NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 28 Q 4.3503 8.1876 119.1179 54.5974 30.6266 176.0323 29 S 4.1984 7.8773 111.6563 59.1399 62.9640 173.7837 30 R 3.8578 8.2851 124.7585 60.3074 30.0839 179.4811 31 T 3.8219 7.8087 114.5158 66.5107 68.5393 176.0046 32 L 3.9212 7.9757 121.7208 58.4736 41.9406 178.8907 33 L 4.0187 8.2191 118.5956 57.8293 41.4548 179.4630 34 A 4.0991 8.5059 121.2265 54.8034 18.2394 179.9911 35 G 3.5158 8.2898 104.7751 47.9650 0.0000 176.0623 36 I 3.7067 8.1561 122.8859 64.0958 37.1416 178.6610 37 V 3.5756 7.9781 119.2090 66.0050 31.3313 177.8121 38 Q 3.9284 8.3092 119.4202 59.3194 28.8512 178.0506 39 Q 4.1458 8.5560 120.9733 59.2302 28.9377 178.1674 40 Q 3.9780 8.3100 119.3350 58.8510 28.6604 178.5069 41 Q 3.9470 8.0767 120.5270 59.4526 29.1418 178.5407 42 Q 3.9907 8.1023 118.9523 58.9032 28.7198 178.7624 43 L 4.0061 8.2743 120.4338 57.6044 41.5761 179.2457 44 L 3.9539 8.2167 120.5796 58.2446 42.0746 178.7174 45 D 4.3296 8.3021 118.9466 57.2990 40.7787 178.9336 46 V 3.5574 7.8106 118.5566 66.3223 31.5576 178.6304 47 V 3.8409 7.9367 111.9890 64.1275 31.3975 178.8227 48 K 3.9780 8.3211 118.7053 59.5478 31.9145 179.6372 49 R 4.1450 7.9978 118.2584 59.2529 29.9474 179.0300 50 Q 4.0397 8.6823 118.3297 58.9803 28.6539 178.7032 51 Q 4.0053 8.2764 120.7729 59.1361 29.0899 178.0770 52 E 4.0611 8.1671 119.5969 59.2156 29.4705 179.0932 53 L 4.0179 8.0908 120.5002 57.9730 42.0815 179.0263 54 L 4.0493 8.3694 119.4506 57.8991 41.6114 179.5791 55 R 4.0029 8.4901 118.3926 59.4500 30.0212 179.1864 56 L 4.1704 8.1617 118.6630 58.0512 41.4962 179.7183 57 T 4.0587 8.1576 115.9405 66.5226 68.3391 176.9659 58 V 3.8537 8.4062 120.7439 65.6801 31.5589 177.7423 59 W 4.3054 8.6038 128.3132 60.6255 30.4778 178.1280 60 G 3.5897 8.6700 105.5320 48.1745 0.0000 175.7017 61 T 3.8416 8.3108 118.3800 66.2323 68.3701 176.9236 62 K 3.7777 8.2491 120.4322 59.3327 32.0993 178.8715 63 N 3.8604 7.5331 117.2105 56.4815 38.7150 176.8409 64 L 3.7699 7.7558 120.5010 57.6995 41.6748 179.1510 65 Q 3.3229 7.7762 119.6665 59.3053 28.7295 178.6194 66 T 3.6490 7.7040 116.7520 66.7522 68.4802 176.8914 67 R 3.8597 7.7628 119.9055 58.9450 29.9956 179.2824 68 V 3.5108 8.0374 118.6398 66.1844 31.5104 178.1894 69 T 3.9865 8.0900 116.6699 65.9268 68.1347 176.4230 70 A 3.9272 7.8513 122.6663 55.0903 18.3209 179.7564 71 I 3.5779 7.7335 118.2538 64.5536 36.7855 178.4731 72 E 3.4980 8.2070 119.5061 59.1149 29.2014 179.4315 73 K 3.7703 7.9758 119.5473 59.5179 32.2343 178.1955 74 Y 3.9289 8.0699 119.9692 60.6965 38.6852 178.1362 75 L 3.6342 7.9384 120.2453 57.3300 41.6284 179.3488 76 K 3.6780 6.9687 119.4275 59.5219 32.0269 178.5232 77 D 4.2643 7.9674 119.2499 57.4725 40.6298 178.8926 78 Q 3.7797 7.8833 118.3165 58.7452 28.6279 178.6662 79 A 4.0131 7.9904 121.8060 55.3145 18.3536 179.7972 80 Q 4.0059 8.2194 116.5959 58.9358 28.7318 178.5723 81 L 4.0072 8.2799 121.8357 58.3167 42.0634 178.8505 82 N 4.4014 8.6892 116.6825 56.0783 38.3056 177.2529 83 A 4.0080 8.2812 122.3861 54.8609 18.5092 179.4656 84 W 4.2697 8.7936 127.3517 60.7289 30.8836 178.5126 85 G 3.6651 8.8621 105.7709 47.7764 0.0000 175.5159 86 A 4.1480 8.1282 122.1093 54.7203 18.3538 179.2338 87 A 3.7515 7.2565 118.8394 54.1506 18.5466 178.3629 88 F 4.4433 7.1707 113.2705 56.5164 41.4890 175.4383 89 R 3.8652 8.1515 117.8192 57.7504 27.7369 176.9325 90 Q 4.3401 7.6146 116.2290 58.2604 28.6181 177.1486 91 V 3.1469 7.0059 118.4840 64.3350 29.2306 174.1010 *94 T 4.3217 7.4854 113.1793 60.7875 71.0238 174.7942 95 T 4.5665 7.5665 118.6240 61.3549 70.6810 174.0886 96 V 3.7358 8.3029 125.7238 61.8599 31.9895 174.0311 97 P 4.3096 0.0000 0.0000 62.4141 31.6884 