NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 Q 4.2966 8.3444 121.7205 55.9190 30.2590 173.8315 2 V 4.3590 8.2938 124.3489 61.4505 33.2572 173.3142 3 Q 4.6655 9.9812 127.6563 54.1127 32.0678 174.2609 4 L 4.6193 8.6517 124.7608 53.7849 42.5574 176.6321 5 V 4.1234 8.6045 126.2368 61.7491 32.3559 174.7709 6 E 5.2696 8.7768 127.9059 55.6344 31.4397 175.4551 7 S 4.4787 9.1633 116.4929 58.2428 67.2389 173.9752 8 G 3.8896 8.5280 106.1629 45.7374 0.0000 172.7263 9 G 3.5317 7.6349 108.7818 44.5787 0.0000 170.5445 10 G 3.7649 8.0251 104.1573 43.8470 0.0000 171.7655 11 L 5.1222 8.1773 121.4834 54.2568 43.3583 177.6306 12 V 4.5782 8.4265 123.6030 60.3863 35.3378 173.6875 13 Q 4.5733 8.8899 120.3026 54.6611 30.1056 175.6485 14 A 4.2549 8.4298 125.7044 54.2470 18.7843 178.4507 15 G 3.9295 9.6091 112.0892 45.1321 0.0000 173.9471 16 G 3.9828 7.8713 108.7693 44.5110 0.0000 172.5719 17 S 4.9600 8.1872 113.5802 56.7243 66.2583 173.5815 18 L 4.6797 7.9148 121.2284 53.1466 45.8284 175.4013 19 R 4.6853 8.1598 119.8512 54.5682 33.2747 174.1605 20 L 5.0605 8.3141 124.9596 53.1552 44.7032 175.6425 21 S 5.3635 9.0087 116.7760 57.3476 67.7639 172.2993 22 C 5.4513 8.9689 121.3535 55.2929 48.7702 172.6197 23 A 5.2579 8.6970 125.8229 50.1982 22.2775 175.0441 24 A 4.8300 9.0469 125.7752 51.6613 19.5575 176.9782 25 S 4.7025 9.6196 117.0197 57.8565 65.8445 175.4077 26 G 3.9580 9.4345 110.6337 45.2408 0.0000 172.2298 27 Y 4.6175 7.7417 121.2187 55.8292 39.8130 175.8135 28 A 3.5264 7.7435 129.5146 53.4775 19.3002 176.2049 29 Y 4.7345 5.4060 113.5588 56.6359 40.3144 174.2378 30 T 4.7953 8.4306 118.1348 62.7213 71.0941 173.2189 31 Y 4.5364 9.2743 125.5910 57.8366 38.7256 175.9472 32 I 3.8231 8.8725 126.1953 64.2389 37.1932 175.5967 33 Y 4.6542 7.7573 116.4011 55.9887 40.6713 173.7777 *35 G 3.7844 8.0061 106.4279 46.2499 0.0000 171.2689 36 W 5.4646 9.0669 118.5825 54.8894 32.4897 175.3534 37 F 5.4969 9.7785 122.3964 55.8477 42.8791 174.1100 38 R 5.1521 9.1280 115.5619 54.9599 33.3304 173.8314 39 Q 4.7526 9.2450 121.5997 54.4761 32.2490 174.4430 40 A 4.7440 8.5629 129.1287 50.1381 20.2745 174.4352 41 P 4.3730 0.0000 0.0000 64.3982 31.7059 177.3929 42 G 3.9931 9.1569 110.2260 45.3593 0.0000 172.9796 43 K 4.7133 7.5142 117.0312 53.9592 35.8682 176.0753 44 E 4.1239 8.4896 120.1856 55.9024 30.0856 177.2491 45 R 4.2643 8.3292 122.3064 56.6675 30.9097 175.5567 46 E 4.9104 9.2450 121.9018 54.2855 33.3812 174.9771 47 G 3.3080 8.9090 109.1175 46.7551 0.0000 172.4439 48 V 4.4480 8.5575 123.2871 63.6417 33.5864 175.0723 49 A 5.0163 7.5549 119.4764 51.1799 22.7549 174.4295 50 A 4.6725 8.3273 121.2709 50.7935 23.6625 174.7767 *52 D 4.7776 8.7338 116.3613 53.2301 40.3503 176.5542 53 S 4.1796 8.2304 112.7555 60.2755 63.2856 175.5981 54 G 3.8470 8.1618 108.7761 45.4591 0.0000 174.4926 55 G 3.8848 8.4578 108.1836 45.2667 0.0000 173.6119 56 G 4.2012 8.0264 109.3346 44.5939 0.0000 173.9951 57 G 4.0315 8.6170 107.3477 46.4427 0.0000 173.8891 58 T 4.3270 7.9167 115.9624 63.0158 69.3768 174.1999 59 L 4.8672 8.3202 124.8111 53.2646 46.1921 175.0523 60 Y 5.3162 8.4611 118.6742 55.6959 41.9778 175.2254 61 A 4.0487 9.0072 124.9765 52.1284 18.9639 178.2638 62 D 4.3041 9.0594 121.0916 57.4115 41.4034 178.7051 63 S 4.1953 7.9772 111.6582 60.0105 63.4638 174.7683 64 V 3.8026 7.4952 113.1553 60.3645 32.5106 175.7431 65 K 3.8199 7.3785 120.7267 57.7856 32.2590 178.2531 66 G 4.0148 8.5918 110.4225 45.4945 0.0000 173.9833 67 R 4.5392 7.3800 115.5469 