.4355 8.1847 111.5784 57.4510 63.0972 172.6715 85 P 4.3564 0.0000 0.0000 63.9645 31.2848 176.7141 86 W 4.4098 8.3120 118.8438 57.0233 30.0494 177.7524 87 A 4.0975 8.1737 122.0708 55.0079 17.8285 177.7148 88 P 4.2462 0.0000 0.0000 66.0025 31.0151 178.2362 89 A 3.9916 8.0381 119.6211 55.0635 18.4983 179.3835 90 A 4.0453 8.4846 119.4919 55.4225 18.4157 179.5400 91 C 4.2719 8.6385 115.8666 63.1058 28.1222 176.0016 92 E 4.0016 8.2030 120.4407 59.0815 28.9047 178.4939 93 L 4.0531 7.9067 120.3856 58.0910 42.0612 178.9295 94 A 4.1156 8.3765 120.6547 55.1204 18.3987 179.4669 95 A 4.2504 8.3748 119.4259 55.1538 18.4468 179.7387 96 R 3.8117 8.3711 117.4504 60.1161 30.3072 178.4132 97 Y 3.9961 8.1308 115.0374 60.0929 37.5702 178.0148 98 A 4.1434 8.3416 122.9765 54.9295 18.4553 179.5082 99 L 4.0233 8.1133 118.1801 58.7415 40.3007 179.2270 100 A 3.9436 7.9657 121.4556 54.9787 18.2336 179.1885 101 C 4.1701 8.3417 117.2323 62.4435 31.5033 175.6752 102 A 3.9931 7.6896 122.3045 55.1521 17.7727 179.4946 103 E 3.9029 8.4303 116.4034 58.8612 29.5057 178.8233 104 R 4.3765 7.3616 115.5998 56.7748 31.3562 176.7888 105 C 4.4554 8.1172 113.7442 59.2010 28.7583 173.0493 106 D 4.9115 7.7680 121.5313 53.6948 42.7370 173.6069 107 G 4.3901 7.9454 115.6123 45.5300 0.0000 173.8461 108 D 4.7567 9.3791 122.6147 54.2780 43.3487 176.7666 109 E 4.2382 8.2201 117.7857 55.0236 31.4210 175.8001 110 P 4.2424 0.0000 0.0000 66.5392 31.1872 178.6590 111 L 3.8887 8.0420 118.5220 57.3482 41.5855 179.3358 112 E 3.9920 8.0750 118.3149 59.1736 29.6525 179.2157 113 R 4.3746 8.1939 117.7937 58.5677 29.6318 178.7550 114 E 3.8981 8.9439 119.8801 59.3403 29.4862 178.7694 115 C 4.0230 8.0334 118.3935 62.5779 31.6350 175.5595 116 A 4.0859 7.9395 122.1850 54.7819 17.9132 179.8181 117 G 3.4661 8.5252 104.4626 48.0796 0.0000 175.5977 118 A 4.1635 8.4624 124.5354 55.0498 18.2850 179.5368 119 C 4.2263 7.9901 114.6609 62.9340 28.1036 176.6028 120 R 3.8741 7.9072 119.5390 59.4061 29.5464 178.8682 121 R 4.0053 8.2465 117.3986 59.5145 30.1588 178.0299 122 F 4.3962 8.4547 120.2514 61.4313 39.4345 177.1597 123 V 3.1320 7.7528 117.7885 66.0816 31.0488 177.8052 124 E 3.8973 8.4077 117.1189 58.4699 29.3136 178.0819 125 A 4.4510 7.5768 118.6134 52.4024 19.3977 177.8259 126 C 4.1558 7.6409 116.1503 61.8656 28.8362 175.6432 127 R 4.0470 7.8779 118.5043 58.6263 29.7873 174.7153 128 P 4.3890 0.0000 0.0000 63.0599 31.1809 175.8244 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 31 Q 8.34 4.43 0.00 2.09 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.95 0.00 0.00 0.00 0.00 0.00 2.18 1.94 0.00 32 A 8.19 4.11 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 33 P 0.00 4.20 0.00 2.26 2.33 0.00 3.70 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.03 0.00 34 E 8.13 4.04 0.00 2.03 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 2.40 2.35 0.00 35 E 8.40 4.08 0.00 2.17 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 2.34 2.32 0.00 36 R 7.90 3.98 0.00 2.09 2.20 0.00 3.06 0.00 0.00 3.27 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.96 0.00 37 C 8.25 4.15 0.00 3.28 3.01 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 38 R 8.05 3.94 0.00 2.31 2.10 0.00 3.18 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 39 L 8.19 3.98 0.00 2.03 1.74 1.05 0.67 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 40 A 8.48 4.06 1.55 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 41 A 8.36 3.61 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 42 Q 8.48 3.91 0.00 2.10 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.37 2.60 0.00 43 A 8.31 4.13 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 44 C 7.68 4.06 0.00 3.05 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 45 I 7.53 3.68 1.83 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 1.59 0.67 0.89 0.00 0.00 46 R 8.01 3.97 0.00 2.09 2.03 0.00 3.35 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 47 A 7.71 4.06 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 48 C 8.45 4.22 0.00 3.15 3.13 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 0.00 0.00 0.00 0.00 49 E 8.79 4.01 0.00 1.97 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 2.33 2.55 0.00 50 R 7.88 3.90 0.00 2.16 2.12 0.00 3.12 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.65 0.00 51 Y 8.16 4.10 0.00 3.13 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 52 L 8.06 3.74 0.00 1.86 1.69 0.95 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 53 A 7.68 4.31 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 54 L 7.78 4.40 0.00 1.75 1.71 0.91 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 55 C 7.17 3.94 0.00 2.77 2.36 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 56 T 8.47 4.35 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 1.19 0.00 0.00 57 E 7.81 4.68 0.00 2.04 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 0.00 2.17 2.29 0.00 58 S 7.87 4.46 0.00 3.90 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 59 S 8.75 4.66 0.00 3.95 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 60 R 8.46 3.93 0.00 2.06 2.20 0.00 3.20 0.00 0.00 3.28 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.66 0.00 61 E 8.11 3.93 0.00 2.14 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 2.39 2.51 0.00 62 Q 8.17 4.08 0.00 2.51 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.68 0.00 0.00 0.00 0.00 0.00 2.60 2.51 0.00 63 R 8.50 4.07 0.00 2.09 2.00 0.00 3.03 0.00 0.00 3.05 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.54 0.00 64 Q 8.13 4.00 0.00 2.34 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.82 0.00 0.00 0.00 0.00 0.00 2.40 2.62 0.00 65 H 8.61 4.24 0.00 3.49 3.40 0.00 5.87 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 