175.8409 98 W 4.3420 8.8327 133.1945 56.8853 30.8602 174.1596 99 P 4.3110 0.0000 0.0000 64.6911 31.4258 176.6278 100 N 4.3467 6.9997 115.6605 52.6011 39.2136 174.5693 101 A 4.1724 8.4153 123.4548 52.0922 19.3182 178.4742 102 S 4.0909 9.1240 118.6631 62.3196 62.4455 176.4849 103 L 4.4198 7.9077 117.3250 55.3894 41.5467 180.2150 104 T 4.2896 8.4189 116.0014 67.4586 68.2877 174.5297 105 P 4.3481 0.0000 0.0000 65.3771 31.3175 178.5361 106 K 3.9907 8.1325 118.0183 59.2754 32.1462 178.4119 107 W 4.4519 8.3954 128.6914 60.5596 30.6144 177.3081 108 N 4.1425 8.8101 117.3579 56.7267 38.3542 176.2659 109 N 4.3692 8.5496 118.6353 56.8824 39.0665 176.6928 110 E 4.0736 8.6403 120.2135 59.7151 29.4945 179.4585 111 T 3.8868 8.2608 115.9634 66.5723 68.5141 176.7342 112 W 4.0824 8.5749 120.5392 59.3007 29.0861 178.7765 113 Q 4.1666 8.5414 118.7223 58.8643 28.1456 178.3112 114 E 3.9634 8.3524 120.4568 58.9179 29.6931 178.3462 115 W 4.1088 8.3621 128.6590 60.6321 30.5979 177.5016 116 E 3.9570 8.7788 119.0027 59.3709 29.1625 178.8985 117 R 3.9508 8.1052 118.0502 59.2679 30.1246 179.2650 118 K 3.9218 8.0360 118.1208 59.3923 31.9723 179.5465 119 V 3.3043 7.6615 118.8704 66.0471 31.3202 177.7982 120 D 4.3084 8.4031 118.9954 57.1421 40.5417 178.4289 121 F 4.0852 8.2635 121.1296 61.4597 39.4020 177.2273 122 L 3.9201 8.1987 118.5260 57.7815 41.3895 179.4125 123 E 3.9075 8.4680 118.9729 59.3127 29.4088 179.0241 124 E 3.8493 8.1327 119.3751 59.1267 29.5940 178.4531 125 N 4.0608 8.0150 117.3614 56.6661 38.9294 177.0282 126 I 3.6501 8.2153 121.5541 64.5937 37.1567 178.5157 127 T 3.7992 7.9511 116.4201 66.6105 68.2694 176.5203 128 A 3.9911 8.0180 122.6257 55.1190 18.2963 179.7316 129 L 3.9760 8.1056 117.7645 57.7026 41.6130 179.7105 130 L 3.9794 8.1662 119.3601 57.7036 41.5662 179.3077 131 E 3.9506 8.2273 118.5844 59.4514 29.3442 179.1938 132 E 3.9531 8.3332 118.3918 59.3817 29.4192 179.3017 133 A 3.9677 8.2495 120.9657 55.1147 18.4366 179.5002 134 Q 3.8869 8.2643 118.1596 59.3216 29.1393 178.4670 135 I 3.6846 7.8135 120.8497 64.5608 37.0963 178.2885 136 Q 3.9861 8.3450 120.3871 58.7679 28.7275 177.8087 137 Q 3.9491 8.4114 121.3096 59.2848 29.0620 178.2106 138 E 3.9899 8.2591 119.5060 59.3372 29.4127 179.5215 139 K 3.9949 8.2439 118.5779 59.4942 32.0665 179.1446 140 N 4.3523 8.4669 117.0058 56.5600 38.4093 177.1370 141 M 4.0539 8.3923 119.8614 58.6323 32.4403 177.4736 142 Y 4.0271 8.2706 119.7908 60.9734 38.9795 178.2008 143 E 3.9851 8.5856 119.5143 59.1987 29.0888 179.0403 144 L 3.9343 8.3581 120.8889 58.3741 41.9523 179.1439 145 Q 4.0667 8.1853 117.2907 58.0668 28.8856 177.9851 146 K 4.0925 7.5856 119.2695 58.7859 32.8610 178.8437 147 L 3.9968 7.6723 121.4019 57.5860 42.1287 177.6638 148 N 4.6856 7.5472 112.8446 53.5625 37.6011 175.2632 149 S 4.2112 7.7540 122.9924 59.0129 63.9221 173.6150 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 28 Q 8.19 4.35 0.00 2.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.92 6.96 0.00 0.00 0.00 0.00 0.00 2.26 1.93 0.00 29 S 7.88 4.20 0.00 4.12 4.13 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 30 R 8.29 3.86 0.00 1.99 1.98 0.00 3.25 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.83 0.00 31 T 7.81 3.82 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 32 L 7.98 3.92 0.00 1.75 1.89 0.92 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.22 4.02 0.00 1.85 1.70 0.92 1.03 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 34 A 8.51 4.10 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 35 G 8.29 3.52 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 0.00 0.00 0.00 36 I 8.16 3.71 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 