56.7756 32.5863 176.3732 68 F 5.3096 8.1264 115.8451 56.3088 41.3652 176.0739 69 T 4.8095 8.9010 117.8962 62.0890 72.0303 172.9613 70 I 5.0428 9.2349 127.8167 60.1214 39.6258 174.6677 71 S 4.9733 9.0206 121.2464 57.3095 66.9294 172.7548 72 R 5.1251 8.4109 117.8183 54.5611 34.6212 174.6911 73 D 4.6452 8.7670 122.5541 53.7582 41.9633 176.3638 74 K 4.0997 8.8230 123.4416 58.4177 32.3614 177.2682 75 G 3.9730 9.1867 112.0425 45.3741 0.0000 172.7733 76 K 4.7062 7.7206 117.2698 54.6475 36.2028 175.9906 77 N 5.0966 8.4307 117.9895 53.3638 36.9406 174.5601 78 T 5.1635 7.5579 107.9542 60.0586 72.7781 175.2756 79 V 4.6442 7.9093 121.1011 60.8233 35.2247 172.8338 80 Y 5.4848 9.3388 119.9512 56.3750 42.7283 174.3651 81 L 4.7378 8.7561 123.3990 53.6960 45.2240 175.8700 82 Q 4.4588 8.7604 129.0800 54.9018 31.6017 173.9199 *84 D 4.5822 8.3477 119.1558 54.5140 42.0489 175.0710 85 S 3.7342 8.5957 113.1446 59.5326 60.5911 173.3303 86 L 4.4546 7.8165 118.9423 54.9066 42.5233 177.1788 87 K 4.9718 9.1662 120.6249 53.7236 35.9126 175.6000 88 P 4.3866 0.0000 0.0000 65.9668 31.3069 178.3561 89 E 4.1274 8.1338 113.7109 58.2860 29.5587 177.0775 90 D 4.7202 8.5020 118.9585 55.3817 41.4436 176.7038 91 T 4.2893 7.8859 117.0082 64.4288 68.8459 173.3948 92 A 4.3760 8.6801 126.4720 51.7823 23.8225 174.8819 93 T 4.6378 8.2046 116.5970 63.3551 69.8201 173.9291 94 Y 5.1070 9.1945 125.0423 56.7222 40.4262 174.2975 95 Y 5.3333 9.5599 121.4955 56.3234 41.4172 174.3878 96 C 3.9903 9.5357 124.8072 56.1679 44.9136 172.1051 97 A 4.5829 7.9266 125.3893 49.9951 21.5709 175.2602 98 A 4.3229 8.2433 120.7611 51.1053 22.7713 177.2412 99 G 3.9821 9.0223 109.2976 45.3074 0.0000 174.5647 100 G 3.4923 6.5317 108.2026 44.0821 0.0000 173.0732 101 Y 4.4970 7.7230 122.6444 56.9685 42.6642 174.8444 102 E 2.6147 5.9000 126.7291 57.8412 28.3378 175.3314 103 L 4.4938 8.2241 124.9700 55.4895 42.0715 176.7313 104 R 4.3669 7.8860 121.6186 54.8297 29.0620 176.0235 105 D 4.3960 9.1867 125.0618 57.3736 41.1926 179.2597 106 R 4.1371 8.1056 115.5483 58.7254 30.4407 177.5224 107 T 4.1798 8.3419 107.5993 62.4992 69.4642 173.7076 108 Y 4.5545 7.9915 121.2471 56.6378 38.8972 175.5522 109 G 4.0572 8.5806 112.2494 45.1791 0.0000 172.5686 110 Q 4.6950 7.4317 121.0189 54.0089 31.2305 174.4289 111 W 5.2130 8.6986 125.3052 54.7005 32.9848 175.4641 112 G 4.0280 9.1401 112.0902 45.9359 0.0000 173.6894 113 Q 4.3267 8.7884 118.0080 56.7997 29.1626 177.7286 114 G 3.4402 8.7209 105.3671 45.4252 0.0000 172.9879 115 T 4.6311 8.6336 118.7836 61.2629 72.3366 173.2441 116 Q 4.4345 8.7768 127.9351 56.0308 30.7957 174.5257 117 V 4.8150 8.9938 125.9808 61.3916 34.6264 174.1059 118 T 4.8108 8.8128 124.3175 61.8261 71.4864 173.0152 119 V 4.8455 8.6466 127.8864 61.3091 32.4975 175.3754 120 S 4.7913 8.9381 123.3861 57.2893 65.6533 174.5775 121 S 4.1315 8.2064 114.3519 58.7573 62.3948 173.6151 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 Q 8.34 4.30 0.00 2.07 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.75 0.00 0.00 0.00 0.00 0.00 2.29 2.40 0.00 2 V 8.29 4.36 2.32 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 1.01 0.00 0.00 1.22 0.00 0.00 3 Q 9.98 4.67 0.00 2.01 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.66 0.00 0.00 0.00 0.00 0.00 2.30 2.34 0.00 4 L 8.65 4.62 0.00 1.50 1.54 0.66 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 5 V 8.60 4.12 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 0.99 0.00 0.00 0.96 0.00 0.00 6 E 8.78 5.27 