A 8.48 4.15 1.63 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 0.00 0.00 67 G 8.51 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 0.00 0.00 0.00 68 D 8.22 4.24 0.00 2.93 2.46 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 0.00 0.00 0.00 69 C 8.12 4.10 0.00 3.23 3.11 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 70 A 8.04 3.93 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 71 D 8.31 4.36 0.00 2.73 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 72 L 7.90 3.93 0.00 1.64 1.68 0.51 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 73 C 8.38 3.95 0.00 2.96 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 74 R 7.85 3.92 0.00 2.04 1.94 0.00 3.09 0.00 0.00 3.06 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.75 0.00 75 L 7.68 3.88 0.00 1.72 1.83 0.89 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 76 A 8.01 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 77 A 7.89 4.10 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 78 L 7.96 4.33 0.00 1.79 1.91 0.91 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.05 4.23 0.00 1.95 1.77 1.02 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 *81 E 8.21 4.24 0.00 2.20 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 0.00 2.32 2.65 0.00 82 R 8.03 4.41 0.00 1.88 1.98 0.00 3.49 0.00 0.00 3.24 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.76 0.00 83 R 7.94 3.76 0.00 1.89 1.98 0.00 3.32 0.00 0.00 3.21 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.66 0.00 84 S 8.18 4.44 0.00 4.01 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 85 P 0.00 4.36 0.00 1.62 1.89 0.00 3.97 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 1.60 0.00 86 W 8.31 4.41 0.00 3.55 3.17 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 0.00 0.00 0.00 87 A 8.17 4.10 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 88 P 0.00 4.25 0.00 2.27 2.33 0.00 3.70 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 2.06 2.00 0.00 89 A 8.04 3.99 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 A 8.48 4.05 1.44 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 0.00 0.00 0.00 91 C 8.64 4.27 0.00 3.15 3.04 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 92 E 8.20 4.00 0.00 2.09 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 2.34 2.33 0.00 93 L 7.91 4.05 0.00 1.78 1.72 0.93 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 94 A 8.38 4.12 1.58 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 0.00 0.00 95 A 8.37 4.25 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 96 R 8.37 3.81 0.00 2.04 2.32 0.00 3.13 0.00 0.00 3.28 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.63 0.00 97 Y 8.13 4.00 0.00 3.07 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 98 A 8.34 4.14 1.70 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 99 L 8.11 4.02 0.00 1.96 1.95 0.99 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 100 A 7.97 3.94 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 0.00 101 C 8.34 4.17 0.00 3.19 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 0.00 102 A 7.69 3.99 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 0.00 103 E 8.43 3.90 0.00 2.03 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 2.33 2.65 0.00 104 R 7.36 4.38 0.00 1.86 1.84 0.00 2.98 0.00 0.00 2.55 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.54 0.00 105 C 8.12 4.46 0.00 2.66 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 0.00 0.00 0.00 0.00 106 D 7.77 4.91 0.00 2.78 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 0.00 107 G 7.95 4.39 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 0.00 108 D 9.38 4.76 0.00 2.63 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 0.00 109 E 8.22 4.24 0.00 2.17 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 2.42 2.39 0.00 110 P 0.00 4.24 0.00 2.45 2.34 0.00 3.73 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 2.10 2.09 0.00 111 L 8.04 3.89 0.00 1.82 1.96 0.94 1.01 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 0.00 112 E 8.08 3.99 0.00 2.24 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 2.56 2.51 0.00 113 R 8.19 4.37 0.00 2.03 2.18 0.00 3.06 0.00 0.00 3.27 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.58 0.00 114 E 8.94 3.90 0.00 2.07 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 2.34 2.40 0.00 115 C 8.03 4.02 0.00 2.98 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 0.00 116 A 7.94 4.09 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 0.00 117 G 8.53 3.47 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 0.00 118 A 8.46 4.16 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 0.00 119 C 7.99 4.23 0.00 3.21 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 0.00 120 R 7.91 3.87 0.00 2.08 2.12 0.00 3.15 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.92 0.00 121 R 8.25 4.01 0.00 1.78 2.17 0.00 3.30 0.00 0.00 3.19 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.69 0.00 122 F 8.45 4.40 0.00 3.21 3.33 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 0.00 123 V 7.75 3.13 2.16 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 0.99 0.00 0.00 1.09 0.00 0.00 124 E 8.41 3.90 0.00 2.11 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 2.33 2.51 0.00 125 A 7.58 4.45 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 0.00 126 C 7.64 4.16 0.00 2.85 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 0.00 127 R 7.88 4.05 0.00 1.73 1.98 0.00 3.18 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.79 0.00 128 P 0.00 4.39 0.00 2.15 2.02 0.00 3.60 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 2.06 1.93 0.00 * Residues marked with a * may have inaccurate shift predictions.