1.41 0.65 0.91 0.00 0.00 37 V 7.98 3.58 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 1.00 0.00 0.00 0.97 0.00 0.00 38 Q 8.31 3.93 0.00 2.23 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.57 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 39 Q 8.56 4.15 0.00 2.23 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.57 0.00 0.00 0.00 0.00 0.00 2.36 2.45 0.00 40 Q 8.31 3.98 0.00 2.30 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.57 0.00 0.00 0.00 0.00 0.00 2.38 2.58 0.00 41 Q 8.08 3.95 0.00 2.18 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.58 0.00 42 Q 8.10 3.99 0.00 2.31 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.58 0.00 0.00 0.00 0.00 0.00 2.38 2.63 0.00 43 L 8.27 4.01 0.00 1.82 1.71 0.92 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 44 L 8.22 3.95 0.00 1.81 1.89 0.91 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 45 D 8.30 4.33 0.00 2.89 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 46 V 7.81 3.56 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 0.88 0.00 0.00 0.93 0.00 0.00 47 V 7.94 3.84 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 0.77 0.00 0.00 1.01 0.00 0.00 48 K 8.32 3.98 0.00 1.96 1.85 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.64 7.81 49 R 8.00 4.15 0.00 1.98 1.97 0.00 3.29 0.00 0.00 3.29 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.81 0.00 50 Q 8.68 4.04 0.00 2.24 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.49 0.00 51 Q 8.28 4.01 0.00 2.25 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 2.34 2.44 0.00 52 E 8.17 4.06 0.00 2.23 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 2.32 2.43 0.00 53 L 8.09 4.02 0.00 1.78 1.83 0.95 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 54 L 8.37 4.05 0.00 2.01 1.73 0.96 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 55 R 8.49 4.00 0.00 2.01 2.03 0.00 3.13 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.94 0.00 56 L 8.16 4.17 0.00 1.93 1.77 0.90 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 57 T 8.16 4.06 4.51 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 1.32 0.00 0.00 58 V 8.41 3.85 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 1.15 0.00 0.00 1.07 0.00 0.00 59 W 8.60 4.31 0.00 3.52 3.42 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 60 G 8.67 3.59 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 61 T 8.31 3.84 4.64 0.00 0.00 0.00 0.00 0.00 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 62 K 8.25 3.78 0.00 1.78 1.79 0.00 1.81 0.00 0.00 1.71 0.00 0.00 3.48 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.93 2.06 7.81 63 N 7.53 3.86 0.00 1.45 2.17 0.00 0.00 7.28 6.26 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 64 L 7.76 3.77 0.00 1.67 1.53 0.88 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 65 Q 7.78 3.32 0.00 0.93 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.80 0.00 0.00 0.00 0.00 0.00 1.35 1.86 0.00 66 T 7.70 3.65 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 1.09 0.00 0.00 67 R 7.76 3.86 0.00 1.73 1.86 0.00 3.04 0.00 0.00 3.19 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.56 0.00 68 V 8.04 3.51 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 1.02 0.00 0.00 0.83 0.00 0.00 69 T 8.09 3.99 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 1.11 0.00 0.00 70 A 7.85 3.93 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 71 I 7.73 3.58 1.91 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.63 0.89 0.00 0.00 72 E 8.21 3.50 0.00 2.10 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 2.56 2.46 0.00 73 K 7.98 3.77 0.00 1.75 1.87 0.00 1.60 0.00 0.00 1.53 0.00 0.00 2.87 