0.00 1.99 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 2.39 2.35 0.00 7 S 9.16 4.48 0.00 3.87 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 8 G 8.53 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 0.00 0.00 0.00 9 G 7.63 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.03 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 11 L 8.18 5.12 0.00 1.64 1.55 0.99 0.80 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 12 V 8.43 4.58 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 0.62 0.00 0.00 0.95 0.00 0.00 13 Q 8.89 4.57 0.00 2.07 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.07 0.00 0.00 0.00 0.00 0.00 2.44 2.26 0.00 14 A 8.43 4.25 1.29 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 0.00 0.00 0.00 0.00 0.00 0.00 15 G 9.61 3.93 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 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.87 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 17 S 8.19 4.96 0.00 3.76 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 18 L 7.91 4.68 0.00 1.31 1.28 0.81 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 19 R 8.16 4.69 0.00 1.86 1.64 0.00 3.08 0.00 0.00 3.28 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.65 0.00 20 L 8.31 5.06 0.00 0.48 0.69 -0.06 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 21 S 9.01 5.36 0.00 3.88 3.96 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 0.00 0.00 0.00 22 C 8.97 5.45 0.00 2.92 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 23 A 8.70 5.26 1.23 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 0.00 0.00 0.00 24 A 9.05 4.83 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 25 S 9.62 4.70 0.00 3.86 3.97 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 26 G 9.43 3.96 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 0.00 0.00 0.00 0.00 0.00 0.00 27 Y 7.74 4.62 0.00 3.00 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 A 7.74 3.53 0.36 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 29 Y 5.41 4.73 0.00 2.29 2.64 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 0.00 30 T 8.43 4.80 4.29 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 0.00 0.00 0.00 1.33 0.00 0.00 31 Y 9.27 4.54 0.00 2.96 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 32 I 8.87 3.82 1.97 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.75 0.92 0.00 0.00 33 Y 7.76 4.65 0.00 3.16 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 *35 G 8.01 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 36 W 9.07 5.46 0.00 3.29 3.24 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 0.00 37 F 9.78 5.50 0.00 3.30 3.12 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 38 R 9.13 5.15 0.00 0.93 1.19 0.00 2.41 0.00 0.00 2.91 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.42 0.00 39 Q 9.25 4.75 0.00 2.16 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.90 0.00 0.00 0.00 0.00 0.00 2.28 2.43 0.00 40 A 8.56 4.74 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 41 P 0.00 4.37 0.00 2.06 2.03 0.00 3.74 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 2.05 2.12 0.00 42 G 9.16 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 43 K 7.51 4.71 0.00 1.87 1.67 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.80 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.37 7.81 44 E 8.49 4.12 0.00 1.95 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 2.28 0.00 45 R 8.33 4.26 0.00 1.64 1.73 0.00 2.80 0.00 0.00 2.67 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.79 0.00 46 E 9.25 4.91 0.00 2.05 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 2.34 2.27 0.00 47 G 8.91 3.31 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 0.00 48 V 8.56 4.45 2.44 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 1.43 0.00 0.00 1.04 0.00 0.00 49 A 7.55 5.02 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 50 A 8.33 4.67 1.23 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 0.00 0.00 0.00 *52 D 8.73 4.78 0.00 2.59 1.84 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 53 S 8.23 4.18 0.00 4.04 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 0.00 54 G 8.16 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 0.00 0.00 0.00 55 G 8.46 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 0.00 0.00 0.00 56 G 8.03 4.20 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 0.00 0.00 0.00 57 G 8.62 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 0.00 0.00 0.00 58 T 7.92 4.33 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 1.02 0.00 0.00 59 L 8.32 4.87 0.00 1.50 1.37 0.91 0.59 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 60 Y 8.46 5.32 0.00 2.82 2.76 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 61 A 9.01 4.05 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 62 D 9.06 4.30 0.00 2.68 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 63 S 7.98 4.20 0.00 3.94 3.93 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 0.00 0.00 0.00 64 V 7.50 3.80 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 0.29 0.00 0.00 0.97 0.00 0.00 65 K 7.38 3.82 0.00 1.73 1.63 0.00 1.70 0.00 0.00 1.67 0.00 0.00 3.08 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.59 7.81 66 G 8.59 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 67 R 7.38 4.54 0.00 1.75 2.28 0.00 3.31 0.00 0.00 3.19 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.50 0.00 68 F 8.13 5.31 0.00 2.74 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 69 T 8.90 4.81 4.29 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 0.00 0.00 0.00 1.31 0.00 0.00 70 I 9.23 5.04 2.01 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.25 0.84 0.00 0.00 71 S 9.02 4.97 0.00 4.02 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 72 R 8.41 5.13 0.00 1.71 1.86 0.00 3.21 0.00 0.00 3.39 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.71 0.00 73 D 8.77 4.65 0.00 2.67 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.82 4.10 0.00 1.77 1.80 0.00 1.80 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.47 1.49 7.81 75 G 9.19 3.97 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 0.00 0.00 0.00 76 K 7.72 4.71 0.00 1.94 1.74 0.00 1.87 0.00 0.00 1.76 0.00 0.00 2.83 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.39 7.81 77 N 8.43 5.10 0.00 2.75 2.97 0.00 0.00 6.32 7.05 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 78 T 7.56 5.16 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 1.26 0.00 0.00 79 V 7.91 4.64 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 0.32 0.00 0.00 1.00 0.00 0.00 80 Y 9.34 5.48 0.00 2.95 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 81 L 8.76 4.74 0.00 0.82 0.59 1.03 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 82 Q 8.76 4.46 0.00 2.16 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.21 0.00 0.00 0.00 0.00 0.00 2.26 2.30 0.00 *84 D 8.35 4.58 0.00 2.87 2.64 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 0.00 85 S 