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.47 1.37 7.81 74 Y 8.07 3.93 0.00 3.04 3.02 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 0.00 0.00 0.00 75 L 7.94 3.63 0.00 0.69 1.24 0.97 0.71 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 76 K 6.97 3.68 0.00 1.16 1.62 0.00 1.74 0.00 0.00 1.63 0.00 0.00 3.00 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.39 1.56 7.81 77 D 7.97 4.26 0.00 2.70 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 78 Q 7.88 3.78 0.00 1.72 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 1.64 1.50 0.00 79 A 7.99 4.01 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 80 Q 8.22 4.01 0.00 2.24 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.75 0.00 0.00 0.00 0.00 0.00 2.44 2.60 0.00 81 L 8.28 4.01 0.00 1.75 1.83 0.86 0.50 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 82 N 8.69 4.40 0.00 2.81 2.88 0.00 0.00 6.92 6.78 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 83 A 8.28 4.01 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 84 W 8.79 4.27 0.00 3.58 3.46 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 85 G 8.86 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 0.00 0.00 0.00 86 A 8.13 4.15 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 87 A 7.26 3.75 0.58 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 88 F 7.17 4.44 0.00 2.06 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 89 R 8.15 3.87 0.00 1.88 2.05 0.00 3.09 0.00 0.00 3.12 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.73 0.00 90 Q 7.61 4.34 0.00 1.91 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.76 0.00 0.00 0.00 0.00 0.00 2.29 2.27 0.00 91 V 7.01 3.15 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 0.89 0.00 0.00 0.98 0.00 0.00 *94 T 7.49 4.32 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 95 T 7.57 4.57 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 1.24 0.00 0.00 96 V 8.30 3.74 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 0.82 0.00 0.00 0.96 0.00 0.00 97 P 0.00 4.31 0.00 2.10 2.04 0.00 3.75 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.12 0.00 98 W 8.83 4.34 0.00 3.31 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 99 P 0.00 4.31 0.00 1.98 1.97 0.00 2.32 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.56 0.00 100 N 7.00 4.35 0.00 2.80 2.89 0.00 0.00 6.89 7.35 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 0.00 101 A 8.42 4.17 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 0.00 102 S 9.12 4.09 0.00 3.88 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 0.00 103 L 7.91 4.42 0.00 1.61 1.64 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 104 T 8.42 4.29 4.42 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 1.36 0.00 0.00 105 P 0.00 4.35 0.00 2.21 2.13 0.00 3.79 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 2.18 2.23 0.00 106 K 8.13 3.99 0.00 1.89 2.05 0.00 1.77 0.00 0.00 1.80 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.61 1.58 7.81 107 W 8.40 4.45 0.00 3.46 3.43 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 0.00 108 N 8.81 4.14 0.00 2.78 2.95 0.00 0.00 6.88 6.74 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 0.00 109 N 8.55 4.37 0.00 2.97 3.03 0.00 0.00 7.28 7.91 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 0.00 110 E 8.64 4.07 0.00 2.22 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 0.00 2.43 2.73 0.00 111 T 8.26 3.89 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 0.96 0.00 0.00 112 W 8.57 4.08 0.00 3.48 3.25 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 0.00 113 Q 8.54 4.17 0.00 2.40 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.82 0.00 0.00 0.00 0.00 0.00 2.49 