8.60 3.73 0.00 3.99 3.90 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 86 L 7.82 4.45 0.00 1.83 1.62 0.85 1.05 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 87 K 9.17 4.97 0.00 1.85 1.82 0.00 1.87 0.00 0.00 1.64 0.00 0.00 2.87 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.35 1.54 7.81 88 P 0.00 4.39 0.00 2.19 2.14 0.00 3.61 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 2.13 2.12 0.00 89 E 8.13 4.13 0.00 2.09 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 0.00 2.30 2.28 0.00 90 D 8.50 4.72 0.00 2.93 3.05 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 91 T 7.89 4.29 4.36 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 1.29 0.00 0.00 92 A 8.68 4.38 1.09 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 0.00 0.00 93 T 8.20 4.64 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 0.75 0.00 0.00 94 Y 9.19 5.11 0.00 2.91 3.10 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 0.00 0.00 0.00 95 Y 9.56 5.33 0.00 3.30 3.22 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 96 C 9.54 3.99 0.00 1.90 2.69 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.93 4.58 -0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.24 4.32 0.02 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 0.00 0.00 99 G 9.02 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 0.00 100 G 6.53 3.49 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 0.00 0.00 0.00 101 Y 7.72 4.50 0.00 2.77 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 0.00 102 E 5.90 2.61 0.00 1.42 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 1.47 1.47 0.00 103 L 8.22 4.49 0.00 1.54 1.54 0.84 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 104 R 7.89 4.37 0.00 1.94 1.95 0.00 3.23 0.00 0.00 3.16 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.64 0.00 105 D 9.19 4.40 0.00 2.94 2.76 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 0.00 106 R 8.11 4.14 0.00 1.89 2.02 0.00 3.25 0.00 0.00 3.29 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 107 T 8.34 4.18 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 1.26 0.00 0.00 108 Y 7.99 4.55 0.00 2.81 2.20 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 0.00 109 G 8.58 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 0.00 0.00 0.00 110 Q 7.43 4.69 0.00 2.02 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.71 0.00 0.00 0.00 0.00 0.00 2.13 2.21 0.00 111 W 8.70 5.21 0.00 3.09 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 0.00 112 G 9.14 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 0.00 0.00 0.00 113 Q 8.79 4.33 0.00 2.12 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.43 0.00 0.00 0.00 0.00 0.00 2.43 2.42 0.00 114 G 8.72 3.44 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 0.00 115 T 8.63 4.63 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 1.23 0.00 0.00 116 Q 8.78 4.43 0.00 2.19 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.85 0.00 0.00 0.00 0.00 0.00 2.44 2.44 0.00 117 V 8.99 4.82 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 0.83 0.00 0.00 0.44 0.00 0.00 118 T 8.81 4.81 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 0.00 119 V 8.65 4.85 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 0.76 0.00 0.00 1.01 0.00 0.00 120 S 8.94 4.79 0.00 3.92 3.96 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 0.00 0.00 0.00 121 S 8.21 4.13 0.00 3.79 3.69 0.00 0.00 0.00 0.00 0.00 0.00 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.