2.61 0.00 114 E 8.35 3.96 0.00 2.14 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 0.00 2.32 2.36 0.00 115 W 8.36 4.11 0.00 3.10 3.19 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 0.00 116 E 8.78 3.96 0.00 2.59 2.28 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 2.43 2.60 0.00 117 R 8.11 3.95 0.00 2.09 1.97 0.00 3.20 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 1.69 1.96 0.00 118 K 8.04 3.92 0.00 1.77 1.72 0.00 1.60 0.00 0.00 1.49 0.00 0.00 2.83 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.35 1.50 7.81 119 V 7.66 3.30 1.62 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 0.85 0.00 0.00 -0.42 0.00 0.00 120 D 8.40 4.31 0.00 2.90 2.72 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 0.00 0.00 0.00 121 F 8.26 4.09 0.00 3.10 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 0.00 122 L 8.20 3.92 0.00 1.83 1.68 0.93 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 123 E 8.47 3.91 0.00 1.94 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 2.30 2.39 0.00 124 E 8.13 3.85 0.00 2.11 1.89 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 2.22 2.24 0.00 125 N 8.01 4.06 0.00 2.11 2.56 0.00 0.00 7.24 8.49 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 0.00 126 I 8.22 3.65 1.86 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 1.49 0.46 0.95 0.00 0.00 127 T 7.95 3.80 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 1.18 0.00 0.00 128 A 8.02 3.99 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 0.00 129 L 8.11 3.98 0.00 1.81 1.70 0.89 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 130 L 8.17 3.98 0.00 1.81 1.69 0.90 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 131 E 8.23 3.95 0.00 2.16 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 2.31 2.60 0.00 132 E 8.33 3.95 0.00 2.16 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 2.31 2.50 0.00 133 A 8.25 3.97 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 0.00 134 Q 8.26 3.89 0.00 2.17 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.75 0.00 0.00 0.00 0.00 0.00 2.35 2.54 0.00 135 I 7.81 3.68 1.99 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 1.39 0.67 0.89 0.00 0.00 136 Q 8.34 3.99 0.00 2.15 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.41 0.00 137 Q 8.41 3.95 0.00 2.32 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.58 0.00 0.00 0.00 0.00 0.00 2.48 2.46 0.00 138 E 8.26 3.99 0.00 2.21 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 2.53 0.00 139 K 8.24 3.99 0.00 1.97 1.87 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.62 7.81 140 N 8.47 4.35 0.00 2.90 2.88 0.00 0.00 6.67 8.48 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 0.00 141 M 8.39 4.05 0.00 2.16 2.08 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.61 0.00 142 Y 8.27 4.03 0.00 3.19 3.15 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 0.00 143 E 8.59 3.99 0.00 2.21 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 2.71 2.54 0.00 144 L 8.36 3.93 0.00 1.76 1.87 0.94 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 145 Q 8.19 4.07 0.00 2.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.70 0.00 0.00 0.00 0.00 0.00 2.36 2.47 0.00 146 K 7.59 4.09 0.00 1.87 1.77 0.00 1.09 0.00 0.00 1.73 0.00 0.00 2.83 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.28 1.39 7.81 147 L 7.67 4.00 0.00 1.64 1.92 0.91 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 148 N 7.55 4.69 0.00 2.92 2.89 0.00 0.00 6.79 7.52 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 0.00 149 S 7.75 4.21 0.00 4.07 3.68 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 * Residues marked with a * may have inaccurate shift predictions.